499.9790  0.0015 -9.6804 3   60.9439 35  71510 3031710 8      18 9 9        syn-C2H3C(O)NH2, v=0
     501.4339  0.0015 -9.6779 3   60.9439 35  71510 3031710 7      18 910        syn-C2H3C(O)NH2, v=0
     665.5542  0.0015 -9.5246 3  256.9479 73  71510 303362016      371919        syn-C2H3C(O)NH2, v=0
     665.5542  0.0015 -9.5246 3  256.9479 73  71510 303362017      371918        syn-C2H3C(O)NH2, v=0
     732.3882  0.0029 -9.8813 3  158.3887 69  71510 30334 628      33 925        syn-C2H3C(O)NH2, v=0
     905.5775  0.0015 -9.3273 3  314.3624 83  71510 303412120      402219        syn-C2H3C(O)NH2, v=0
     905.5775  0.0015 -9.3273 3  314.3624 83  71510 303412121      402218        syn-C2H3C(O)NH2, v=0
     993.5961  0.0031 -9.8296 3  673.1768121  71510 303603129      593228        syn-C2H3C(O)NH2, v=0
     993.5961  0.0031 -9.8296 3  673.1768121  71510 303603130      593227        syn-C2H3C(O)NH2, v=0
    1033.1509  0.0016 -9.0147 3   90.3957 45  71510 303221112      2112 9        syn-C2H3C(O)NH2, v=0
    1033.2914  0.0016 -9.0145 3   90.3957 45  71510 303221111      211210        syn-C2H3C(O)NH2, v=0
    1125.7951  0.0020 -9.5005 3  134.2277 63  71510 30331 625      30 922        syn-C2H3C(O)NH2, v=0
    1161.9180  0.0051 -9.5440 3  104.5880 57  71510 30328 524      27 621        syn-C2H3C(O)NH2, v=0
    1260.6180  0.0014 -8.9089 3   48.3743 31  71510 30315 9 7      16 8 8        syn-C2H3C(O)NH2, v=0
    1265.2117  0.0014 -8.9057 3   48.3742 31  71510 30315 9 6      16 8 9        syn-C2H3C(O)NH2, v=0
    1365.9550  0.0041 -9.4749 3  237.4683 85  71510 30342 835      41 932        syn-C2H3C(O)NH2, v=0
    1428.1976  0.0021 -9.3033 3  547.4165107  71510 303532924      542827        syn-C2H3C(O)NH2, v=0
    1428.1976  0.0021 -9.3033 3  547.4165107  71510 303532925      542826        syn-C2H3C(O)NH2, v=0
    1447.6583  0.0015 -8.8213 3  230.3932 69  71510 303341915      351818        syn-C2H3C(O)NH2, v=0
    1447.6583  0.0015 -8.8213 3  230.3932 69  71510 303341916      351817        syn-C2H3C(O)NH2, v=0
    1635.3462  0.0031 -9.3202 3  275.0832 91  71510 30345 837      441134        syn-C2H3C(O)NH2, v=0
    1694.6235  0.0015 -8.8246 3  345.2252 87  71510 303432221      422320        syn-C2H3C(O)NH2, v=0
    1694.6235  0.0015 -8.8246 3  345.2252 87  71510 303432222      422319        syn-C2H3C(O)NH2, v=0
    1804.0379  0.0016 -8.5244 3  107.2861 49  71510 303241213      231310        syn-C2H3C(O)NH2, v=0
    1804.0810  0.0016 -8.5244 3  107.2861 49  71510 303241212      231311        syn-C2H3C(O)NH2, v=0
    1806.7338  0.0039 -9.3878 3  717.9568125  71510 303623230      613329        syn-C2H3C(O)NH2, v=0
    1806.7338  0.0039 -9.3878 3  717.9568125  71510 303623231      613328        syn-C2H3C(O)NH2, v=0
    1924.3655  0.0007 -8.7793 3    8.9040 15  71510 303 7 3 5       6 4 2        syn-C2H3C(O)NH2, v=0
    1941.7147  0.0043 -9.6400 3  572.2407131  71510 303651253      641550        syn-C2H3C(O)NH2, v=0
    1978.6904  0.0112 -9.7318 3  945.9497141  71510 303703832      713735        syn-C2H3C(O)NH2, v=0
    1978.6904  0.0112 -9.7318 3  945.9497141  71510 303703833      713734        syn-C2H3C(O)NH2, v=0
    1995.0381  0.0040 -9.3880 3  423.7272113  71510 303561146      551243        syn-C2H3C(O)NH2, v=0
    2013.7876  0.0013 -8.5457 3   37.2541 27  71510 30313 8 6      14 7 7        syn-C2H3C(O)NH2, v=0
    2028.0466  0.0013 -8.5396 3   37.2537 27  71510 30313 8 5      14 7 8        syn-C2H3C(O)NH2, v=0
    2227.4418  0.0015 -8.4235 3  205.2845 65  71510 303321814      331717        syn-C2H3C(O)NH2, v=0
    2227.4418  0.0015 -8.4235 3  205.2845 65  71510 303321815      331716        syn-C2H3C(O)NH2, v=0
    2229.7489  0.0019 -8.8533 3  508.3640103  71510 303512823      522726        syn-C2H3C(O)NH2, v=0
    2229.7489  0.0019 -8.8533 3  508.3640103  71510 303512824      522725        syn-C2H3C(O)NH2, v=0
    2343.3864  0.0037 -9.0847 3  297.4524 93  71510 303461036      47 939        syn-C2H3C(O)NH2, v=0
    2357.9664  0.0109 -9.8073 3  761.0227151  71510 303751561      741658        syn-C2H3C(O)NH2, v=0
    2456.4791  0.0019 -8.9063 3  154.0582 65  71510 303321023      33 726        syn-C2H3C(O)NH2, v=0
    2461.2699  0.0050 -8.9118 3  145.6064 65  71510 30332 725      33 628        syn-C2H3C(O)NH2, v=0
    2486.0209  0.0016 -8.5375 3  377.5315 91  71510 303452322      442421        syn-C2H3C(O)NH2, v=0
    2486.0209  0.0016 -8.5375 3  377.5315 91  71510 303452323      442420        syn-C2H3C(O)NH2, v=0
    2511.1172  0.0032 -9.0372 3  339.2800101  71510 30350 941      491238        syn-C2H3C(O)NH2, v=0
    2521.0544  0.0038 -9.2694 3  487.8684121  71510 303601149      591446        syn-C2H3C(O)NH2, v=0
    2537.8554  0.0011 -8.9931 3    6.2638 15  71510 303 7 1 7       6 2 4        syn-C2H3C(O)NH2, v=0
    2577.1368  0.0016 -8.2151 3  125.6246 53  71510 303261314      251411        syn-C2H3C(O)NH2, v=0
    2577.1499  0.0016 -8.2151 3  125.6246 53  71510 303261313      251412        syn-C2H3C(O)NH2, v=0
    2622.8958  0.0048 -9.1452 3  764.1732129  71510 303643331      633430        syn-C2H3C(O)NH2, v=0
    2622.8958  0.0048 -9.1452 3  764.1732129  71510 303643332      633429        syn-C2H3C(O)NH2, v=0
    2629.2935  0.0032 -8.7973 3  166.8433 69  71510 30334 926      35 629        syn-C2H3C(O)NH2, v=0
    2674.7345  0.0026 -8.7392 3  150.0866 67  71510 30333 627      32 924        syn-C2H3C(O)NH2, v=0
    2751.6433  0.0012 -8.3335 3   27.5838 23  71510 30311 7 5      12 6 6        syn-C2H3C(O)NH2, v=0
    2755.6116  0.0035 -9.0653 3  410.2116111  71510 303551045      541342        syn-C2H3C(O)NH2, v=0
    2794.9167  0.0012 -8.3199 3   27.5824 23  71510 30311 7 4      12 6 7        syn-C2H3C(O)NH2, v=0
    2805.9230  0.0091 -9.3351 3  894.4554137  71510 303683731      693634        syn-C2H3C(O)NH2, v=0
    2805.9230  0.0091 -9.3351 3  894.4554137  71510 303683732      693633        syn-C2H3C(O)NH2, v=0
    2828.8362  0.0026 -8.9871 3  263.0918 85  71510 303421330      431033        syn-C2H3C(O)NH2, v=0
    2896.3182  0.0022 -8.8543 3  226.9284 81  71510 30340 931      391228        syn-C2H3C(O)NH2, v=0
    2905.6493  0.0023 -8.6633 3  142.0310 65  71510 30332 626      31 923        syn-C2H3C(O)NH2, v=0
    2953.0618  0.0018 -8.6996 3  126.5828 59  71510 30329 921      30 624        syn-C2H3C(O)NH2, v=0
    3004.8699  0.0016 -8.1449 3  181.6220 61  71510 303301714      311615        syn-C2H3C(O)NH2, v=0
    3004.8700  0.0016 -8.1449 3  181.6220 61  71510 303301713      311616        syn-C2H3C(O)NH2, v=0
    3028.5131  0.0018 -8.5282 3  470.7521 99  71510 303492722      502625        syn-C2H3C(O)NH2, v=0
    3028.5131  0.0018 -8.5282 3  470.7521 99  71510 303492723      502624        syn-C2H3C(O)NH2, v=0
    3153.3182  0.0006 -8.6032 3    3.4322 11  71510 303 5 1 5       4 2 2        syn-C2H3C(O)NH2, v=0
    3175.6028  0.0004 -9.7870 3   31.7329 29  71510 30314 5 9      14 510        syn-C2H3C(O)NH2, v=0
    3220.7747  0.0047 -9.2479 3  588.2228131  71510 303651451      661354        syn-C2H3C(O)NH2, v=0
    3279.8041  0.0017 -8.3465 3  411.2809 95  71510 303472423      462522        syn-C2H3C(O)NH2, v=0
    3279.8041  0.0017 -8.3465 3  411.2809 95  71510 303472424      462521        syn-C2H3C(O)NH2, v=0
    3292.8254  0.0009 -8.2065 3   14.6918 19  71510 303 9 4 6       8 5 3        syn-C2H3C(O)NH2, v=0
    3352.3288  0.0016 -7.9932 3  145.4108 57  71510 303281415      271512        syn-C2H3C(O)NH2, v=0
    3352.3328  0.0016 -7.9932 3  145.4108 57  71510 303281414      271513        syn-C2H3C(O)NH2, v=0
    3365.2261  0.0005 -9.7340 3  119.3954 57  71510 30328 919      28 920        syn-C2H3C(O)NH2, v=0
    3375.2190  0.0003 -8.8044 3    1.5662  5  71510 303 2 2 0       3 1 3        syn-C2H3C(O)NH2, v=0
    3442.1388  0.0060 -8.9937 3  811.8253133  71510 303663432      653531        syn-C2H3C(O)NH2, v=0
    3442.1388  0.0060 -8.9937 3  811.8253133  71510 303663433      653530        syn-C2H3C(O)NH2, v=0
    3453.8245  0.0010 -8.2156 3   19.3642 19  71510 303 9 6 4      10 5 5        syn-C2H3C(O)NH2, v=0
    3466.1098  0.0005 -9.6856 3   68.5435 43  71510 30321 714      21 715        syn-C2H3C(O)NH2, v=0
    3581.1066  0.0010 -8.1844 3   19.3600 19  71510 303 9 6 3      10 5 6        syn-C2H3C(O)NH2, v=0
    3595.4409  0.0027 -8.6535 3   21.9732 27  71510 30313 212      12 3 9        syn-C2H3C(O)NH2, v=0
    3629.7613  0.0073 -9.0216 3  844.3943133  71510 303663630      673533        syn-C2H3C(O)NH2, v=0
    3629.7613  0.0073 -9.0216 3  844.3943133  71510 303663631      673532        syn-C2H3C(O)NH2, v=0
    3745.7104  0.0005 -9.7783 3  226.9284 79  71510 303391227      391228        syn-C2H3C(O)NH2, v=0
    3777.6187  0.0031 -8.7296 3   25.2260 27  71510 30313 310      14 213        syn-C2H3C(O)NH2, v=0
    3779.8807  0.0016 -7.9325 3  159.4064 57  71510 303281613      291514        syn-C2H3C(O)NH2, v=0
    3779.8811  0.0016 -7.9325 3  159.4064 57  71510 303281612      291515        syn-C2H3C(O)NH2, v=0
    3818.9357  0.0008 -8.5093 3    4.7119 13  71510 303 6 1 6       5 2 3        syn-C2H3C(O)NH2, v=0
    3824.5241  0.0017 -8.2702 3  434.5814 95  71510 303472621      482524        syn-C2H3C(O)NH2, v=0
    3824.5241  0.0017 -8.2702 3  434.5814 95  71510 303472622      482523        syn-C2H3C(O)NH2, v=0
    3884.9838  0.0004 -9.6798 3   19.9832 23  71510 30311 4 7      11 4 8        syn-C2H3C(O)NH2, v=0
    3888.7294  0.0003 -8.4520 3    1.6738  7  71510 303 3 1 2       2 2 1        syn-C2H3C(O)NH2, v=0
    3934.2604  0.0048 -8.4842 3   70.2480 47  71510 30323 420      22 517        syn-C2H3C(O)NH2, v=0
    3961.3057  0.0035 -8.8723 3  355.9693 99  71510 303491535      501238        syn-C2H3C(O)NH2, v=0
    4070.3533  0.0008 -8.1834 3   12.5969 15  71510 303 7 5 3       8 4 4        syn-C2H3C(O)NH2, v=0
    4076.0140  0.0017 -8.2114 3  446.4726 99  71510 303492524      482623        syn-C2H3C(O)NH2, v=0
    4076.0140  0.0017 -8.2114 3  446.4726 99  71510 303492525      482622        syn-C2H3C(O)NH2, v=0
    4129.5346  0.0015 -7.8242 3  166.6445 61  71510 303301516      291613        syn-C2H3C(O)NH2, v=0
    4129.5358  0.0015 -7.8242 3  166.6445 61  71510 303301515      291614        syn-C2H3C(O)NH2, v=0
    4146.3794  0.0007 -8.1023 3    8.9029 15  71510 303 7 3 4       6 4 3        syn-C2H3C(O)NH2, v=0
    4186.1267  0.0023 -8.3661 3  108.5428 55  71510 30327 820      28 523        syn-C2H3C(O)NH2, v=0
    4192.6580  0.0009 -7.9945 3   14.6914 19  71510 303 9 4 5       8 5 4        syn-C2H3C(O)NH2, v=0
    4233.8217  0.0006 -9.5873 3  154.1401 65  71510 303321022      321023        syn-C2H3C(O)NH2, v=0
    4264.5212  0.0076 -8.8957 3  860.9121137  71510 303683533      673632        syn-C2H3C(O)NH2, v=0
    4264.5212  0.0076 -8.8957 3  860.9121137  71510 303683534      673631        syn-C2H3C(O)NH2, v=0
    4293.4428  0.0010 -7.9006 3   21.9295 23  71510 30311 5 7      10 6 4        syn-C2H3C(O)NH2, v=0
    4389.8337  0.0042 -8.5047 3   47.2159 37  71510 30318 414      19 317        syn-C2H3C(O)NH2, v=0
    4402.5150  0.0026 -8.3230 3  115.5666 57  71510 30328 821      29 524        syn-C2H3C(O)NH2, v=0
    4427.7340  0.0008 -8.1111 3   12.5851 15  71510 303 7 5 2       8 4 5        syn-C2H3C(O)NH2, v=0
    4430.3474  0.0064 -9.0830 3  663.2101141  71510 303701457      691554        syn-C2H3C(O)NH2, v=0
    4438.2830  0.0019 -8.3367 3  162.4498 69  71510 30334 727      331024        syn-C2H3C(O)NH2, v=0
    4442.1411  0.0006 -8.1697 3    4.5637 11  71510 303 5 2 3       4 3 2        syn-C2H3C(O)NH2, v=0
    4443.7295  0.0004 -9.6583 3   10.9244 17  71510 303 8 3 5       8 3 6        syn-C2H3C(O)NH2, v=0
    4450.2570  0.0058 -8.7582 3  795.7674129  71510 303643529      653432        syn-C2H3C(O)NH2, v=0
    4450.2570  0.0058 -8.7582 3  795.7674129  71510 303643530      653431        syn-C2H3C(O)NH2, v=0
    4493.7695  0.0005 -9.7026 3  274.0395 87  71510 303431330      431331        syn-C2H3C(O)NH2, v=0
    4500.0270  0.0007 -8.2598 3    7.2854 11  71510 303 5 4 2       6 3 3        syn-C2H3C(O)NH2, v=0
    4542.7223  0.0006 -9.4860 3   50.6575 37  71510 30318 612      18 613        syn-C2H3C(O)NH2, v=0
    4552.3763  0.0016 -7.7635 3  138.6379 53  71510 303261512      271413        syn-C2H3C(O)NH2, v=0
    4552.3776  0.0016 -7.7635 3  138.6379 53  71510 303261511      271414        syn-C2H3C(O)NH2, v=0
    4560.2749  0.0007 -9.4795 3   95.3796 51  71510 30325 817      25 818        syn-C2H3C(O)NH2, v=0
    4617.8091  0.0017 -8.0552 3  399.8527 91  71510 303452520      462423        syn-C2H3C(O)NH2, v=0
    4617.8091  0.0017 -8.0552 3  399.8527 91  71510 303452521      462422        syn-C2H3C(O)NH2, v=0
    4624.1591  0.0011 -7.8357 3   21.9294 23  71510 30311 5 6      10 6 5        syn-C2H3C(O)NH2, v=0
    4653.3761  0.0030 -8.3106 3  207.8290 79  71510 30339 732      381029        syn-C2H3C(O)NH2, v=0
    4659.7772  0.0005 -8.5144 3    3.4322  7  71510 303 3 3 1       4 2 2        syn-C2H3C(O)NH2, v=0
    4660.0021  0.0032 -8.5430 3  351.6366101  71510 303501239      51 942        syn-C2H3C(O)NH2, v=0
    4664.5319  0.0041 -8.7920 3  414.5363109  71510 303541341      531638        syn-C2H3C(O)NH2, v=0
    4826.1604  0.0326 -9.5628 3 1264.6573163  71510 303814437      824340        syn-C2H3C(O)NH2, v=0
    4826.1604  0.0326 -9.5628 3 1264.6573163  71510 303814438      824339        syn-C2H3C(O)NH2, v=0
    4843.0915  0.0031 -8.4177 3  286.1950 91  71510 303451135      46 838        syn-C2H3C(O)NH2, v=0
    4874.6973  0.0018 -8.1135 3  483.1060103  71510 303512625      502724        syn-C2H3C(O)NH2, v=0
    4874.6973  0.0018 -8.1135 3  483.1060103  71510 303512626      502723        syn-C2H3C(O)NH2, v=0
    4900.3202  0.0022 -8.3842 3  184.1164 71  71510 303351125      36 828        syn-C2H3C(O)NH2, v=0
    4908.7092  0.0015 -7.6914 3  189.3251 65  71510 303321617      311714        syn-C2H3C(O)NH2, v=0
    4908.7096  0.0015 -7.6914 3  189.3251 65  71510 303321616      311715        syn-C2H3C(O)NH2, v=0
    4935.0972  0.0035 -8.6040 3  423.7915111  71510 303551343      561046        syn-C2H3C(O)NH2, v=0
    5000.1454  0.0039 -8.2996 3   42.7001 37  71510 30318 316      17 413        syn-C2H3C(O)NH2, v=0
    5090.1030  0.0094 -8.8335 3  911.4327141  71510 303703634      693733        syn-C2H3C(O)NH2, v=0
    5090.1030  0.0094 -8.8335 3  911.4327141  71510 303703635      693732        syn-C2H3C(O)NH2, v=0
    5138.1394  0.0012 -7.6886 3   30.6171 27  71510 30313 6 8      12 7 5        syn-C2H3C(O)NH2, v=0
    5185.8012  0.0006 -9.4745 3  193.3497 73  71510 303361125      361126        syn-C2H3C(O)NH2, v=0
    5195.1065  0.0019 -8.2591 3  193.3497 75  71510 30337 829      361126        syn-C2H3C(O)NH2, v=0
    5252.9408  0.0012 -7.6693 3   30.6170 27  71510 30313 6 7      12 7 6        syn-C2H3C(O)NH2, v=0
    5265.7469  0.0068 -8.9831 3  680.4869141  71510 303701555      711458        syn-C2H3C(O)NH2, v=0
    5267.4594  0.0046 -8.5288 3  748.5756125  71510 303623428      633331        syn-C2H3C(O)NH2, v=0
    5267.4594  0.0046 -8.5288 3  748.5756125  71510 303623429      633330        syn-C2H3C(O)NH2, v=0
    5306.4431  0.0006 -9.6510 3  325.6123 95  71510 303471433      471434        syn-C2H3C(O)NH2, v=0
    5322.2109  0.0016 -7.6266 3  119.3170 49  71510 303241411      251312        syn-C2H3C(O)NH2, v=0
    5322.2153  0.0016 -7.6266 3  119.3170 49  71510 303241410      251313        syn-C2H3C(O)NH2, v=0
    5345.2480  0.0039 -8.4188 3  351.4617103  71510 303511042      501139        syn-C2H3C(O)NH2, v=0
    5408.3869  0.0016 -7.8706 3  366.5667 87  71510 303432419      442322        syn-C2H3C(O)NH2, v=0
    5408.3869  0.0016 -7.8706 3  366.5667 87  71510 303432420      442321        syn-C2H3C(O)NH2, v=0
    5424.1613  0.0048 -8.2156 3  184.1164 75  71510 30337 731      36 828        syn-C2H3C(O)NH2, v=0
    5429.6647  0.0006 -8.1004 3    7.2546 11  71510 303 5 4 1       6 3 4        syn-C2H3C(O)NH2, v=0
    5447.4866  0.0019 -8.6308 3    9.9816 17  71510 303 8 2 6       9 1 9        syn-C2H3C(O)NH2, v=0
    5459.6088  0.0028 -8.4549 3  313.7318 95  71510 303471136      461433        syn-C2H3C(O)NH2, v=0
    5543.4877  0.0038 -8.6315 3  502.6550121  71510 303601447      611150        syn-C2H3C(O)NH2, v=0
    5566.4924  0.0036 -8.4294 3  364.1086103  71510 303511140      521043        syn-C2H3C(O)NH2, v=0
    5622.2910  0.0032 -8.2170 3  227.4710 81  71510 303401031      41 734        syn-C2H3C(O)NH2, v=0
    5673.5061  0.0277 -9.3103 3 1205.0704159  71510 303794336      804239        syn-C2H3C(O)NH2, v=0
    5673.5061  0.0277 -9.3103 3 1205.0704159  71510 303794337      804238        syn-C2H3C(O)NH2, v=0
    5675.9048  0.0019 -8.0426 3  521.1804107  71510 303532726      522825        syn-C2H3C(O)NH2, v=0
    5675.9048  0.0019 -8.0426 3  521.1804107  71510 303532727      522824        syn-C2H3C(O)NH2, v=0
    5689.8341  0.0015 -7.5854 3  213.4524 69  71510 303341718      331815        syn-C2H3C(O)NH2, v=0
    5689.8342  0.0015 -7.5854 3  213.4524 69  71510 303341717      331816        syn-C2H3C(O)NH2, v=0
    5761.9154  0.0008 -9.3195 3  126.6813 59  71510 30329 920      29 921        syn-C2H3C(O)NH2, v=0
    5762.0973  0.0007 -9.3336 3   35.4573 31  71510 30315 510      15 511        syn-C2H3C(O)NH2, v=0
    5784.7275  0.0005 -7.8127 3    5.7967 13  71510 303 6 2 5       5 3 2        syn-C2H3C(O)NH2, v=0
    5824.8934  0.0444 -9.5867 3 1072.4483179  71510 303891772      882069        syn-C2H3C(O)NH2, v=0
    5889.8812  0.0020 -8.0884 3  101.7066 53  71510 30326 819      27 522        syn-C2H3C(O)NH2, v=0
    5918.9457  0.0116 -8.7974 3  963.3860145  71510 303723735      713834        syn-C2H3C(O)NH2, v=0
    5918.9457  0.0116 -8.7974 3  963.3860145  71510 303723736      713833        syn-C2H3C(O)NH2, v=0
    5925.8209  0.0013 -7.5228 3   40.7542 31  71510 30315 7 9      14 8 6        syn-C2H3C(O)NH2, v=0
    5964.2167  0.0013 -7.5172 3   40.7541 31  71510 30315 7 8      14 8 7        syn-C2H3C(O)NH2, v=0
    6048.0912  0.0008 -9.2584 3   74.0467 45  71510 30322 715      22 716        syn-C2H3C(O)NH2, v=0
    6081.4149  0.0037 -8.3247 3  702.8197121  71510 303603327      613230        syn-C2H3C(O)NH2, v=0
    6081.4149  0.0037 -8.3247 3  702.8197121  71510 303603328      613229        syn-C2H3C(O)NH2, v=0
    6089.1724  0.0016 -7.5153 3  101.4441 45  71510 303221310      231211        syn-C2H3C(O)NH2, v=0
    6089.1870  0.0016 -7.5153 3  101.4441 45  71510 3032213 9      231212        syn-C2H3C(O)NH2, v=0
    6184.1492  0.0007 -9.6209 3  381.6453103  71510 303511536      511537        syn-C2H3C(O)NH2, v=0
    6196.2667  0.0016 -7.7094 3  334.7239 83  71510 303412318      422221        syn-C2H3C(O)NH2, v=0
    6196.2667  0.0016 -7.7094 3  334.7239 83  71510 303412319      422220        syn-C2H3C(O)NH2, v=0
    6220.7553  0.0007 -9.3903 3  237.0241 81  71510 303401228      401229        syn-C2H3C(O)NH2, v=0
    6242.4187  0.0044 -8.1423 3  193.3148 75  71510 30337 829      38 732        syn-C2H3C(O)NH2, v=0
    6261.9312  0.0030 -8.0318 3  122.7818 59  71510 30329 822      30 525        syn-C2H3C(O)NH2, v=0
    6380.0562  0.0044 -8.6549 3  588.2219131  71510 303651551      661254        syn-C2H3C(O)NH2, v=0
    6472.9116  0.0014 -7.5004 3  239.0257 73  71510 303361819      351916        syn-C2H3C(O)NH2, v=0
    6472.9117  0.0014 -7.5004 3  239.0257 73  71510 303361818      351917        syn-C2H3C(O)NH2, v=0
    6479.6914  0.0021 -7.9926 3  560.6951111  71510 303552827      542926        syn-C2H3C(O)NH2, v=0
    6479.6914  0.0021 -7.9926 3  560.6951111  71510 303552828      542925        syn-C2H3C(O)NH2, v=0
    6517.0037  0.0233 -9.0813 3 1146.9108155  71510 303774235      784138        syn-C2H3C(O)NH2, v=0
    6517.0037  0.0233 -9.0813 3 1146.9108155  71510 303774236      784137        syn-C2H3C(O)NH2, v=0
    6695.9589  0.0014 -7.3859 3   52.3407 35  71510 30317 810      16 9 7        syn-C2H3C(O)NH2, v=0
    6708.4683  0.0014 -7.3843 3   52.3406 35  71510 30317 8 9      16 9 8        syn-C2H3C(O)NH2, v=0
    6723.0333  0.0049 -8.0898 3   75.9452 47  71510 30323 518      24 421        syn-C2H3C(O)NH2, v=0
    6751.1120  0.0142 -8.7815 3 1016.7712149  71510 303743836      733935        syn-C2H3C(O)NH2, v=0
    6751.1120  0.0142 -8.7815 3 1016.7712149  71510 303743837      733934        syn-C2H3C(O)NH2, v=0
    6757.1716  0.0004 -8.2113 3    3.3627  7  71510 303 3 3 0       4 2 3        syn-C2H3C(O)NH2, v=0
    6801.4496  0.0454 -9.4519 3 1072.4160179  71510 303891872      881969        syn-C2H3C(O)NH2, v=0
    6852.9544  0.0016 -7.4260 3   85.0194 41  71510 3032012 9      211110        syn-C2H3C(O)NH2, v=0
    6853.0020  0.0016 -7.4260 3   85.0194 41  71510 3032012 8      211111        syn-C2H3C(O)NH2, v=0
    6871.7820  0.0047 -8.5409 3  572.0779131  71510 303651353      641450        syn-C2H3C(O)NH2, v=0
    6874.8239  0.0281 -9.2222 3  955.8425169  71510 303841668      831965        syn-C2H3C(O)NH2, v=0
    6892.1667  0.0030 -8.1402 3  658.5007117  71510 303583226      593129        syn-C2H3C(O)NH2, v=0
    6892.1667  0.0030 -8.1402 3  658.5007117  71510 303583227      593128        syn-C2H3C(O)NH2, v=0
    6981.4453  0.0015 -7.5670 3  304.3250 79  71510 303392217      402120        syn-C2H3C(O)NH2, v=0
    6981.4453  0.0015 -7.5670 3  304.3250 79  71510 303392218      402119        syn-C2H3C(O)NH2, v=0
    6988.0356  0.0007 -9.2434 3   22.9439 25  71510 30312 4 8      12 4 9        syn-C2H3C(O)NH2, v=0
    7044.4565  0.0117 -8.9084 3  779.4426151  71510 303751659      761562        syn-C2H3C(O)NH2, v=0
    7068.6992  0.0009 -9.1960 3  162.4498 67  71510 303331023      331024        syn-C2H3C(O)NH2, v=0
    7134.3752  0.0033 -7.9626 3  175.4687 71  71510 30335 927      36 630        syn-C2H3C(O)NH2, v=0
    7249.4401  0.0001 -9.4712 3    0.0000  3  71510 303 1 0 1       0 0 0        syn-C2H3C(O)NH2, v=0
    7257.9594  0.0014 -7.4325 3  266.0447 77  71510 303381919      372018        syn-C2H3C(O)NH2, v=0
    7257.9594  0.0014 -7.4325 3  266.0447 77  71510 303381920      372017        syn-C2H3C(O)NH2, v=0
    7286.1147  0.0024 -7.9594 3  601.6493115  71510 303572928      563027        syn-C2H3C(O)NH2, v=0
    7286.1147  0.0024 -7.9594 3  601.6493115  71510 303572929      563026        syn-C2H3C(O)NH2, v=0
    7338.5603  0.0008 -9.3311 3  285.1624 89  71510 303441331      441332        syn-C2H3C(O)NH2, v=0
    7356.7067  0.0195 -8.8707 3 1090.1795151  71510 303754134      764037        syn-C2H3C(O)NH2, v=0
    7356.7067  0.0195 -8.8707 3 1090.1795151  71510 303754135      764036        syn-C2H3C(O)NH2, v=0
    7360.9884  0.0065 -8.6926 3  680.4863141  71510 303701655      711358        syn-C2H3C(O)NH2, v=0
    7430.9417  0.0031 -7.9670 3  264.0289 89  71510 30344 836      431133        syn-C2H3C(O)NH2, v=0
    7462.5587  0.0015 -7.2703 3   65.3763 39  71510 30319 911      1810 8        syn-C2H3C(O)NH2, v=0
    7466.5555  0.0015 -7.2698 3   65.3763 39  71510 30319 910      1810 9        syn-C2H3C(O)NH2, v=0
    7586.6652  0.0172 -8.7818 3 1071.5871153  71510 303763937      754036        syn-C2H3C(O)NH2, v=0
    7586.6652  0.0172 -8.7818 3 1071.5871153  71510 303763938      754035        syn-C2H3C(O)NH2, v=0
    7613.1075  0.0015 -7.3567 3   70.0433 37  71510 3031811 8      1910 9        syn-C2H3C(O)NH2, v=0
    7613.2615  0.0015 -7.3567 3   70.0433 37  71510 3031811 7      191010        syn-C2H3C(O)NH2, v=0
    7684.7249  0.0010 -9.0830 3  101.9030 53  71510 30326 818      26 819        syn-C2H3C(O)NH2, v=0
    7699.7540  0.0025 -7.9718 3  615.6193113  71510 303563125      573028        syn-C2H3C(O)NH2, v=0
    7699.7540  0.0025 -7.9718 3  615.6193113  71510 303563126      573027        syn-C2H3C(O)NH2, v=0
    7702.0458  0.0001 -7.0345 3    0.2418  3  71510 303 1 1 0       1 0 1        syn-C2H3C(O)NH2, v=0
    7763.9049  0.0015 -7.4404 3  275.3705 75  71510 303372116      382019        syn-C2H3C(O)NH2, v=0
    7763.9049  0.0015 -7.4404 3  275.3705 75  71510 303372117      382018        syn-C2H3C(O)NH2, v=0
    7799.9956  0.0010 -9.0786 3   55.3967 39  71510 30319 613      19 614        syn-C2H3C(O)NH2, v=0
    7836.6163  0.0002 -7.3972 3    0.4591  5  71510 303 2 0 2       1 1 1        syn-C2H3C(O)NH2, v=0
    7897.9667  0.0168 -8.8963 3  845.9101159  71510 303791564      781861        syn-C2H3C(O)NH2, v=0
    7953.3024  0.0006 -9.2382 3   13.1196 19  71510 303 9 3 6       9 3 7        syn-C2H3C(O)NH2, v=0
    8045.0070  0.0014 -7.3790 3  294.5089 81  71510 303402021      392118        syn-C2H3C(O)NH2, v=0
    8045.0071  0.0014 -7.3790 3  294.5089 81  71510 303402020      392119        syn-C2H3C(O)NH2, v=0
    8066.0539  0.0100 -8.8351 3  657.8120135  71510 303672048      681751        syn-C2H3C(O)NH2, v=0
    8095.2348  0.0027 -7.9402 3  644.0422119  71510 303593029      583128        syn-C2H3C(O)NH2, v=0
    8095.2348  0.0027 -7.9402 3  644.0422119  71510 303593030      583127        syn-C2H3C(O)NH2, v=0
    8163.2599  0.0029 -7.7946 3  198.2603 77  71510 30338 731      371028        syn-C2H3C(O)NH2, v=0
    8192.6667  0.0162 -8.6753 3 1034.8775147  71510 303734033      743936        syn-C2H3C(O)NH2, v=0
    8192.6667  0.0162 -8.6753 3 1034.8775147  71510 303734034      743935        syn-C2H3C(O)NH2, v=0
    8219.5691  0.0004 -9.3601 3    5.9896 13  71510 303 6 2 4       6 2 5        syn-C2H3C(O)NH2, v=0
    8230.0471  0.0015 -7.1717 3   79.8609 43  71510 303211012      2011 9        syn-C2H3C(O)NH2, v=0
    8231.3049  0.0015 -7.1716 3   79.8609 43  71510 303211011      201110        syn-C2H3C(O)NH2, v=0
    8314.7978  0.0038 -8.1945 3  437.4780113  71510 303561244      571147        syn-C2H3C(O)NH2, v=0
    8368.9454  0.0015 -7.3070 3   56.5161 33  71510 3031610 7      17 9 8        syn-C2H3C(O)NH2, v=0
    8369.4382  0.0015 -7.3069 3   56.5161 33  71510 3031610 6      17 9 9        syn-C2H3C(O)NH2, v=0
    8370.3097  0.0290 -9.0510 3  955.7931169  71510 303841768      831865        syn-C2H3C(O)NH2, v=0
    8422.1610  0.0115 -8.7535 3  779.4422151  71510 303751759      761462        syn-C2H3C(O)NH2, v=0
    8425.6696  0.0206 -8.7957 3 1127.8327157  71510 303784038      774137        syn-C2H3C(O)NH2, v=0
    8425.6696  0.0206 -8.7957 3 1127.8327157  71510 303784039      774136        syn-C2H3C(O)NH2, v=0
    8479.2176  0.0010 -9.1029 3  202.6850 75  71510 303371126      371127        syn-C2H3C(O)NH2, v=0
    8504.2114  0.0022 -7.8171 3  574.1765109  71510 303543024      552927        syn-C2H3C(O)NH2, v=0
    8504.2114  0.0022 -7.8171 3  574.1765109  71510 303543025      552926        syn-C2H3C(O)NH2, v=0
    8539.2352  0.0009 -9.2941 3  337.7635 97  71510 303481434      481435        syn-C2H3C(O)NH2, v=0
    8543.6090  0.0015 -7.3276 3  247.8610 71  71510 303352015      361918        syn-C2H3C(O)NH2, v=0
    8543.6090  0.0015 -7.3276 3  247.8610 71  71510 303352016      361917        syn-C2H3C(O)NH2, v=0
    8616.3401  0.0203 -8.9271 3  885.0832161  71510 303801763      811666        syn-C2H3C(O)NH2, v=0
    8639.8341  0.0051 -8.4154 3  462.7226113  71510 303561740      571443        syn-C2H3C(O)NH2, v=0
    8663.0410  0.0020 -7.7256 3  171.0210 71  71510 30335 728      341025        syn-C2H3C(O)NH2, v=0
    8834.0936  0.0015 -7.3378 3  324.4176 85  71510 303422121      412220        syn-C2H3C(O)NH2, v=0
    8834.0936  0.0015 -7.3378 3  324.4176 85  71510 303422122      412219        syn-C2H3C(O)NH2, v=0
    8844.2601  0.0096 -8.6080 3  742.6602149  71510 303741460      731757        syn-C2H3C(O)NH2, v=0
    8907.1141  0.0033 -7.9331 3  687.8730123  71510 303613130      603229        syn-C2H3C(O)NH2, v=0
    8907.1141  0.0033 -7.9331 3  687.8730123  71510 303613131      603228        syn-C2H3C(O)NH2, v=0
    8999.5902  0.0016 -7.0875 3   95.7942 47  71510 303231113      221210        syn-C2H3C(O)NH2, v=0
    8999.9813  0.0016 -7.0875 3   95.7942 47  71510 303231112      221211        syn-C2H3C(O)NH2, v=0
    9024.9337  0.0133 -8.4927 3  981.0061143  71510 303713932      723835        syn-C2H3C(O)NH2, v=0
    9024.9337  0.0133 -8.4927 3  981.0061143  71510 303713933      723834        syn-C2H3C(O)NH2, v=0
    9032.6103  0.0007 -7.2915 3   10.6231 17  71510 303 8 3 6       7 4 3        syn-C2H3C(O)NH2, v=0
    9038.0687  0.0001 -6.7139 3    0.7205  5  71510 303 2 1 1       2 0 2        syn-C2H3C(O)NH2, v=0
    9119.3421  0.0014 -7.2776 3   44.4381 29  71510 30314 9 6      15 8 7        syn-C2H3C(O)NH2, v=0
    9120.8985  0.0014 -7.2774 3   44.4380 29  71510 30314 9 5      15 8 8        syn-C2H3C(O)NH2, v=0
    9203.8323  0.0032 -7.8672 3  326.9804 99  71510 30349 940      481237        syn-C2H3C(O)NH2, v=0
    9251.6119  0.0040 -7.8455 3  285.8915 93  71510 30346 938      451035        syn-C2H3C(O)NH2, v=0
    9268.1903  0.0246 -8.8212 3 1185.5070161  71510 303804139      794238        syn-C2H3C(O)NH2, v=0
    9268.1903  0.0246 -8.8212 3 1185.5070161  71510 303804140      794237        syn-C2H3C(O)NH2, v=0
    9305.5680  0.0020 -7.6742 3  534.1730105  71510 303522923      532826        syn-C2H3C(O)NH2, v=0
    9305.5680  0.0020 -7.6742 3  534.1730105  71510 303522924      532825        syn-C2H3C(O)NH2, v=0
    9320.4984  0.0015 -7.2272 3  221.7970 67  71510 303331914      341817        syn-C2H3C(O)NH2, v=0
    9320.4984  0.0015 -7.2272 3  221.7970 67  71510 303331915      341816        syn-C2H3C(O)NH2, v=0
    9387.6880  0.0071 -8.5226 3  600.0899131  71510 303651649      641946        syn-C2H3C(O)NH2, v=0
    9441.1343  0.0052 -7.6884 3  137.4916 65  71510 30332 627      31 724        syn-C2H3C(O)NH2, v=0
    9448.4825  0.0012 -8.9476 3  134.2277 61  71510 30330 921      30 922        syn-C2H3C(O)NH2, v=0
    9491.0695  0.0032 -7.6953 3  130.1913 61  71510 30330 823      31 526        syn-C2H3C(O)NH2, v=0
    9516.0256  0.0199 -8.8410 3  885.0829161  71510 303801863      811566        syn-C2H3C(O)NH2, v=0
    9569.4087  0.0019 -7.7429 3  119.0762 57  71510 30328 920      29 623        syn-C2H3C(O)NH2, v=0
    9600.8225  0.0022 -7.6677 3   18.8439 25  71510 30312 211      11 3 8        syn-C2H3C(O)NH2, v=0
    9625.2651  0.0015 -7.3074 3  355.7704 89  71510 303442222      432321        syn-C2H3C(O)NH2, v=0
    9625.2651  0.0015 -7.3074 3  355.7704 89  71510 303442223      432320        syn-C2H3C(O)NH2, v=0
    9645.3331  0.0057 -8.3582 3  646.1020139  71510 303691356      681653        syn-C2H3C(O)NH2, v=0
    9699.5628  0.0010 -8.9502 3   39.4296 33  71510 30316 511      16 512        syn-C2H3C(O)NH2, v=0
    9721.8164  0.0040 -7.9364 3  733.1410127  71510 303633231      623330        syn-C2H3C(O)NH2, v=0
    9721.8164  0.0040 -7.9364 3  733.1410127  71510 303633232      623329        syn-C2H3C(O)NH2, v=0
    9768.6053  0.0038 -7.8117 3  247.7485 85  71510 30342 933      43 836        syn-C2H3C(O)NH2, v=0
    9771.3563  0.0016 -7.0159 3  113.1758 51  71510 303251214      241311        syn-C2H3C(O)NH2, v=0
    9771.4767  0.0016 -7.0159 3  113.1758 51  71510 303251213      241312        syn-C2H3C(O)NH2, v=0
    9776.7385  0.0018 -7.6924 3   95.0534 51  71510 30325 818      26 521        syn-C2H3C(O)NH2, v=0
    9784.5116  0.0044 -8.0889 3  487.6286121  71510 303601249      591346        syn-C2H3C(O)NH2, v=0
    9822.8430  0.0011 -9.2774 3  394.8256105  71510 303521537      521538        syn-C2H3C(O)NH2, v=0
    9853.5559  0.0109 -8.3213 3  928.5661139  71510 303693831      703734        syn-C2H3C(O)NH2, v=0
    9853.5559  0.0109 -8.3213 3  928.5661139  71510 303693832      703733        syn-C2H3C(O)NH2, v=0
    9862.2496  0.0013 -7.2711 3   33.8094 25  71510 30312 8 5      13 7 6        syn-C2H3C(O)NH2, v=0
    9867.0830  0.0013 -7.2707 3   33.8092 25  71510 30312 8 4      13 7 7        syn-C2H3C(O)NH2, v=0
    9988.9489  0.0012 -8.8844 3   79.8045 47  71510 30323 716      23 717        syn-C2H3C(O)NH2, v=0
    9992.5772  0.0010 -9.0359 3  247.3863 83  71510 303411229      411230        syn-C2H3C(O)NH2, v=0
    9996.6524  0.0050 -7.7314 3  111.4100 57  71510 30328 622      29 525        syn-C2H3C(O)NH2, v=0
   10023.8582  0.0332 -9.0048 3  997.4015171  71510 303851867      861770        syn-C2H3C(O)NH2, v=0
   10094.4846  0.0016 -7.1382 3  197.1790 63  71510 303311813      321716        syn-C2H3C(O)NH2, v=0
   10094.4846  0.0016 -7.1382 3  197.1790 63  71510 303311814      321715        syn-C2H3C(O)NH2, v=0
   10103.8465  0.0019 -7.5419 3  495.6095101  71510 303502822      512725        syn-C2H3C(O)NH2, v=0
   10103.8465  0.0019 -7.5419 3  495.6095101  71510 303502823      512724        syn-C2H3C(O)NH2, v=0
   10114.2924  0.0292 -8.8569 3 1244.6089165  71510 303824240      814339        syn-C2H3C(O)NH2, v=0
   10114.2924  0.0292 -8.8569 3 1244.6089165  71510 303824241      814338        syn-C2H3C(O)NH2, v=0
   10131.4642  0.0503 -9.2457 3 1430.4681173  71510 303864739      874642        syn-C2H3C(O)NH2, v=0
   10131.4642  0.0503 -9.2457 3 1430.4681173  71510 303864740      874641        syn-C2H3C(O)NH2, v=0
   10142.6655  0.0035 -7.8892 3  396.6737109  71510 303541044      531341        syn-C2H3C(O)NH2, v=0
   10173.4853  0.0175 -8.6760 3  845.8350159  71510 303791664      781761        syn-C2H3C(O)NH2, v=0
   10209.5597  0.0026 -7.5810 3  188.9318 75  71510 30337 730      361027        syn-C2H3C(O)NH2, v=0
   10210.4559  0.0043 -8.1503 3  556.2448129  71510 303641252      631549        syn-C2H3C(O)NH2, v=0
   10418.5735  0.0016 -7.2868 3  388.5666 93  71510 303462323      452422        syn-C2H3C(O)NH2, v=0
   10418.5735  0.0016 -7.2868 3  388.5666 93  71510 303462324      452421        syn-C2H3C(O)NH2, v=0
   10423.5447  0.0038 -7.9903 3  473.0987119  71510 303591148      581445        syn-C2H3C(O)NH2, v=0
   10482.8119  0.0023 -7.5509 3  179.8500 73  71510 30336 729      351026        syn-C2H3C(O)NH2, v=0
   10539.4071  0.0050 -7.9491 3  779.8452131  71510 303653332      643431        syn-C2H3C(O)NH2, v=0
   10539.4071  0.0050 -7.9491 3  779.8452131  71510 303653333      643430        syn-C2H3C(O)NH2, v=0
   10545.2624  0.0016 -6.9554 3  132.0054 55  71510 303271315      261412        syn-C2H3C(O)NH2, v=0
   10545.2992  0.0016 -6.9554 3  132.0054 55  71510 303271314      261413        syn-C2H3C(O)NH2, v=0
   10593.4967  0.0011 -7.2931 3   24.6304 21  71510 30310 7 4      11 6 5        syn-C2H3C(O)NH2, v=0
   10608.1030  0.0327 -8.9556 3  997.4013171  71510 303851967      861670        syn-C2H3C(O)NH2, v=0
   10608.1760  0.0011 -7.2919 3   24.6299 21  71510 30310 7 3      11 6 6        syn-C2H3C(O)NH2, v=0
   10650.5783  0.0026 -7.8135 3  216.7457 77  71510 303381227      39 930        syn-C2H3C(O)NH2, v=0
   10660.4255  0.0040 -8.1094 3  517.5555123  71510 303611348      621251        syn-C2H3C(O)NH2, v=0
   10678.5789  0.0088 -8.1597 3  877.5587135  71510 303673730      683633        syn-C2H3C(O)NH2, v=0
   10678.5789  0.0088 -8.1597 3  877.5587135  71510 303673731      683632        syn-C2H3C(O)NH2, v=0
   10704.2429  0.0022 -7.5975 3   79.4475 47  71510 30323 717      24 420        syn-C2H3C(O)NH2, v=0
   10762.2156  0.0383 -9.0283 3  886.9018157  71510 303782356      792059        syn-C2H3C(O)NH2, v=0
   10776.2984  0.0006 -7.1869 3    7.2854 15  71510 303 7 2 6       6 3 3        syn-C2H3C(O)NH2, v=0
   10791.0569  0.0251 -8.8271 3  819.7767153  71510 303761957      752254        syn-C2H3C(O)NH2, v=0
   10865.4422  0.0016 -7.0600 3  174.0074 59  71510 303291713      301614        syn-C2H3C(O)NH2, v=0
   10865.4423  0.0016 -7.0600 3  174.0074 59  71510 303291712      301615        syn-C2H3C(O)NH2, v=0
   10899.0623  0.0018 -7.4191 3  458.4868 97  71510 303482721      492624        syn-C2H3C(O)NH2, v=0
   10899.0623  0.0018 -7.4191 3  458.4868 97  71510 303482722      492623        syn-C2H3C(O)NH2, v=0
   10940.0684  0.0026 -7.5755 3   85.4481 49  71510 30324 718      25 421        syn-C2H3C(O)NH2, v=0
   10964.0417  0.0343 -8.9017 3 1305.1371169  71510 303844341      834440        syn-C2H3C(O)NH2, v=0
   10964.0417  0.0343 -8.9017 3 1305.1371169  71510 303844342      834439        syn-C2H3C(O)NH2, v=0
   10989.1511  0.0435 -9.0547 3 1367.0906169  71510 303844638      854541        syn-C2H3C(O)NH2, v=0
   10989.1511  0.0435 -9.0547 3 1367.0906169  71510 303844639      854540        syn-C2H3C(O)NH2, v=0
   10996.2316  0.0009 -7.0408 3   16.9014 21  71510 30310 4 7       9 5 4        syn-C2H3C(O)NH2, v=0
   11157.8773  0.0023 -7.7138 3  274.0395 89  71510 303441034      431331        syn-C2H3C(O)NH2, v=0
   11214.0750  0.0017 -7.2749 3  422.8056 97  71510 303482424      472523        syn-C2H3C(O)NH2, v=0
   11214.0750  0.0017 -7.2749 3  422.8056 97  71510 303482425      472522        syn-C2H3C(O)NH2, v=0
   11296.0702  0.0513 -9.1253 3 1116.3899181  71510 303901971      911874        syn-C2H3C(O)NH2, v=0
   11298.6235  0.0002 -6.4378 3    1.4267  7  71510 303 3 1 2       3 0 3        syn-C2H3C(O)NH2, v=0
   11303.8396  0.0010 -7.3548 3   16.9014 17  71510 303 8 6 3       9 5 4        syn-C2H3C(O)NH2, v=0
   11321.1977  0.0015 -6.9049 3  152.2828 59  71510 303291416      281513        syn-C2H3C(O)NH2, v=0
   11321.2089  0.0015 -6.9049 3  152.2828 59  71510 303291415      281514        syn-C2H3C(O)NH2, v=0
   11336.7058  0.0013 -8.8448 3  171.0210 69  71510 303341024      341025        syn-C2H3C(O)NH2, v=0
   11347.0717  0.0010 -7.3516 3   16.9000 17  71510 303 8 6 2       9 5 5        syn-C2H3C(O)NH2, v=0
   11359.9527  0.0063 -7.9703 3  827.9847135  71510 303673433      663532        syn-C2H3C(O)NH2, v=0
   11359.9527  0.0063 -7.9703 3  827.9847135  71510 303673434      663531        syn-C2H3C(O)NH2, v=0
   11500.0456  0.0071 -8.0072 3  827.9847131  71510 303653629      663532        syn-C2H3C(O)NH2, v=0
   11500.0456  0.0071 -8.0072 3  827.9847131  71510 303653630      663531        syn-C2H3C(O)NH2, v=0
   11505.1892  0.0010 -8.8860 3   26.1464 27  71510 30313 4 9      13 410        syn-C2H3C(O)NH2, v=0
   11608.1533  0.0011 -8.9919 3  296.5528 91  71510 303451332      451333        syn-C2H3C(O)NH2, v=0
   11633.1983  0.0016 -6.9923 3  152.2828 55  71510 303271612      281513        syn-C2H3C(O)NH2, v=0
   11633.1984  0.0016 -6.9923 3  152.2828 55  71510 303271611      281514        syn-C2H3C(O)NH2, v=0
   11649.8168  0.0023 -8.1050 3   12.1035 19  71510 303 9 2 7      10 110        syn-C2H3C(O)NH2, v=0
   11673.7305  0.0508 -9.0967 3 1116.3898181  71510 303902071      911774        syn-C2H3C(O)NH2, v=0
   11691.2212  0.0017 -7.3052 3  422.8056 93  71510 303462620      472523        syn-C2H3C(O)NH2, v=0
   11691.2212  0.0017 -7.3052 3  422.8056 93  71510 303462621      472522        syn-C2H3C(O)NH2, v=0
   11798.3073  0.0031 -7.6860 3  297.4494 93  71510 303461136      47 839        syn-C2H3C(O)NH2, v=0
   11817.5043  0.0401 -8.9547 3 1367.0906173  71510 303864442      854541        syn-C2H3C(O)NH2, v=0
   11817.5043  0.0401 -8.9547 3 1367.0906173  71510 303864443      854540        syn-C2H3C(O)NH2, v=0
   11842.7164  0.0373 -8.8726 3 1305.1371165  71510 303824537      834440        syn-C2H3C(O)NH2, v=0
   11842.7164  0.0373 -8.8726 3 1305.1371165  71510 303824538      834439        syn-C2H3C(O)NH2, v=0
   11888.7518  0.0032 -7.6060 3  237.5095 83  71510 303411032      42 735        syn-C2H3C(O)NH2, v=0
   11972.3943  0.0008 -7.4831 3   10.6231 13  71510 303 6 5 2       7 4 3        syn-C2H3C(O)NH2, v=0
   12011.8295  0.0018 -7.2711 3  458.4868101  71510 303502525      492624        syn-C2H3C(O)NH2, v=0
   12011.8295  0.0018 -7.2711 3  458.4868101  71510 303502526      492623        syn-C2H3C(O)NH2, v=0
   12076.5508  0.0034 -7.8202 3   28.5619 29  71510 30314 311      15 214        syn-C2H3C(O)NH2, v=0
   12094.0893  0.0008 -7.4746 3   10.6190 13  71510 303 6 5 1       7 4 4        syn-C2H3C(O)NH2, v=0
   12099.0791  0.0015 -6.8634 3  174.0074 63  71510 303311517      301614        syn-C2H3C(O)NH2, v=0
   12099.0824  0.0015 -6.8634 3  174.0074 63  71510 303311516      301615        syn-C2H3C(O)NH2, v=0
   12137.5820  0.0032 -7.7550 3  364.1066103  71510 303511240      52 943        syn-C2H3C(O)NH2, v=0
   12155.9551  0.0032 -7.8518 3  301.7179 91  71510 303451432      461135        syn-C2H3C(O)NH2, v=0
   12172.4899  0.0023 -7.6002 3  145.6885 63  71510 303311022      32 725        syn-C2H3C(O)NH2, v=0
   12183.5205  0.0079 -7.9993 3  877.5587139  71510 303693534      683633        syn-C2H3C(O)NH2, v=0
   12183.5205  0.0079 -7.9993 3  877.5587139  71510 303693535      683632        syn-C2H3C(O)NH2, v=0
   12256.4776  0.0011 -6.8914 3   24.6304 25  71510 30312 5 8      11 6 5        syn-C2H3C(O)NH2, v=0
   12279.1911  0.0101 -8.3223 3  742.5468149  71510 303741560      731657        syn-C2H3C(O)NH2, v=0
   12288.4397  0.0019 -7.5024 3   73.6368 45  71510 30322 716      23 419        syn-C2H3C(O)NH2, v=0
   12301.4750  0.0030 -7.4943 3  253.2002 87  71510 30343 835      421132        syn-C2H3C(O)NH2, v=0
   12317.9959  0.0056 -7.8628 3  779.8452127  71510 303633528      643431        syn-C2H3C(O)NH2, v=0
   12317.9959  0.0056 -7.8628 3  779.8452127  71510 303633529      643430        syn-C2H3C(O)NH2, v=0
   12318.6720  0.0019 -7.4610 3  202.6850 77  71510 30338 830      371127        syn-C2H3C(O)NH2, v=0
   12323.3451  0.0015 -8.7349 3  108.6824 55  71510 30327 819      27 820        syn-C2H3C(O)NH2, v=0
   12397.5173  0.0016 -6.9351 3  132.0054 51  71510 303251511      261412        syn-C2H3C(O)NH2, v=0
   12397.5177  0.0016 -6.9351 3  132.0054 51  71510 303251510      261413        syn-C2H3C(O)NH2, v=0
   12480.3185  0.0017 -7.1997 3  388.5666 89  71510 303442519      452422        syn-C2H3C(O)NH2, v=0
   12480.3185  0.0017 -7.1997 3  388.5666 89  71510 303442520      452421        syn-C2H3C(O)NH2, v=0
   12529.1306  0.0034 -7.5097 3  184.2909 73  71510 30336 928      37 631        syn-C2H3C(O)NH2, v=0
   12556.3459  0.0006 -7.7616 3    5.7967  9  71510 303 4 4 1       5 3 2        syn-C2H3C(O)NH2, v=0
   12569.9969  0.0014 -8.7311 3   60.3853 41  71510 30320 614      20 615        syn-C2H3C(O)NH2, v=0
   12674.7462  0.0466 -9.0152 3 1430.4681177  71510 303884543      874642        syn-C2H3C(O)NH2, v=0
   12674.7462  0.0466 -9.0152 3 1430.4681177  71510 303884544      874641        syn-C2H3C(O)NH2, v=0
   12685.7845  0.0047 -8.1057 3  604.3358133  71510 303661452      671355        syn-C2H3C(O)NH2, v=0
   12692.2103  0.0319 -8.6987 3 1244.6089161  71510 303804436      814339        syn-C2H3C(O)NH2, v=0
   12692.2103  0.0319 -8.6987 3 1244.6089161  71510 303804437      814338        syn-C2H3C(O)NH2, v=0
   12727.7978  0.0051 -7.3968 3   97.6203 55  71510 30327 523      26 620        syn-C2H3C(O)NH2, v=0
   12742.8379  0.0029 -7.4555 3   91.6421 51  71510 30325 719      26 422        syn-C2H3C(O)NH2, v=0
   12793.3136  0.0035 -7.8217 3  437.4767113  71510 303561344      571047        syn-C2H3C(O)NH2, v=0
   12811.9001  0.0019 -7.2747 3  495.6095105  71510 303522626      512725        syn-C2H3C(O)NH2, v=0
   12811.9001  0.0019 -7.2747 3  495.6095105  71510 303522627      512724        syn-C2H3C(O)NH2, v=0
   12831.4206  0.0009 -8.9045 3   15.5495 21  71510 30310 3 7      10 3 8        syn-C2H3C(O)NH2, v=0
   12874.7339  0.0006 -7.7410 3    5.7861  9  71510 303 4 4 0       5 3 3        syn-C2H3C(O)NH2, v=0
   12877.3129  0.0035 -7.6494 3  308.9035 95  71510 303471037      48 940        syn-C2H3C(O)NH2, v=0
   12878.8578  0.0015 -6.8302 3  197.1790 67  71510 303331618      321715        syn-C2H3C(O)NH2, v=0
   12878.8588  0.0015 -6.8302 3  197.1790 67  71510 303331617      321716        syn-C2H3C(O)NH2, v=0
   12998.9205  0.0010 -6.8901 3   16.9000 21  71510 30310 4 6       9 5 5        syn-C2H3C(O)NH2, v=0
   13010.1787  0.0097 -8.0354 3  928.5661143  71510 303713635      703734        syn-C2H3C(O)NH2, v=0
   13010.1787  0.0097 -8.0354 3  928.5661143  71510 303713636      703733        syn-C2H3C(O)NH2, v=0
   13031.6381  0.0011 -6.8369 3   24.6299 25  71510 30312 5 7      11 6 6        syn-C2H3C(O)NH2, v=0
   13132.4658  0.0045 -7.7261 3  733.1410123  71510 303613427      623330        syn-C2H3C(O)NH2, v=0
   13132.4658  0.0045 -7.7261 3  733.1410123  71510 303613428      623329        syn-C2H3C(O)NH2, v=0
   13154.4095  0.0006 -9.0398 3    7.6449 15  71510 303 7 2 5       7 2 6        syn-C2H3C(O)NH2, v=0
   13158.0811  0.0016 -6.8884 3  113.1758 47  71510 303231410      241311        syn-C2H3C(O)NH2, v=0
   13158.0825  0.0016 -6.8884 3  113.1758 47  71510 3032314 9      241312        syn-C2H3C(O)NH2, v=0
   13180.2765  0.0004 -6.9894 3    2.3993  9  71510 303 4 1 3       3 2 2        syn-C2H3C(O)NH2, v=0
   13194.2301  0.0012 -6.7868 3   33.8094 29  71510 30314 6 9      13 7 6        syn-C2H3C(O)NH2, v=0
   13266.3365  0.0016 -7.1020 3  355.7704 85  71510 303422418      432321        syn-C2H3C(O)NH2, v=0
   13266.3365  0.0016 -7.1020 3  355.7704 85  71510 303422419      432320        syn-C2H3C(O)NH2, v=0
   13269.8628  0.0042 -7.6951 3  409.8648111  71510 303551145      541242        syn-C2H3C(O)NH2, v=0
   13310.9296  0.0001 -8.7685 3    0.4591  5  71510 303 2 1 2       1 1 1        syn-C2H3C(O)NH2, v=0
   13318.0523  0.0020 -7.4633 3  237.0241 83  71510 30341 932      401229        syn-C2H3C(O)NH2, v=0
   13325.4316  0.0013 -8.9686 3  350.1829 99  71510 303491435      491436        syn-C2H3C(O)NH2, v=0
   13347.5335  0.0013 -8.7694 3  212.2827 77  71510 303381127      381128        syn-C2H3C(O)NH2, v=0
   13472.8767  0.0012 -6.7684 3   33.8092 29  71510 30314 6 8      13 7 7        syn-C2H3C(O)NH2, v=0
   13530.3684  0.0047 -7.4802 3  153.6068 67  71510 30333 726      34 629        syn-C2H3C(O)NH2, v=0
   13535.8336  0.0539 -9.0827 3 1495.2684181  71510 303904644      894743        syn-C2H3C(O)NH2, v=0
   13535.8336  0.0539 -9.0827 3 1495.2684181  71510 303904645      894742        syn-C2H3C(O)NH2, v=0
   13537.6816  0.0271 -8.5322 3 1185.5070157  71510 303784335      794238        syn-C2H3C(O)NH2, v=0
   13537.6816  0.0271 -8.5322 3 1185.5070157  71510 303784336      794237        syn-C2H3C(O)NH2, v=0
   13544.7012  0.0035 -7.3249 3   38.2692 35  71510 30317 315      16 412        syn-C2H3C(O)NH2, v=0
   13597.5455  0.0009 -6.9110 3   10.6190 17  71510 303 8 3 5       7 4 4        syn-C2H3C(O)NH2, v=0
   13603.5668  0.0045 -7.4294 3  227.0250 83  71510 30341 834      40 931        syn-C2H3C(O)NH2, v=0
   13614.3517  0.0020 -7.2853 3  534.1730109  71510 303542727      532826        syn-C2H3C(O)NH2, v=0
   13614.3517  0.0020 -7.2853 3  534.1730109  71510 303542728      532825        syn-C2H3C(O)NH2, v=0
   13660.5145  0.0014 -6.8047 3  221.7970 71  71510 303351719      341816        syn-C2H3C(O)NH2, v=0
   13660.5148  0.0014 -6.8047 3  221.7970 71  71510 303351718      341817        syn-C2H3C(O)NH2, v=0
   13667.9673  0.0038 -7.8943 3  517.5547123  71510 303611448      621151        syn-C2H3C(O)NH2, v=0
   13684.6793  0.0046 -7.9330 3  477.4261117  71510 303581444      571741        syn-C2H3C(O)NH2, v=0
   13761.4908  0.0629 -9.0166 3 1172.6304187  71510 303931875      922172        syn-C2H3C(O)NH2, v=0
   13763.5638  0.0001 -6.7061 3    0.0000  3  71510 303 1 1 1       0 0 0        syn-C2H3C(O)NH2, v=0
   13829.2777  0.0034 -7.3996 3  137.7972 63  71510 30331 824      32 527        syn-C2H3C(O)NH2, v=0
   13839.9960  0.0120 -8.0782 3  981.0061147  71510 303733736      723835        syn-C2H3C(O)NH2, v=0
   13839.9960  0.0120 -8.0782 3  981.0061147  71510 303733737      723834        syn-C2H3C(O)NH2, v=0
   13870.5774  0.0018 -7.2123 3   15.9775 23  71510 30311 210      10 3 7        syn-C2H3C(O)NH2, v=0
   13914.4596  0.0016 -6.8529 3   95.7942 43  71510 3032113 9      221210        syn-C2H3C(O)NH2, v=0
   13914.4643  0.0016 -6.8529 3   95.7942 43  71510 3032113 8      221211        syn-C2H3C(O)NH2, v=0
   13943.4872  0.0036 -7.5965 3  687.8730119  71510 303593326      603229        syn-C2H3C(O)NH2, v=0
   13943.4872  0.0036 -7.5965 3  687.8730119  71510 303593327      603228        syn-C2H3C(O)NH2, v=0
   14005.4573  0.0013 -6.7051 3   44.4381 33  71510 30316 710      15 8 7        syn-C2H3C(O)NH2, v=0
   14049.2416  0.0016 -7.0119 3  324.4176 81  71510 303402317      412220        syn-C2H3C(O)NH2, v=0
   14049.2416  0.0016 -7.0119 3  324.4176 81  71510 303402318      412219        syn-C2H3C(O)NH2, v=0
   14101.0443  0.0014 -6.6992 3   44.4380 33  71510 30316 7 9      15 8 8        syn-C2H3C(O)NH2, v=0
   14105.2387  0.0044 -7.5658 3   51.7673 39  71510 30319 415      20 318        syn-C2H3C(O)NH2, v=0
   14169.4112  0.0032 -7.6809 3  368.7368103  71510 303511239      501536        syn-C2H3C(O)NH2, v=0
   14321.9256  0.0007 -6.9153 3    5.7861 13  71510 303 6 2 4       5 3 3        syn-C2H3C(O)NH2, v=0
   14350.7401  0.0001 -8.5801 3    0.2418  5  71510 303 2 0 2       1 0 1        syn-C2H3C(O)NH2, v=0
   14379.1773  0.0228 -8.3727 3 1127.8327153  71510 303764234      774137        syn-C2H3C(O)NH2, v=0
   14379.1773  0.0228 -8.3727 3 1127.8327153  71510 303764235      774136        syn-C2H3C(O)NH2, v=0
   14388.5109  0.0045 -7.2715 3   64.5355 45  71510 30322 419      21 516        syn-C2H3C(O)NH2, v=0
   14409.3686  0.0008 -6.9191 3    9.0412 17  71510 303 8 2 7       7 3 4        syn-C2H3C(O)NH2, v=0
   14419.2514  0.0022 -7.3024 3  574.1765113  71510 303562828      552927        syn-C2H3C(O)NH2, v=0
   14419.2514  0.0022 -7.3024 3  574.1765113  71510 303562829      552926        syn-C2H3C(O)NH2, v=0
   14444.0522  0.0014 -6.7864 3  247.8610 75  71510 303371820      361917        syn-C2H3C(O)NH2, v=0
   14444.0523  0.0014 -6.7864 3  247.8610 75  71510 303371819      361918        syn-C2H3C(O)NH2, v=0
   14462.3089  0.0072 -8.1556 3  697.8129143  71510 303711556      721459        syn-C2H3C(O)NH2, v=0
   14666.0683  0.0016 -6.8293 3   79.8609 39  71510 3031912 8      2011 9        syn-C2H3C(O)NH2, v=0
   14666.0834  0.0016 -6.8293 3   79.8609 39  71510 3031912 7      201110        syn-C2H3C(O)NH2, v=0
   14673.0415  0.0147 -8.1273 3 1034.8775151  71510 303753837      743936        syn-C2H3C(O)NH2, v=0
   14673.0415  0.0147 -8.1273 3 1034.8775151  71510 303753838      743935        syn-C2H3C(O)NH2, v=0
   14682.6250  0.0046 -7.9792 3  604.3352133  71510 303661552      671255        syn-C2H3C(O)NH2, v=0
   14701.3296  0.0003 -6.1862 3    2.3485  9  71510 303 4 1 3       4 0 4        syn-C2H3C(O)NH2, v=0
   14751.0870  0.0029 -7.4738 3  644.0422115  71510 303573225      583128        syn-C2H3C(O)NH2, v=0
   14751.0870  0.0029 -7.4738 3  644.0422115  71510 303573226      583127        syn-C2H3C(O)NH2, v=0
   14773.8732  0.0644 -8.9548 3 1172.5969187  71510 303931975      922072        syn-C2H3C(O)NH2, v=0
   14774.6175  0.0014 -6.6376 3   56.5161 37  71510 30318 811      17 9 8        syn-C2H3C(O)NH2, v=0
   14778.5440  0.0062 -7.9863 3  645.9326139  71510 303691456      681553        syn-C2H3C(O)NH2, v=0
   14798.1187  0.0415 -8.7200 3 1050.5683177  71510 303881771      872068        syn-C2H3C(O)NH2, v=0
   14799.5285  0.0016 -8.6208 3  142.0310 63  71510 30331 922      31 923        syn-C2H3C(O)NH2, v=0
   14806.3695  0.0014 -6.6357 3   56.5161 37  71510 30318 810      17 9 9        syn-C2H3C(O)NH2, v=0
   14828.9811  0.0016 -6.9292 3  294.5089 77  71510 303382216      392119        syn-C2H3C(O)NH2, v=0
   14828.9811  0.0016 -6.9292 3  294.5089 77  71510 303382217      392118        syn-C2H3C(O)NH2, v=0
   15143.9006  0.0016 -8.9644 3  408.2748107  71510 303531538      531539        syn-C2H3C(O)NH2, v=0
   15197.8392  0.0015 -8.6315 3   43.6454 35  71510 30317 512      17 513        syn-C2H3C(O)NH2, v=0
   15206.9872  0.0031 -7.3914 3  314.8990 97  71510 30348 939      471236        syn-C2H3C(O)NH2, v=0
   15216.7429  0.0191 -8.2197 3 1071.5871149  71510 303744133      754036        syn-C2H3C(O)NH2, v=0
   15216.7429  0.0191 -8.2197 3 1071.5871149  71510 303744134      754035        syn-C2H3C(O)NH2, v=0
   15226.6677  0.0024 -7.3256 3  615.6193117  71510 303582929      573028        syn-C2H3C(O)NH2, v=0
   15226.6677  0.0024 -7.3256 3  615.6193117  71510 303582930      573027        syn-C2H3C(O)NH2, v=0
   15229.4907  0.0014 -6.7748 3  275.3705 79  71510 303391921      382018        syn-C2H3C(O)NH2, v=0
   15229.4908  0.0014 -6.7748 3  275.3705 79  71510 303391920      382019        syn-C2H3C(O)NH2, v=0
   15412.1025  0.0015 -6.8192 3   65.3763 35  71510 3031711 7      1810 8        syn-C2H3C(O)NH2, v=0
   15412.1509  0.0015 -6.8192 3   65.3763 35  71510 3031711 6      1810 9        syn-C2H3C(O)NH2, v=0
   15479.5177  0.0014 -8.7180 3  258.0118 85  71510 303421230      421231        syn-C2H3C(O)NH2, v=0
   15509.3848  0.0178 -8.1823 3 1090.1795155  71510 303773938      764037        syn-C2H3C(O)NH2, v=0
   15509.3848  0.0178 -8.1823 3 1090.1795155  71510 303773939      764036        syn-C2H3C(O)NH2, v=0
   15533.4248  0.0015 -6.5805 3   70.0433 41  71510 30320 912      1910 9        syn-C2H3C(O)NH2, v=0
   15543.7268  0.0015 -6.5800 3   70.0433 41  71510 30320 911      191010        syn-C2H3C(O)NH2, v=0
   15555.2860  0.0024 -7.3575 3  601.6493111  71510 303553124      563027        syn-C2H3C(O)NH2, v=0
   15555.2860  0.0024 -7.3575 3  601.6493111  71510 303553125      563026        syn-C2H3C(O)NH2, v=0
   15559.4727  0.0035 -7.5815 3  376.7757105  71510 303521141      531044        syn-C2H3C(O)NH2, v=0
   15594.6674  0.0017 -8.5638 3   85.8130 49  71510 30324 717      24 718        syn-C2H3C(O)NH2, v=0
   15605.4788  0.0016 -6.8538 3  266.0447 73  71510 303362115      372018        syn-C2H3C(O)NH2, v=0
   15605.4788  0.0016 -6.8538 3  266.0447 73  71510 303362116      372017        syn-C2H3C(O)NH2, v=0
   15670.0164  0.0007 -6.7179 3   12.5969 19  71510 303 9 3 7       8 4 4        syn-C2H3C(O)NH2, v=0
   15686.7630  0.0001 -8.6260 3    0.4987  5  71510 303 2 1 1       1 1 0        syn-C2H3C(O)NH2, v=0
   15696.1268  0.0002 -6.4435 3    0.9031  7  71510 303 3 0 3       2 1 2        syn-C2H3C(O)NH2, v=0
   15776.2830  0.0071 -8.0803 3  697.8125143  71510 303711656      721359        syn-C2H3C(O)NH2, v=0
   15812.5936  0.0260 -8.4438 3  935.1729167  71510 303831667      821964        syn-C2H3C(O)NH2, v=0
   15859.6405  0.0032 -7.2889 3   98.0319 53  71510 30326 720      27 423        syn-C2H3C(O)NH2, v=0
   15928.5795  0.0017 -7.3303 3   68.0122 43  71510 30321 715      22 418        syn-C2H3C(O)NH2, v=0
   15972.0277  0.0028 -7.2380 3  242.6042 85  71510 30342 834      411131        syn-C2H3C(O)NH2, v=0
   16016.8627  0.0014 -6.7696 3  304.3250 83  71510 303412021      402120        syn-C2H3C(O)NH2, v=0
   16016.8627  0.0014 -6.7696 3  304.3250 83  71510 303412022      402119        syn-C2H3C(O)NH2, v=0
   16036.6704  0.0028 -7.3547 3  658.5007121  71510 303603030      593129        syn-C2H3C(O)NH2, v=0
   16036.6704  0.0028 -7.3547 3  658.5007121  71510 303603031      593128        syn-C2H3C(O)NH2, v=0
   16044.8908  0.0128 -8.2451 3  797.9805153  71510 303761660      771563        syn-C2H3C(O)NH2, v=0
   16050.4214  0.0158 -8.0730 3 1016.7712145  71510 303724032      733935        syn-C2H3C(O)NH2, v=0
   16050.4214  0.0158 -8.0730 3 1016.7712145  71510 303724033      733934        syn-C2H3C(O)NH2, v=0
   16057.4986  0.0019 -7.3365 3   88.5795 49  71510 30324 817      25 520        syn-C2H3C(O)NH2, v=0
   16139.3226  0.0013 -6.9573 3   13.3849 21  71510 30310 2 9       9 3 6        syn-C2H3C(O)NH2, v=0
   16151.4323  0.0014 -6.8249 3   52.3407 31  71510 3031510 6      16 9 7        syn-C2H3C(O)NH2, v=0
   16151.5860  0.0014 -6.8249 3   52.3406 31  71510 3031510 5      16 9 8        syn-C2H3C(O)NH2, v=0
   16290.8544  0.0010 -6.8569 3   11.0726 19  71510 303 9 2 8       8 3 5        syn-C2H3C(O)NH2, v=0
   16292.3372  0.0016 -6.5323 3   85.0194 45  71510 303221013      211110        syn-C2H3C(O)NH2, v=0
   16295.6201  0.0016 -6.5321 3   85.0194 45  71510 303221012      211111        syn-C2H3C(O)NH2, v=0
   16347.9937  0.0429 -8.6332 3 1050.5172177  71510 303881871      871968        syn-C2H3C(O)NH2, v=0
   16349.0956  0.0213 -8.2430 3 1146.9108159  71510 303794039      784138        syn-C2H3C(O)NH2, v=0
   16349.0956  0.0213 -8.2430 3 1146.9108159  71510 303794040      784137        syn-C2H3C(O)NH2, v=0
   16356.0985  0.0021 -7.2475 3  560.6951107  71510 303533023      542926        syn-C2H3C(O)NH2, v=0
   16356.0985  0.0021 -7.2475 3  560.6951107  71510 303533024      542925        syn-C2H3C(O)NH2, v=0
   16378.6296  0.0016 -6.7856 3  239.0257 69  71510 303342014      351917        syn-C2H3C(O)NH2, v=0
   16378.6296  0.0016 -6.7856 3  239.0257 69  71510 303342015      351916        syn-C2H3C(O)NH2, v=0
   16527.4309  0.0021 -7.3020 3   54.8454 39  71510 30319 614      20 317        syn-C2H3C(O)NH2, v=0
   16649.6405  0.0021 -7.1749 3  212.2827 79  71510 30339 831      381128        syn-C2H3C(O)NH2, v=0
   16754.1138  0.0154 -8.1900 3  826.4536157  71510 303781563      771860        syn-C2H3C(O)NH2, v=0
   16806.2102  0.0014 -6.7704 3  334.7239 87  71510 303432122      422221        syn-C2H3C(O)NH2, v=0
   16806.2102  0.0014 -6.7704 3  334.7239 87  71510 303432123      422220        syn-C2H3C(O)NH2, v=0
   16825.7352  0.0025 -7.2791 3   59.8241 41  71510 30320 615      21 318        syn-C2H3C(O)NH2, v=0
   16849.3302  0.0034 -7.3894 3  702.8197125  71510 303623131      613230        syn-C2H3C(O)NH2, v=0
   16849.3302  0.0034 -7.3894 3  702.8197125  71510 303623132      613229        syn-C2H3C(O)NH2, v=0
   16880.2534  0.0130 -7.9323 3  963.3860141  71510 303703931      713834        syn-C2H3C(O)NH2, v=0
   16880.2534  0.0130 -7.9323 3  963.3860141  71510 303703932      713833        syn-C2H3C(O)NH2, v=0
   16882.4212  0.0013 -6.8501 3   40.7542 27  71510 30313 9 5      14 8 6        syn-C2H3C(O)NH2, v=0
   16882.9012  0.0013 -6.8501 3   40.7541 27  71510 30313 9 4      14 8 7        syn-C2H3C(O)NH2, v=0
   16896.1228  0.0041 -7.3224 3  202.5323 77  71510 30338 830      39 733        syn-C2H3C(O)NH2, v=0
   16903.3452  0.0126 -8.2000 3  797.9803153  71510 303761760      771463        syn-C2H3C(O)NH2, v=0
   16962.7980  0.0073 -8.0857 3  583.3314127  71510 303631945      641648        syn-C2H3C(O)NH2, v=0
   17050.8917  0.0034 -7.3950 3  383.3474107  71510 303531043      521340        syn-C2H3C(O)NH2, v=0
   17054.2083  0.0016 -6.4918 3  101.4441 49  71510 303241114      231211        syn-C2H3C(O)NH2, v=0
   17055.2397  0.0016 -6.4918 3  101.4441 49  71510 303241113      231212        syn-C2H3C(O)NH2, v=0
   17057.8064  0.0044 -7.7554 3  400.5792105  71510 303521637      531340        syn-C2H3C(O)NH2, v=0
   17105.9985  0.0048 -7.3371 3   81.7129 49  71510 30324 519      25 422        syn-C2H3C(O)NH2, v=0
   17124.7871  0.0569 -8.8844 3 1473.5323175  71510 303874839      884742        syn-C2H3C(O)NH2, v=0
   17124.7871  0.0569 -8.8844 3 1473.5323175  71510 303874840      884741        syn-C2H3C(O)NH2, v=0
   17148.2924  0.0016 -6.7248 3  213.4524 65  71510 303321913      331816        syn-C2H3C(O)NH2, v=0
   17148.2924  0.0016 -6.7248 3  213.4524 65  71510 303321914      331815        syn-C2H3C(O)NH2, v=0
   17153.5308  0.0020 -7.1437 3  521.1804103  71510 303512922      522825        syn-C2H3C(O)NH2, v=0
   17153.5308  0.0020 -7.1437 3  521.1804103  71510 303512923      522824        syn-C2H3C(O)NH2, v=0
   17192.2437  0.0254 -8.3090 3 1205.0704163  71510 303814140      804239        syn-C2H3C(O)NH2, v=0
   17192.2437  0.0254 -8.3090 3 1205.0704163  71510 303814141      804238        syn-C2H3C(O)NH2, v=0
   17380.8926  0.0041 -7.3472 3  338.7899101  71510 303501041      491138        syn-C2H3C(O)NH2, v=0
   17414.8271  0.0017 -8.5360 3  179.8500 71  71510 303351025      351026        syn-C2H3C(O)NH2, v=0
   17472.9310  0.0220 -8.3664 3  904.8320163  71510 303811764      821667        syn-C2H3C(O)NH2, v=0
   17508.9187  0.0014 -8.5948 3   29.5856 29  71510 30314 410      14 411        syn-C2H3C(O)NH2, v=0
   17552.9211  0.0088 -7.9612 3  724.4200147  71510 303731459      721756        syn-C2H3C(O)NH2, v=0
   17597.5826  0.0015 -6.7770 3  366.5667 91  71510 303452223      442322        syn-C2H3C(O)NH2, v=0
   17597.5826  0.0015 -6.7770 3  366.5667 91  71510 303452224      442321        syn-C2H3C(O)NH2, v=0
   17602.5879  0.0012 -6.9015 3   30.6171 23  71510 30311 8 4      12 7 5        syn-C2H3C(O)NH2, v=0
   17604.0572  0.0012 -6.9014 3   30.6170 23  71510 30311 8 3      12 7 6        syn-C2H3C(O)NH2, v=0
   17664.7185  0.0042 -7.4294 3  748.5756129  71510 303643232      633331        syn-C2H3C(O)NH2, v=0
   17664.7185  0.0042 -7.4294 3  748.5756129  71510 303643233      633330        syn-C2H3C(O)NH2, v=0
   17706.2766  0.0106 -7.7973 3  911.4327137  71510 303683830      693733        syn-C2H3C(O)NH2, v=0
   17706.2766  0.0106 -7.7973 3  911.4327137  71510 303683831      693732        syn-C2H3C(O)NH2, v=0
   17709.5628  0.0002 -5.8564 3    4.1212 11  71510 303 5 2 3       5 1 4        syn-C2H3C(O)NH2, v=0
   17731.3919  0.0016 -8.6879 3  308.2071 93  71510 303461333      461334        syn-C2H3C(O)NH2, v=0
   17783.1515  0.0049 -7.6659 3  555.9951129  71510 303641352      631449        syn-C2H3C(O)NH2, v=0
   17787.2900  0.0002 -5.9801 3    2.8389  9  71510 303 4 2 2       4 1 3        syn-C2H3C(O)NH2, v=0
   17819.4670  0.0016 -6.4586 3  119.3170 53  71510 303261215      251312        syn-C2H3C(O)NH2, v=0
   17819.7873  0.0016 -6.4586 3  119.3170 53  71510 303261214      251313        syn-C2H3C(O)NH2, v=0
   17872.3858  0.0037 -7.5756 3  451.3603115  71510 303571245      581148        syn-C2H3C(O)NH2, v=0
   17914.2807  0.0016 -6.6715 3  189.3251 61  71510 303301812      311715        syn-C2H3C(O)NH2, v=0
   17914.2807  0.0016 -6.6715 3  189.3251 61  71510 303301813      311714        syn-C2H3C(O)NH2, v=0
   17938.0498  0.0018 -7.2629 3   50.0592 37  71510 30318 613      19 316        syn-C2H3C(O)NH2, v=0
   17947.5796  0.0018 -7.0458 3  483.1060 99  71510 303492821      502724        syn-C2H3C(O)NH2, v=0
   17947.5796  0.0018 -7.0458 3  483.1060 99  71510 303492822      502723        syn-C2H3C(O)NH2, v=0
   17951.5684  0.0027 -7.3567 3  174.8782 69  71510 303341124      35 827        syn-C2H3C(O)NH2, v=0
   17984.8516  0.0494 -8.7196 3 1409.2157171  71510 303854738      864641        syn-C2H3C(O)NH2, v=0
   17984.8516  0.0494 -8.7196 3 1409.2157171  71510 303854739      864640        syn-C2H3C(O)NH2, v=0
   18025.8929  0.0038 -7.4689 3  458.5348117  71510 303581147      571444        syn-C2H3C(O)NH2, v=0
   18030.5254  0.0217 -8.3392 3  904.8319163  71510 303811864      821567        syn-C2H3C(O)NH2, v=0
   18038.3530  0.0050 -7.1168 3  174.8782 73  71510 30336 730      35 827        syn-C2H3C(O)NH2, v=0
   18038.8991  0.0301 -8.3803 3 1264.6573167  71510 303834241      824340        syn-C2H3C(O)NH2, v=0
   18038.8991  0.0301 -8.3803 3 1264.6573167  71510 303834242      824339        syn-C2H3C(O)NH2, v=0
   18115.8850  0.0054 -7.7612 3  629.0820137  71510 303681355      671652        syn-C2H3C(O)NH2, v=0
   18139.5538  0.0026 -7.1059 3  232.2481 83  71510 30341 833      401130        syn-C2H3C(O)NH2, v=0
   18170.5965  0.0272 -8.3226 3  935.0951167  71510 303831767      821864        syn-C2H3C(O)NH2, v=0
   18307.9359  0.0011 -6.9915 3   21.9295 19  71510 303 9 7 3      10 6 4        syn-C2H3C(O)NH2, v=0
   18312.3108  0.0011 -6.9913 3   21.9294 19  71510 303 9 7 2      10 6 5        syn-C2H3C(O)NH2, v=0
   18322.9598  0.0042 -7.5947 3  540.4500127  71510 303631251      621548        syn-C2H3C(O)NH2, v=0
   18391.0348  0.0016 -6.7892 3  399.8527 95  71510 303472324      462423        syn-C2H3C(O)NH2, v=0
   18391.0348  0.0016 -6.7892 3  399.8527 95  71510 303472325      462422        syn-C2H3C(O)NH2, v=0
   18478.4942  0.0024 -7.0795 3  222.1388 81  71510 30340 832      391129        syn-C2H3C(O)NH2, v=0
   18482.9073  0.0053 -7.4746 3  795.7674133  71510 303663333      653432        syn-C2H3C(O)NH2, v=0
   18482.9073  0.0053 -7.4746 3  795.7674133  71510 303663334      653431        syn-C2H3C(O)NH2, v=0
   18528.5254  0.0086 -7.6679 3  860.9121133  71510 303663729      673632        syn-C2H3C(O)NH2, v=0
   18528.5254  0.0086 -7.6679 3  860.9121133  71510 303663730      673631        syn-C2H3C(O)NH2, v=0
   18558.3689  0.0009 -6.4980 3   19.3642 23  71510 30311 4 8      10 5 5        syn-C2H3C(O)NH2, v=0
   18585.3513  0.0002 -6.1304 3    1.8036  7  71510 303 3 2 1       3 1 2        syn-C2H3C(O)NH2, v=0
   18587.3778  0.0034 -7.2055 3  193.3111 75  71510 30337 929      38 632        syn-C2H3C(O)NH2, v=0
   18587.8968  0.0015 -6.4321 3  138.6379 57  71510 303281316      271413        syn-C2H3C(O)NH2, v=0
   18587.9953  0.0015 -6.4321 3  138.6379 57  71510 303281315      271414        syn-C2H3C(O)NH2, v=0
   18606.0252  0.0028 -7.2020 3   64.9981 43  71510 30321 616      22 319        syn-C2H3C(O)NH2, v=0
   18629.0077  0.0032 -7.2564 3  247.7460 85  71510 303421033      43 736        syn-C2H3C(O)NH2, v=0
   18676.3507  0.0016 -6.6259 3  166.6445 57  71510 303281711      291614        syn-C2H3C(O)NH2, v=0
   18676.3507  0.0016 -6.6259 3  166.6445 57  71510 303281712      291613        syn-C2H3C(O)NH2, v=0
   18683.5384  0.0002 -5.7323 3    5.6406 13  71510 303 6 2 4       6 1 5        syn-C2H3C(O)NH2, v=0
   18738.2307  0.0018 -6.9538 3  446.4726 95  71510 303472720      482623        syn-C2H3C(O)NH2, v=0
   18738.2307  0.0018 -6.9538 3  446.4726 95  71510 303472721      482622        syn-C2H3C(O)NH2, v=0
   18770.4016  0.0020 -8.4358 3  115.7134 57  71510 30328 820      28 821        syn-C2H3C(O)NH2, v=0
   18773.4154  0.0356 -8.5150 3 1018.3601173  71510 303861868      871771        syn-C2H3C(O)NH2, v=0
   18840.6288  0.0426 -8.5603 3 1346.3222167  71510 303834637      844540        syn-C2H3C(O)NH2, v=0
   18840.6288  0.0426 -8.5603 3 1346.3222167  71510 303834638      844539        syn-C2H3C(O)NH2, v=0
   18846.0771  0.0023 -7.2498 3  111.7434 55  71510 30327 919      28 622        syn-C2H3C(O)NH2, v=0
   18849.6990  0.0026 -7.7994 3   14.4281 21  71510 30310 2 8      11 111        syn-C2H3C(O)NH2, v=0
   18889.1316  0.0353 -8.4565 3 1325.6702171  71510 303854342      844441        syn-C2H3C(O)NH2, v=0
   18889.1316  0.0353 -8.4565 3 1325.6702171  71510 303854343      844440        syn-C2H3C(O)NH2, v=0
   18937.8811  0.0100 -8.0221 3  675.3013139  71510 303691752      682049        syn-C2H3C(O)NH2, v=0
   18991.5882  0.0009 -7.1482 3   14.6918 15  71510 303 7 6 2       8 5 3        syn-C2H3C(O)NH2, v=0
   19004.1067  0.0009 -7.1476 3   14.6914 15  71510 303 7 6 1       8 5 4        syn-C2H3C(O)NH2, v=0
   19032.7545  0.0012 -8.6349 3   18.2090 23  71510 30311 3 8      11 3 9        syn-C2H3C(O)NH2, v=0
   19034.8310  0.0036 -7.1575 3  145.6011 65  71510 30332 825      33 528        syn-C2H3C(O)NH2, v=0
   19035.2637  0.0019 -8.4399 3   65.6187 43  71510 30321 615      21 616        syn-C2H3C(O)NH2, v=0
   19061.9848  0.0031 -7.3115 3  308.9018 95  71510 303471137      48 840        syn-C2H3C(O)NH2, v=0
   19133.8630  0.0353 -8.4985 3 1018.3600173  71510 303861968      871671        syn-C2H3C(O)NH2, v=0
   19186.6263  0.0017 -6.8066 3  434.5814 99  71510 303492425      482524        syn-C2H3C(O)NH2, v=0
   19186.6263  0.0017 -6.8066 3  434.5814 99  71510 303492426      482523        syn-C2H3C(O)NH2, v=0
   19231.6114  0.0009 -8.7805 3    9.5218 17  71510 303 8 2 6       8 2 7        syn-C2H3C(O)NH2, v=0
   19303.9692  0.0066 -7.5248 3  844.3943137  71510 303683434      673533        syn-C2H3C(O)NH2, v=0
   19303.9692  0.0066 -7.5248 3  844.3943137  71510 303683435      673532        syn-C2H3C(O)NH2, v=0
   19347.0301  0.0069 -7.5439 3  811.8253129  71510 303643628      653531        syn-C2H3C(O)NH2, v=0
   19347.0301  0.0069 -7.5439 3  811.8253129  71510 303643629      653530        syn-C2H3C(O)NH2, v=0
   19347.5720  0.0005 -5.9596 3    3.4758 11  71510 303 5 1 4       5 0 5        syn-C2H3C(O)NH2, v=0
   19359.1873  0.0015 -6.4119 3  159.4064 61  71510 303301417      291514        syn-C2H3C(O)NH2, v=0
   19359.2174  0.0015 -6.4119 3  159.4064 61  71510 303301416      291515        syn-C2H3C(O)NH2, v=0
   19434.1844  0.0017 -6.5886 3  145.4108 53  71510 303261611      271512        syn-C2H3C(O)NH2, v=0
   19434.1845  0.0017 -6.5886 3  145.4108 53  71510 303261610      271513        syn-C2H3C(O)NH2, v=0
   19525.4568  0.0017 -6.8676 3  411.2809 91  71510 303452619      462522        syn-C2H3C(O)NH2, v=0
   19525.4568  0.0017 -6.8676 3  411.2809 91  71510 303452620      462521        syn-C2H3C(O)NH2, v=0
   19641.2216  0.0007 -7.4585 3    8.9040 11  71510 303 5 5 1       6 4 2        syn-C2H3C(O)NH2, v=0
   19674.8753  0.0007 -7.4571 3    8.9029 11  71510 303 5 5 0       6 4 3        syn-C2H3C(O)NH2, v=0
   19690.3868  0.0002 -6.3767 3    1.0220  5  71510 303 2 2 0       2 1 1        syn-C2H3C(O)NH2, v=0
   19692.1638  0.0366 -8.4063 3 1284.8532163  71510 303814536      824439        syn-C2H3C(O)NH2, v=0
   19692.1638  0.0366 -8.4063 3 1284.8532163  71510 303814537      824438        syn-C2H3C(O)NH2, v=0
   19743.0112  0.0413 -8.5376 3 1388.1080175  71510 303874443      864542        syn-C2H3C(O)NH2, v=0
   19743.0112  0.0413 -8.5376 3 1388.1080175  71510 303874444      864541        syn-C2H3C(O)NH2, v=0
   19787.7093  0.0032 -7.3741 3  376.7746105  71510 303521241      53 944        syn-C2H3C(O)NH2, v=0
   19825.0534  0.0001 -6.2137 3    0.2418  5  71510 303 2 1 2       1 0 1        syn-C2H3C(O)NH2, v=0
   19835.4146  0.0026 -7.2610 3  325.6123 97  71510 303481137      471434        syn-C2H3C(O)NH2, v=0
   19876.8276  0.0030 -7.3945 3  251.9405 83  71510 303411329      421032        syn-C2H3C(O)NH2, v=0
   19878.9232  0.0002 -8.1720 3    0.9031  7  71510 303 3 1 3       2 1 2        syn-C2H3C(O)NH2, v=0
   19888.2882  0.0039 -7.6147 3  532.6523125  71510 303621349      631252        syn-C2H3C(O)NH2, v=0
   19909.5516  0.0036 -7.2369 3  258.1826 87  71510 30343 934      44 837        syn-C2H3C(O)NH2, v=0
   19960.1378  0.0240 -8.3557 3  800.1169149  71510 303742253      751956        syn-C2H3C(O)NH2, v=0
   19964.0989  0.0546 -8.6878 3 1138.5571183  71510 303911972      921875        syn-C2H3C(O)NH2, v=0
   19984.4199  0.0018 -6.8292 3  470.7521103  71510 303512526      502625        syn-C2H3C(O)NH2, v=0
   19984.4199  0.0018 -6.8292 3  470.7521103  71510 303512527      502624        syn-C2H3C(O)NH2, v=0
   20046.4268  0.0035 -7.1159 3  104.6195 55  71510 30327 721      28 424        syn-C2H3C(O)NH2, v=0
   20101.9230  0.0019 -8.6774 3  362.8668101  71510 303501436      501437        syn-C2H3C(O)NH2, v=0
   20127.9769  0.0082 -7.5798 3  894.4554141  71510 303703535      693634        syn-C2H3C(O)NH2, v=0
   20127.9769  0.0082 -7.5798 3  894.4554141  71510 303703536      693633        syn-C2H3C(O)NH2, v=0
   20133.0900  0.0500 -6.3977 3  181.6220 65 -71510 303321518      311615        syn-C2H3C(O)NH2, v=0
   20133.0900  0.0500 -6.3977 3  181.6220 65 -71510 303321517      311616        syn-C2H3C(O)NH2, v=0
   20161.7100  0.1000 -7.4252 3  764.1732125 -71510 303623527      633430        syn-C2H3C(O)NH2, v=0
   20161.7100  0.1000 -7.4252 3  764.1732125 -71510 303623528      633429        syn-C2H3C(O)NH2, v=0
   20167.0503  0.0018 -8.4763 3  222.1388 79  71510 303391128      391129        syn-C2H3C(O)NH2, v=0
   20187.4400  0.0800 -6.5599 3  125.6246 49 -71510 303241510      251411        syn-C2H3C(O)NH2, v=0
   20187.4400  0.0800 -6.5599 3  125.6246 49 -71510 3032415 9      251412        syn-C2H3C(O)NH2, v=0
   20196.1838  0.0543 -8.6777 3 1138.5570183  71510 303912072      921775        syn-C2H3C(O)NH2, v=0
   20256.9700  0.0500 -6.3772 3   27.5838 27 -71510 30313 5 9      12 6 6        syn-C2H3C(O)NH2, v=0
   20271.3604  0.0030 -7.1054 3  303.0426 95  71510 30347 938      461235        syn-C2H3C(O)NH2, v=0
   20309.2500  0.0500 -6.7872 3  377.5315 87 -71510 303432518      442421        syn-C2H3C(O)NH2, v=0
   20309.2500  0.0500 -6.7872 3  377.5315 87 -71510 303432519      442420        syn-C2H3C(O)NH2, v=0
   20314.0358  0.0164 -8.0219 3  826.3361157  71510 303781663      771760        syn-C2H3C(O)NH2, v=0
   20441.5611  0.0048 -7.1592 3  118.3943 59  71510 30329 623      30 526        syn-C2H3C(O)NH2, v=0
   20539.4997  0.0313 -8.2574 3 1224.8097159  71510 303794435      804338        syn-C2H3C(O)NH2, v=0
   20539.4997  0.0313 -8.2574 3 1224.8097159  71510 303794436      804337        syn-C2H3C(O)NH2, v=0
   20600.6075  0.0479 -8.6234 3 1451.9695179  71510 303894544      884643        syn-C2H3C(O)NH2, v=0
   20600.6075  0.0479 -8.6234 3 1451.9695179  71510 303894545      884642        syn-C2H3C(O)NH2, v=0
   20626.7356  0.0021 -7.0420 3  247.3863 85  71510 30342 933      411230        syn-C2H3C(O)NH2, v=0
   20703.6898  0.0397 -8.4015 3  907.2815161  71510 303802060      792357        syn-C2H3C(O)NH2, v=0
   20718.2237  0.0035 -7.4481 3  451.3596115  71510 303571345      581048        syn-C2H3C(O)NH2, v=0
   20744.6250  0.0030 -6.8326 3   34.0870 33  71510 30316 314      15 411        syn-C2H3C(O)NH2, v=0
   20784.5100  0.0500 -6.8568 3  508.3640107 -71510 303532627      522726        syn-C2H3C(O)NH2, v=0
   20784.5100  0.0500 -6.8568 3  508.3640107 -71510 303532628      522725        syn-C2H3C(O)NH2, v=0
   20822.8081  0.0037 -7.4278 3   32.1003 31  71510 30315 312      16 215        syn-C2H3C(O)NH2, v=0
   20909.4300  0.0800 -6.3893 3  205.2845 69 -71510 303341619      331716        syn-C2H3C(O)NH2, v=0
   20909.4300  0.0800 -6.3893 3  205.2845 69 -71510 303341618      331717        syn-C2H3C(O)NH2, v=0
   20935.4100  0.0800 -6.5409 3  107.2861 45 -71510 3032214 9      231310        syn-C2H3C(O)NH2, v=0
   20935.4100  0.0800 -6.5409 3  107.2861 45 -71510 3032214 8      231311        syn-C2H3C(O)NH2, v=0
   20950.5968  0.0004 -5.5970 3    7.3848 15  71510 303 7 2 5       7 1 6        syn-C2H3C(O)NH2, v=0
   20955.0035  0.0102 -7.6395 3  945.9497145  71510 303723636      713735        syn-C2H3C(O)NH2, v=0
   20955.0035  0.0102 -7.6395 3  945.9497145  71510 303723637      713734        syn-C2H3C(O)NH2, v=0
   20972.9066  0.0043 -7.3117 3  717.9568121  71510 303603426      613329        syn-C2H3C(O)NH2, v=0
   20972.9066  0.0043 -7.3117 3  717.9568121  71510 303603427      613328        syn-C2H3C(O)NH2, v=0
   21089.5300  0.1000 -6.7127 3  345.2252 83 -71510 303412417      422320        syn-C2H3C(O)NH2, v=0
   21089.5300  0.1000 -6.7127 3  345.2252 83 -71510 303412418      422319        syn-C2H3C(O)NH2, v=0
   21170.4401  0.0002 -8.0708 3    0.7205  7  71510 303 3 0 3       2 0 2        syn-C2H3C(O)NH2, v=0
   21264.4161  0.0016 -7.1802 3   45.4621 35  71510 30317 612      18 315        syn-C2H3C(O)NH2, v=0
   21362.5000  0.0500 -6.3006 3   37.2541 31 -71510 30315 610      14 7 7        syn-C2H3C(O)NH2, v=0
   21382.6776  0.0265 -8.1135 3 1166.1930155  71510 303774334      784237        syn-C2H3C(O)NH2, v=0
   21382.6776  0.0265 -8.1135 3 1166.1930155  71510 303774335      784236        syn-C2H3C(O)NH2, v=0
   21408.2440  0.0046 -7.3605 3  472.7366119  71510 303591248      581345        syn-C2H3C(O)NH2, v=0
   21461.9901  0.0554 -8.7137 3 1517.2534183  71510 303914645      904744        syn-C2H3C(O)NH2, v=0
   21461.9901  0.0554 -8.7137 3 1517.2534183  71510 303914646      904743        syn-C2H3C(O)NH2, v=0
   21479.9724  0.0019 -7.2061 3   34.7408 31  71510 30315 511      16 214        syn-C2H3C(O)NH2, v=0
   21533.7966  0.0008 -6.3871 3   14.8312 21  71510 30310 3 8       9 4 5        syn-C2H3C(O)NH2, v=0
   21586.9500  0.0800 -6.8891 3  547.4165111 -71510 303552728      542827        syn-C2H3C(O)NH2, v=0
   21586.9500  0.0800 -6.8891 3  547.4165111 -71510 303552729      542826        syn-C2H3C(O)NH2, v=0
   21637.6111  0.0031 -7.0932 3   70.3695 45  71510 30322 617      23 320        syn-C2H3C(O)NH2, v=0
   21671.7869  0.0049 -7.6890 3  620.6462135  71510 303671453      681356        syn-C2H3C(O)NH2, v=0
   21677.5100  0.0800 -6.5326 3   90.3957 41 -71510 3032013 8      2112 9        syn-C2H3C(O)NH2, v=0
   21677.5100  0.0800 -6.5326 3   90.3957 41 -71510 3032013 7      211210        syn-C2H3C(O)NH2, v=0
   21688.0000  0.0500 -6.3863 3  230.3932 73 -71510 303361720      351817        syn-C2H3C(O)NH2, v=0
   21688.0000  0.0500 -6.3863 3  230.3932 73 -71510 303361719      351818        syn-C2H3C(O)NH2, v=0
   21748.1547  0.0002 -8.2991 3    1.6738  7  71510 303 3 2 2       2 2 1        syn-C2H3C(O)NH2, v=0
   21780.3400  0.0800 -7.2033 3  673.1768117 -71510 303583325      593228        syn-C2H3C(O)NH2, v=0
   21780.3400  0.0800 -7.2033 3  673.1768117 -71510 303583326      593227        syn-C2H3C(O)NH2, v=0
   21780.8446  0.0038 -7.5362 3  532.6518125  71510 303621449      631152        syn-C2H3C(O)NH2, v=0
   21785.1220  0.0125 -7.7038 3  998.8761149  71510 303743737      733836        syn-C2H3C(O)NH2, v=0
   21785.1220  0.0125 -7.7038 3  998.8761149  71510 303743738      733835        syn-C2H3C(O)NH2, v=0
   21806.4905  0.0018 -7.1458 3   62.5704 41  71510 30320 714      21 417        syn-C2H3C(O)NH2, v=0
   21858.3535  0.0022 -7.0715 3  285.1624 91  71510 303451035      441332        syn-C2H3C(O)NH2, v=0
   21866.0900  0.0500 -6.6440 3  314.3624 79 -71510 303392316      402219        syn-C2H3C(O)NH2, v=0
   21866.0900  0.0500 -6.6440 3  314.3624 79 -71510 303392317      402218        syn-C2H3C(O)NH2, v=0
   21880.4843  0.0053 -6.8922 3  129.4776 63  71510 30331 626      30 723        syn-C2H3C(O)NH2, v=0
   21898.4101  0.0023 -7.1766 3   38.6991 33  71510 30316 512      17 215        syn-C2H3C(O)NH2, v=0
   21919.1700  0.0800 -6.3058 3   27.5824 27 -71510 30313 5 8      12 6 7        syn-C2H3C(O)NH2, v=0
   21988.5500  0.0800 -6.2748 3   37.2537 31 -71510 30315 6 9      14 7 8        syn-C2H3C(O)NH2, v=0
   22034.5321  0.0043 -7.0422 3  274.4117 91  71510 30345 937      441034        syn-C2H3C(O)NH2, v=0
   22094.6663  0.0021 -8.3396 3  150.0866 65  71510 30332 923      32 924        syn-C2H3C(O)NH2, v=0
   22216.9200  0.0500 -6.2454 3   48.3743 35 -71510 30317 711      16 8 8        syn-C2H3C(O)NH2, v=0
   22221.7365  0.0223 -7.9745 3 1109.0042151  71510 303754233      764136        syn-C2H3C(O)NH2, v=0
   22221.7365  0.0223 -7.9745 3 1109.0042151  71510 303754234      764135        syn-C2H3C(O)NH2, v=0
   22288.2521  0.0019 -8.3682 3   48.0994 37  71510 30318 513      18 514        syn-C2H3C(O)NH2, v=0
   22325.9594  0.0002 -8.2762 3    1.6788  7  71510 303 3 2 1       2 2 0        syn-C2H3C(O)NH2, v=0
   22391.6700  0.0500 -6.9261 3  587.9088115 -71510 303572829      562928        syn-C2H3C(O)NH2, v=0
   22391.6700  0.0500 -6.9261 3  587.9088115 -71510 303572830      562927        syn-C2H3C(O)NH2, v=0
   22412.7700  0.0800 -6.5370 3   74.9538 37 -71510 3031812 7      1911 8        syn-C2H3C(O)NH2, v=0
   22412.7700  0.0800 -6.5370 3   74.9538 37 -71510 3031812 6      1911 9        syn-C2H3C(O)NH2, v=0
   22439.0500  0.0500 -6.2366 3   48.3742 35 -71510 30317 710      16 8 9        syn-C2H3C(O)NH2, v=0
   22468.8000  0.0500 -6.3886 3  256.9479 77 -71510 303381821      371918        syn-C2H3C(O)NH2, v=0
   22468.8000  0.0500 -6.3886 3  256.9479 77 -71510 303381820      371919        syn-C2H3C(O)NH2, v=0
   22542.3362  0.0033 -7.2068 3  320.5538 97  71510 303481038      49 941        syn-C2H3C(O)NH2, v=0
   22569.5323  0.0011 -6.3151 3   19.3600 23  71510 30311 4 7      10 5 6        syn-C2H3C(O)NH2, v=0
   22584.0700  0.0800 -7.1000 3  629.8341113 -71510 303563224      573127        syn-C2H3C(O)NH2, v=0
   22584.0700  0.0800 -7.1000 3  629.8341113 -71510 303563225      573126        syn-C2H3C(O)NH2, v=0
   22589.8120  0.0022 -8.6848 3  421.9889109  71510 303541539      541540        syn-C2H3C(O)NH2, v=0
   22618.4056  0.0152 -7.7726 3 1053.2338153  71510 303763838      753937        syn-C2H3C(O)NH2, v=0
   22618.4056  0.0152 -7.7726 3 1053.2338153  71510 303763839      753936        syn-C2H3C(O)NH2, v=0
   22639.0000  0.0800 -6.5814 3  284.9439 75 -71510 303372215      382118        syn-C2H3C(O)NH2, v=0
   22639.0000  0.0800 -6.5814 3  284.9439 75 -71510 303372216      382117        syn-C2H3C(O)NH2, v=0
   22646.2698  0.0016 -7.2022 3   30.9775 29  71510 30314 510      15 213        syn-C2H3C(O)NH2, v=0
   22739.8437  0.0005 -6.2550 3    3.3627 11  71510 303 5 1 4       4 2 3        syn-C2H3C(O)NH2, v=0
   22875.4514  0.0095 -7.7299 3  724.2444147  71510 303731559      721656        syn-C2H3C(O)NH2, v=0
   22893.6276  0.0591 -8.5159 3 1149.7317185  71510 303921874      912171        syn-C2H3C(O)NH2, v=0
   22918.6025  0.0048 -7.6406 3  620.6459135  71510 303671553      681256        syn-C2H3C(O)NH2, v=0
   22981.8500  0.0500 -6.2023 3   60.9439 39 -71510 30319 812      18 9 9        syn-C2H3C(O)NH2, v=0
   23018.9087  0.0022 -8.2937 3   92.0671 51  71510 30325 718      25 719        syn-C2H3C(O)NH2, v=0
   23054.2058  0.0019 -8.4388 3  268.8962 87  71510 303431231      431232        syn-C2H3C(O)NH2, v=0
   23056.7127  0.0187 -7.8403 3 1053.2443147  71510 303734132      744035        syn-C2H3C(O)NH2, v=0
   23056.7127  0.0187 -7.8403 3 1053.2443147  71510 303734133      744034        syn-C2H3C(O)NH2, v=0
   23057.6100  0.0500 -6.1994 3   60.9439 39 -71510 30319 811      18 910        syn-C2H3C(O)NH2, v=0
   23066.8210  0.0053 -7.5688 3  544.7686125  71510 303621547      611844        syn-C2H3C(O)NH2, v=0
   23106.0210  0.0002 -6.3374 3    0.9031  5  71510 303 2 2 1       2 1 2        syn-C2H3C(O)NH2, v=0
   23139.8800  0.0500 -6.5565 3   60.9606 33 -71510 3031611 6      1710 7        syn-C2H3C(O)NH2, v=0
   23139.8800  0.0500 -6.5564 3   60.9606 33 -71510 3031611 5      1710 8        syn-C2H3C(O)NH2, v=0
   23198.9500  0.0500 -6.9678 3  629.8402119 -71510 303592930      583029        syn-C2H3C(O)NH2, v=0
   23198.9500  0.0500 -6.9678 3  629.8402119 -71510 303592931      583028        syn-C2H3C(O)NH2, v=0
   23251.7400  0.0500 -6.3959 3  284.9478 81 -71510 303401922      392019        syn-C2H3C(O)NH2, v=0
   23251.7400  0.0500 -6.3959 3  284.9478 81 -71510 303401921      392020        syn-C2H3C(O)NH2, v=0
   23261.9140  0.0036 -7.3192 3  428.1994111  71510 303551342      541639        syn-C2H3C(O)NH2, v=0
   23264.5356  0.0033 -7.0840 3  370.2386105  71510 303521042      511339        syn-C2H3C(O)NH2, v=0
   23273.2359  0.0079 -7.7923 3  715.3360145  71510 303721557      731460        syn-C2H3C(O)NH2, v=0
   23384.1200  0.0500 -7.0016 3  587.9296109 -71510 303543123      553026        syn-C2H3C(O)NH2, v=0
   23384.1200  0.0500 -7.0016 3  587.9296109 -71510 303543124      553025        syn-C2H3C(O)NH2, v=0
   23407.9700  0.0500 -6.5249 3  256.9701 71 -71510 303352114      362017        syn-C2H3C(O)NH2, v=0
   23407.9700  0.0500 -6.5249 3  256.9701 71 -71510 303352115      362016        syn-C2H3C(O)NH2, v=0
   23430.9949  0.0002 -8.0298 3    1.0220  7  71510 303 3 1 2       2 1 1        syn-C2H3C(O)NH2, v=0
   23454.1993  0.0003 -5.8748 3    1.5662  9  71510 303 4 0 4       3 1 3        syn-C2H3C(O)NH2, v=0
   23454.9276  0.0184 -7.8457 3 1109.0216157  71510 303783939      774038        syn-C2H3C(O)NH2, v=0
   23454.9276  0.0184 -7.8457 3 1109.0216157  71510 303783940      774037        syn-C2H3C(O)NH2, v=0
   23682.4628  0.0044 -7.0385 3  161.8079 69  71510 30334 727      35 630        syn-C2H3C(O)NH2, v=0
   23682.9172  0.0044 -7.1767 3   56.5208 41  71510 30320 416      21 319        syn-C2H3C(O)NH2, v=0
   23703.2467  0.0026 -7.1156 3   42.8547 35  71510 30317 513      18 216        syn-C2H3C(O)NH2, v=0
   23722.5500  0.0500 -6.1675 3   74.9627 43 -71510 30321 913      201010        syn-C2H3C(O)NH2, v=0
   23747.5900  0.0500 -6.1666 3   74.9627 43 -71510 30321 912      201011        syn-C2H3C(O)NH2, v=0
   23857.2100  0.0800 -6.5953 3   48.4164 29 -71510 3031410 5      15 9 6        syn-C2H3C(O)NH2, v=0
   23857.2100  0.0800 -6.5953 3   48.4164 29 -71510 3031410 4      15 9 7        syn-C2H3C(O)NH2, v=0
   23887.6397  0.0155 -7.7108 3  998.9144143  71510 303714031      723934        syn-C2H3C(O)NH2, v=0
   23887.6397  0.0155 -7.7108 3  998.9144143  71510 303714032      723933        syn-C2H3C(O)NH2, v=0
   23904.6720  0.0386 -8.2467 3 1028.8787175  71510 303871770      862067        syn-C2H3C(O)NH2, v=0
   23977.7859  0.0010 -6.2923 3   12.5851 19  71510 303 9 3 6       8 4 5        syn-C2H3C(O)NH2, v=0
   24008.8400  0.0800 -7.0138 3  673.2099123 -71510 303613031      603130        syn-C2H3C(O)NH2, v=0
   24008.8400  0.0800 -7.0138 3  673.2099123 -71510 303613032      603129        syn-C2H3C(O)NH2, v=0
   24036.8700  0.0500 -6.4081 3  314.3926 85 -71510 303422022      412121        syn-C2H3C(O)NH2, v=0
   24036.8700  0.0500 -6.4081 3  314.3926 85 -71510 303422023      412120        syn-C2H3C(O)NH2, v=0
   24083.8103  0.0042 -6.7218 3   59.0510 43  71510 30321 418      20 515        syn-C2H3C(O)NH2, v=0
   24088.4880  0.0078 -7.7625 3  715.3358145  71510 303721657      731360        syn-C2H3C(O)NH2, v=0
   24112.6894  0.0029 -6.9234 3  291.4185 93  71510 30346 937      451234        syn-C2H3C(O)NH2, v=0
   24172.9500  0.0500 -6.4747 3  230.4415 67 -71510 303332013      341916        syn-C2H3C(O)NH2, v=0
   24172.9500  0.0500 -6.4747 3  230.4415 67 -71510 303332014      341915        syn-C2H3C(O)NH2, v=0
   24180.4800  0.0500 -6.9084 3  547.4641105 -71510 303523022      532925        syn-C2H3C(O)NH2, v=0
   24180.4800  0.0500 -6.9084 3  547.4641105 -71510 303523023      532924        syn-C2H3C(O)NH2, v=0
   24213.4172  0.0050 -6.7558 3   90.8570 53  71510 30326 522      25 619        syn-C2H3C(O)NH2, v=0
   24294.7610  0.0221 -7.9230 3 1166.2385161  71510 303804040      794139        syn-C2H3C(O)NH2, v=0
   24294.7610  0.0221 -7.9230 3 1166.2385161  71510 303804041      794138        syn-C2H3C(O)NH2, v=0
   24461.5900  0.0500 -6.1395 3   90.4302 47 -71510 303231014      221111        syn-C2H3C(O)NH2, v=0
   24469.9800  0.1000 -6.1392 3   90.4302 47 -71510 303231013      221112        syn-C2H3C(O)NH2, v=0
   24495.1308  0.0612 -8.4569 3 1149.6789185  71510 303921974      912071        syn-C2H3C(O)NH2, v=0
   24562.4200  0.1000 -6.6605 3   37.3213 25 -71510 30312 9 4      13 8 5        syn-C2H3C(O)NH2, v=0
   24562.4200  0.1000 -6.6605 3   37.3213 25 -71510 30312 9 3      13 8 6        syn-C2H3C(O)NH2, v=0
   24659.3767  0.0006 -5.4524 3    9.3408 17  71510 303 8 2 6       8 1 7        syn-C2H3C(O)NH2, v=0
   24666.1317  0.0028 -7.0987 3  137.4916 61  71510 303301021      31 724        syn-C2H3C(O)NH2, v=0
   24714.5474  0.0127 -7.5859 3  946.0157139  71510 303693930      703833        syn-C2H3C(O)NH2, v=0
   24714.5474  0.0127 -7.5859 3  946.0157139  71510 303693931      703832        syn-C2H3C(O)NH2, v=0
   24729.0277  0.0139 -7.9210 3  816.7154155  71510 303771661      781564        syn-C2H3C(O)NH2, v=0
   24821.2600  0.0500 -7.0642 3  718.0170127 -71510 303633132      623231        syn-C2H3C(O)NH2, v=0
   24821.2600  0.0500 -7.0642 3  718.0170127 -71510 303633133      623230        syn-C2H3C(O)NH2, v=0
   24824.1500  0.0500 -6.4252 3  345.2817 89 -71510 303442123      432222        syn-C2H3C(O)NH2, v=0
   24824.1500  0.0500 -6.4252 3  345.2817 89 -71510 303442124      432221        syn-C2H3C(O)NH2, v=0
   24826.2144  0.0022 -7.0676 3   82.2835 47  71510 30323 816      24 519        syn-C2H3C(O)NH2, v=0
   24837.3989  0.0033 -7.2197 3  389.6415107  71510 303531142      541045        syn-C2H3C(O)NH2, v=0
   24847.7551  0.0239 -7.9963 3  914.6950165  71510 303821666      811963        syn-C2H3C(O)NH2, v=0
   24853.5544  0.0008 -6.2534 3    7.2546 15  71510 303 7 2 5       6 3 4        syn-C2H3C(O)NH2, v=0
   24890.7035  0.0037 -6.9622 3  153.6039 67  71510 30333 826      34 529        syn-C2H3C(O)NH2, v=0
   24903.4880  0.0017 -8.3548 3   33.2563 31  71510 30315 411      15 412        syn-C2H3C(O)NH2, v=0
   24933.6600  0.0800 -6.4313 3  205.3588 63 -71510 303311912      321815        syn-C2H3C(O)NH2, v=0
   24933.6600  0.0800 -6.4313 3  205.3588 63 -71510 303311913      321814        syn-C2H3C(O)NH2, v=0
   24963.1113  0.0559 -8.5291 3 1452.0449173  71510 303864838      874741        syn-C2H3C(O)NH2, v=0
   24963.1113  0.0559 -8.5291 3 1452.0449173  71510 303864839      874740        syn-C2H3C(O)NH2, v=0
   24973.2000  0.0800 -6.8201 3  508.4384101 -71510 303502921      512824        syn-C2H3C(O)NH2, v=0
   24973.2000  0.0800 -6.8201 3  508.4384101 -71510 303502922      512823        syn-C2H3C(O)NH2, v=0
   24975.2524  0.0002 -6.0549 3    1.5662  7  71510 303 3 2 2       3 1 3        syn-C2H3C(O)NH2, v=0
   25029.2228  0.0022 -6.8548 3  258.0118 87  71510 30343 934      421231        syn-C2H3C(O)NH2, v=0
   25032.8484  0.0039 -7.3679 3  342.9048 97  71510 303481534      491237        syn-C2H3C(O)NH2, v=0
   25074.5310  0.0037 -6.9564 3  111.4059 57  71510 30328 722      29 425        syn-C2H3C(O)NH2, v=0
   25114.8896  0.0034 -6.9837 3  202.5302 77  71510 30338 930      39 633        syn-C2H3C(O)NH2, v=0
   25117.3738  0.0007 -5.7581 3    4.8028 13  71510 303 6 1 5       6 0 6        syn-C2H3C(O)NH2, v=0
   25137.9787  0.0263 -8.0046 3 1224.8834165  71510 303824141      814240        syn-C2H3C(O)NH2, v=0
   25137.9787  0.0263 -8.0046 3 1224.8834165  71510 303824142      814239        syn-C2H3C(O)NH2, v=0
   25150.0624  0.0037 -7.1351 3  444.1816115  71510 303571146      561443        syn-C2H3C(O)NH2, v=0
   25205.7400  0.1000 -6.1176 3  107.3463 51 -71510 303251115      241212        syn-C2H3C(O)NH2, v=0
   25208.2100  0.0500 -6.1175 3  107.3463 51 -71510 303251114      241213        syn-C2H3C(O)NH2, v=0
   25251.5012  0.0012 -6.7653 3   27.6756 21  71510 30310 8 3      11 7 4        syn-C2H3C(O)NH2, v=0
   25251.8919  0.0012 -6.7652 3   27.6756 21  71510 30310 8 2      11 7 5        syn-C2H3C(O)NH2, v=0
   25258.8545  0.0138 -7.9027 3  816.7153155  71510 303771761      781464        syn-C2H3C(O)NH2, v=0
   25287.4860  0.0016 -7.2795 3   19.1397 23  71510 30311 4 8      12 111        syn-C2H3C(O)NH2, v=0
   25353.2365  0.0002 -5.8587 3    0.7205  7  71510 303 3 1 3       2 0 2        syn-C2H3C(O)NH2, v=0
   25469.3707  0.0062 -7.6420 3  513.3103119  71510 303591842      601545        syn-C2H3C(O)NH2, v=0
   25537.4621  0.0104 -7.4657 3  894.5490135  71510 303673829      683732        syn-C2H3C(O)NH2, v=0
   25537.4621  0.0104 -7.4657 3  894.5490135  71510 303673830      683731        syn-C2H3C(O)NH2, v=0
   25565.1606  0.0022 -8.2701 3  188.9318 73  71510 303361026      361027        syn-C2H3C(O)NH2, v=0
   25572.6206  0.0014 -7.1785 3   27.4065 27  71510 30313 5 9      14 212        syn-C2H3C(O)NH2, v=0
   25613.6200  0.0500 -6.4468 3  377.6145 93 -71510 303462225      452322        syn-C2H3C(O)NH2, v=0
   25613.6200  0.0500 -6.4468 3  377.6145 93 -71510 303462224      452323        syn-C2H3C(O)NH2, v=0
   25636.4300  0.0800 -7.1189 3  764.2607131 -71510 303653233      643332        syn-C2H3C(O)NH2, v=0
   25636.4300  0.0800 -7.1189 3  764.2607131 -71510 303653234      643331        syn-C2H3C(O)NH2, v=0
   25652.1010  0.0140 -7.7669 3  807.1906155  71510 303771562      761859        syn-C2H3C(O)NH2, v=0
   25678.8051  0.0031 -7.0187 3  258.1812 87  71510 303431034      44 737        syn-C2H3C(O)NH2, v=0
   25689.6900  0.0500 -6.3949 3  181.7223 59 -71510 303291811      301714        syn-C2H3C(O)NH2, v=0
   25689.6900  0.0500 -6.3949 3  181.7223 59 -71510 303291812      301713        syn-C2H3C(O)NH2, v=0
   25694.5177  0.0034 -6.9740 3   75.9398 47  71510 30323 618      24 321        syn-C2H3C(O)NH2, v=0
   25727.1459  0.0045 -7.0716 3  396.1605109  71510 303541144      531241        syn-C2H3C(O)NH2, v=0
   25762.2100  0.1000 -6.7369 3  470.8531 97 -71510 303482820      492723        syn-C2H3C(O)NH2, v=0
   25762.2100  0.1000 -6.7369 3  470.8531 97 -71510 303482821      492722        syn-C2H3C(O)NH2, v=0
   25790.7500  0.0500 -6.1482 3   22.0836 25 -71510 30312 4 9      11 5 6        syn-C2H3C(O)NH2, v=0
   25821.0337  0.0485 -8.3789 3 1388.2121169  71510 303844737      854640        syn-C2H3C(O)NH2, v=0
   25821.0337  0.0485 -8.3789 3 1388.2121169  71510 303844738      854639        syn-C2H3C(O)NH2, v=0
   25910.1755  0.0019 -7.2378 3   22.0797 25  71510 30312 4 9      13 112        syn-C2H3C(O)NH2, v=0
   25919.9994  0.0010 -6.9389 3   19.4794 17  71510 303 8 7 2       9 6 3        syn-C2H3C(O)NH2, v=0
   25921.1040  0.0010 -6.9389 3   19.4794 17  71510 303 8 7 1       9 6 4        syn-C2H3C(O)NH2, v=0
   25955.6954  0.0015 -6.1013 3  125.7105 55  71510 303271216      261313        syn-C2H3C(O)NH2, v=0
   25956.5097  0.0015 -6.1013 3  125.7105 55  71510 303271215      261314        syn-C2H3C(O)NH2, v=0
   25975.3487  0.0061 -7.4458 3  628.8230137  71510 303681455      671552        syn-C2H3C(O)NH2, v=0
   25984.6536  0.0311 -8.0902 3 1284.9552169  71510 303844242      834341        syn-C2H3C(O)NH2, v=0
   25984.6536  0.0311 -8.0902 3 1284.9552169  71510 303844243      834340        syn-C2H3C(O)NH2, v=0
   26064.1521  0.0238 -8.0725 3  924.7775165  71510 303821765      831668        syn-C2H3C(O)NH2, v=0
   26074.3269  0.0021 -8.4213 3  320.1207 95  71510 303471334      471335        syn-C2H3C(O)NH2, v=0
   26108.8613  0.0014 -7.3096 3   16.3973 21  71510 30310 4 7      11 110        syn-C2H3C(O)NH2, v=0
   26139.4578  0.0042 -7.2389 3  524.8601125  71510 303621250      611547        syn-C2H3C(O)NH2, v=0
   26169.1086  0.0024 -6.5045 3   30.1697 31  71510 30315 313      14 410        syn-C2H3C(O)NH2, v=0
   26222.7068  0.0080 -7.5614 3  706.3761145  71510 303721458      711755        syn-C2H3C(O)NH2, v=0
   26245.7386  0.0009 -6.1994 3   17.3335 23  71510 30311 3 9      10 4 6        syn-C2H3C(O)NH2, v=0
   26263.9002  0.0011 -8.5617 3   11.6160 19  71510 303 9 2 7       9 2 8        syn-C2H3C(O)NH2, v=0
   26340.4783  0.0406 -8.1620 3 1028.7983175  71510 303871870      861967        syn-C2H3C(O)NH2, v=0
   26356.4052  0.0084 -7.3500 3  844.5154131  71510 303653728      663631        syn-C2H3C(O)NH2, v=0
   26356.4052  0.0084 -7.3500 3  844.5154131  71510 303653729      663630        syn-C2H3C(O)NH2, v=0
   26357.3067  0.0002 -7.7813 3    1.5662  9  71510 303 4 1 4       3 1 3        syn-C2H3C(O)NH2, v=0
   26391.8492  0.0014 -8.4106 3   21.0929 25  71510 30312 3 9      12 310        syn-C2H3C(O)NH2, v=0
   26405.2200  0.0800 -6.4730 3  411.3903 97 -71510 303482325      472424        syn-C2H3C(O)NH2, v=0
   26405.2200  0.0800 -6.4730 3  411.3903 97 -71510 303482326      472423        syn-C2H3C(O)NH2, v=0
   26406.7643  0.0236 -8.0612 3  924.7775165  71510 303821865      831568        syn-C2H3C(O)NH2, v=0
   26415.8926  0.0027 -6.8203 3  280.0339 91  71510 30345 936      441233        syn-C2H3C(O)NH2, v=0
   26436.3223  0.0052 -7.3836 3  612.2622135  71510 303671354      661651        syn-C2H3C(O)NH2, v=0
   26440.7900  0.0800 -6.3661 3  159.5324 55 -71510 303271710      281613        syn-C2H3C(O)NH2, v=0
   26440.7900  0.0800 -6.3661 3  159.5324 55 -71510 303271711      281612        syn-C2H3C(O)NH2, v=0
   26454.2563  0.0055 -7.1778 3  811.9401135  71510 303673334      663433        syn-C2H3C(O)NH2, v=0
   26454.2563  0.0055 -7.1778 3  811.9401135  71510 303673335      663432        syn-C2H3C(O)NH2, v=0
   26502.7662  0.0030 -7.0677 3  320.5528 97  71510 303481138      49 841        syn-C2H3C(O)NH2, v=0
   26547.2515  0.0018 -6.6588 3  434.7090 93  71510 303462719      472622        syn-C2H3C(O)NH2, v=0
   26547.2515  0.0018 -6.6588 3  434.7090 93  71510 303462720      472621        syn-C2H3C(O)NH2, v=0
   26559.8725  0.0009 -7.2713 3   12.7328 13  71510 303 6 6 1       7 5 2        syn-C2H3C(O)NH2, v=0
   26562.7886  0.0009 -7.2712 3   12.7327 13  71510 303 6 6 0       7 5 3        syn-C2H3C(O)NH2, v=0
   26617.0171  0.0029 -7.5893 3   16.9551 23  71510 30311 2 9      12 112        syn-C2H3C(O)NH2, v=0
   26628.6880  0.0038 -6.9701 3  211.9498 79  71510 30339 831      40 734        syn-C2H3C(O)NH2, v=0
   26657.9481  0.0016 -7.0899 3   41.0515 33  71510 30316 611      17 314        syn-C2H3C(O)NH2, v=0
   26674.5430  0.0419 -8.2332 3 1325.8028165  71510 303824636      834539        syn-C2H3C(O)NH2, v=0
   26674.5430  0.0419 -8.2332 3 1325.8028165  71510 303824637      834538        syn-C2H3C(O)NH2, v=0
   26688.1004  0.0029 -7.0341 3   47.2092 37  71510 30318 514      19 217        syn-C2H3C(O)NH2, v=0
   26711.2847  0.0015 -6.0905 3  145.5226 59  71510 303291317      281414        syn-C2H3C(O)NH2, v=0
   26711.5378  0.0015 -6.0904 3  145.5226 59  71510 303291316      281415        syn-C2H3C(O)NH2, v=0
   26766.6729  0.0002 -5.2854 3   12.4921 19  71510 303 9 3 6       9 2 7        syn-C2H3C(O)NH2, v=0
   26834.8581  0.0365 -8.1799 3 1346.4527173  71510 303864343      854442        syn-C2H3C(O)NH2, v=0
   26834.8581  0.0365 -8.1799 3 1346.4527173  71510 303864344      854441        syn-C2H3C(O)NH2, v=0
   26840.4635  0.0025 -6.7932 3  268.8962 89  71510 30344 935      431232        syn-C2H3C(O)NH2, v=0
   26856.9908  0.0036 -7.2673 3  465.4410117  71510 303581246      591149        syn-C2H3C(O)NH2, v=0
   26898.0675  0.0048 -6.7824 3  216.7457 81  71510 30340 833      39 930        syn-C2H3C(O)NH2, v=0
   26900.6689  0.0047 -6.9937 3   87.6822 51  71510 30325 520      26 423        syn-C2H3C(O)NH2, v=0
   27074.0425  0.0031 -7.1138 3  206.6398 75  71510 303371226      38 929        syn-C2H3C(O)NH2, v=0
   27148.8548  0.0025 -8.1830 3  122.9906 59  71510 30329 821      29 822        syn-C2H3C(O)NH2, v=0
   27171.3935  0.0067 -7.2389 3  795.9159127  71510 303633627      643530        syn-C2H3C(O)NH2, v=0
   27171.3935  0.0067 -7.2389 3  795.9159127  71510 303633628      643529        syn-C2H3C(O)NH2, v=0
   27185.8790  0.0023 -8.1972 3   71.0912 45  71510 30322 616      22 617        syn-C2H3C(O)NH2, v=0
   27186.4100  0.0500 -6.3456 3  138.7897 51 -71510 3032516 9      261512        syn-C2H3C(O)NH2, v=0
   27186.4100  0.0500 -6.3456 3  138.7897 51 -71510 303251610      261511        syn-C2H3C(O)NH2, v=0
   27199.1900  0.0500 -6.5035 3  446.6086101 -71510 303502426      492525        syn-C2H3C(O)NH2, v=0
   27199.1900  0.0500 -6.5035 3  446.6086101 -71510 303502427      492524        syn-C2H3C(O)NH2, v=0
   27258.9437  0.0003 -5.3438 3   10.1633 17  71510 303 8 3 5       8 2 6        syn-C2H3C(O)NH2, v=0
   27274.9976  0.0069 -7.2408 3  861.0544139  71510 303693435      683534        syn-C2H3C(O)NH2, v=0
   27274.9976  0.0069 -7.2408 3  861.0544139  71510 303693436      683533        syn-C2H3C(O)NH2, v=0
   27295.0334  0.0381 -8.2452 3 1039.5151175  71510 303871869      881772        syn-C2H3C(O)NH2, v=0
   27328.5300  0.0800 -6.5858 3  400.0068 89 -71510 303442618      452521        syn-C2H3C(O)NH2, v=0
   27328.5300  0.0800 -6.5858 3  400.0068 89 -71510 303442619      452520        syn-C2H3C(O)NH2, v=0
   27470.4739  0.0013 -7.6075 3    8.0519 15  71510 303 7 3 5       8 0 8        syn-C2H3C(O)NH2, v=0
   27471.7000  0.0500 -6.0848 3  166.7822 63 -71510 303311418      301515        syn-C2H3C(O)NH2, v=0
   27471.7000  0.0500 -6.0847 3  166.7822 63 -71510 303311417      301516        syn-C2H3C(O)NH2, v=0
   27499.7694  0.0003 -5.8645 3    2.4454  9  71510 303 4 2 3       4 1 4        syn-C2H3C(O)NH2, v=0
   27511.1001  0.0032 -7.1317 3  389.6409107  71510 303531242      54 945        syn-C2H3C(O)NH2, v=0
   27515.6681  0.0379 -8.2382 3 1039.5151175  71510 303871969      881672        syn-C2H3C(O)NH2, v=0
   27523.6768  0.0360 -8.0919 3 1264.8183161  71510 303804535      814438        syn-C2H3C(O)NH2, v=0
   27523.6768  0.0360 -8.0919 3 1264.8183161  71510 303804536      814437        syn-C2H3C(O)NH2, v=0
   27601.8591  0.0003 -5.2133 3   15.0568 21  71510 30310 3 7      10 2 8        syn-C2H3C(O)NH2, v=0
   27636.9957  0.0002 -7.7194 3    1.4267  9  71510 303 4 0 4       3 0 3        syn-C2H3C(O)NH2, v=0
   27688.6645  0.0426 -8.2735 3 1409.3747177  71510 303884444      874543        syn-C2H3C(O)NH2, v=0
   27688.6645  0.0426 -8.2735 3 1409.3747177  71510 303884445      874542        syn-C2H3C(O)NH2, v=0
   27782.4044  0.0010 -7.6907 3    6.3279 13  71510 303 6 3 4       7 0 7        syn-C2H3C(O)NH2, v=0
   27810.0262  0.0022 -7.1810 3   25.2187 27  71510 30313 410      14 113        syn-C2H3C(O)NH2, v=0
   27925.9500  0.0500 -6.3343 3  119.4945 47 -71510 3032315 8      241411        syn-C2H3C(O)NH2, v=0
   27925.9500  0.0500 -6.3343 3  119.4945 47 -71510 3032315 9      241410        syn-C2H3C(O)NH2, v=0
   27982.3600  0.0800 -7.1324 3  748.7513123 -71510 303613526      623429        syn-C2H3C(O)NH2, v=0
   27982.3600  0.0800 -7.1324 3  748.7513123 -71510 303613527      623428        syn-C2H3C(O)NH2, v=0
   27995.3400  0.0500 -6.5384 3  483.2686105 -71510 303522527      512626        syn-C2H3C(O)NH2, v=0
   27995.3400  0.0500 -6.5384 3  483.2686105 -71510 303522528      512625        syn-C2H3C(O)NH2, v=0
   28098.6533  0.0086 -7.3078 3  911.6025143  71510 303713536      703635        syn-C2H3C(O)NH2, v=0
   28098.6533  0.0086 -7.3078 3  911.6025143  71510 303713537      703634        syn-C2H3C(O)NH2, v=0
   28105.9300  0.0500 -6.5181 3  366.7471 85 -71510 303422517      432420        syn-C2H3C(O)NH2, v=0
   28105.9300  0.0500 -6.5181 3  366.7471 85 -71510 303422518      432419        syn-C2H3C(O)NH2, v=0
   28200.2800  0.0500 -6.0284 3   30.7922 29 -71510 30314 510      13 6 7        syn-C2H3C(O)NH2, v=0
   28236.2400  0.0500 -6.0840 3  189.4888 67 -71510 303331519      321616        syn-C2H3C(O)NH2, v=0
   28236.2400  0.0500 -6.0840 3  189.4888 67 -71510 303331518      321617        syn-C2H3C(O)NH2, v=0
   28368.4707  0.0307 -7.9548 3 1205.2597157  71510 303784434      794337        syn-C2H3C(O)NH2, v=0
   28368.4707  0.0307 -7.9548 3 1205.2597157  71510 303784435      794336        syn-C2H3C(O)NH2, v=0
   28431.9493  0.0581 -8.4379 3 1160.9204185  71510 303921973      931876        syn-C2H3C(O)NH2, v=0
   28438.4262  0.0015 -7.5411 3    9.9758 17  71510 303 8 3 6       9 0 9        syn-C2H3C(O)NH2, v=0
   28515.4204  0.0012 -7.3438 3   13.8505 19  71510 303 9 4 6      10 1 9        syn-C2H3C(O)NH2, v=0
   28524.8453  0.0257 -7.8757 3  914.5737165  71510 303821766      811863        syn-C2H3C(O)NH2, v=0
   28527.9828  0.0032 -6.8689 3  357.3541103  71510 303511041      501338        syn-C2H3C(O)NH2, v=0
   28546.1449  0.0494 -8.3711 3 1473.7201181  71510 303904545      894644        syn-C2H3C(O)NH2, v=0
   28546.1449  0.0494 -8.3711 3 1473.7201181  71510 303904546      894643        syn-C2H3C(O)NH2, v=0
   28573.5449  0.0579 -8.4336 3 1160.9203185  71510 303922073      931776        syn-C2H3C(O)NH2, v=0
   28639.1366  0.0034 -7.2120 3  465.4406117  71510 303581346      591049        syn-C2H3C(O)NH2, v=0
   28658.6700  0.0800 -6.3335 3  101.6472 43 -71510 3032114 8      2213 9        syn-C2H3C(O)NH2, v=0
   28658.6700  0.0800 -6.3335 3  101.6472 43 -71510 3032114 7      221310        syn-C2H3C(O)NH2, v=0
   28659.0298  0.0039 -7.3442 3  547.9472127  71510 303631350      641253        syn-C2H3C(O)NH2, v=0
   28706.2300  0.0500 -5.3976 3    8.0837 15 -71510 303 7 3 4       7 2 5        syn-C2H3C(O)NH2, v=0
   28789.5418  0.0042 -7.0303 3  703.0226119  71510 303593425      603328        syn-C2H3C(O)NH2, v=0
   28789.5418  0.0042 -7.0303 3  703.0226119  71510 303593426      603327        syn-C2H3C(O)NH2, v=0
   28793.8900  0.0500 -6.5776 3  521.3697109 -71510 303542628      532727        syn-C2H3C(O)NH2, v=0
   28793.8900  0.0500 -6.5776 3  521.3697109 -71510 303542629      532726        syn-C2H3C(O)NH2, v=0
   28806.9992  0.0148 -7.9130 3  717.7806141  71510 303702150      711853        syn-C2H3C(O)NH2, v=0
   28811.0443  0.0158 -7.7791 3  754.9566147  71510 303731855      722152        syn-C2H3C(O)NH2, v=0
   28879.2300  0.0800 -6.4558 3  334.9306 81 -71510 303402416      412319        syn-C2H3C(O)NH2, v=0
   28879.2300  0.0800 -6.4558 3  334.9306 81 -71510 303402417      412318        syn-C2H3C(O)NH2, v=0
   28881.8237  0.0002 -7.7998 3    2.3993  9  71510 303 4 2 3       3 2 2        syn-C2H3C(O)NH2, v=0
   28887.9482  0.0029 -6.9961 3  381.6453105  71510 303521240      511537        syn-C2H3C(O)NH2, v=0
   28925.2974  0.0106 -7.3789 3  963.5834147  71510 303733637      723736        syn-C2H3C(O)NH2, v=0
   28925.2974  0.0106 -7.3789 3  963.5834147  71510 303733638      723735        syn-C2H3C(O)NH2, v=0
   29004.4000  0.0500 -6.0881 3  213.6421 71 -71510 303351620      341717        syn-C2H3C(O)NH2, v=0
   29004.4000  0.0500 -6.0881 3  213.6421 71 -71510 303351619      341718        syn-C2H3C(O)NH2, v=0
   29179.5988  0.0023 -8.2240 3  232.2481 81  71510 303401129      401130        syn-C2H3C(O)NH2, v=0
   29208.9574  0.0261 -7.8221 3 1147.1282153  71510 303764333      774236        syn-C2H3C(O)NH2, v=0
   29208.9574  0.0261 -7.8221 3 1147.1282153  71510 303764334      774235        syn-C2H3C(O)NH2, v=0
   29225.3634  0.0025 -8.4223 3  375.8102103  71510 303511437      511438        syn-C2H3C(O)NH2, v=0
   29235.4079  0.0033 -6.9458 3  268.8163 89  71510 30344 935      45 838        syn-C2H3C(O)NH2, v=0
   29261.7455  0.0003 -8.0239 3    3.5877  9  71510 303 4 3 2       3 3 1        syn-C2H3C(O)NH2, v=0
   29313.2868  0.0023 -6.7815 3  296.5528 93  71510 303461036      451333        syn-C2H3C(O)NH2, v=0
   29330.9316  0.0003 -8.0218 3    3.5881  9  71510 303 4 3 1       3 3 0        syn-C2H3C(O)NH2, v=0
   29382.2125  0.0011 -6.1254 3   20.1128 25  71510 30312 310      11 4 7        syn-C2H3C(O)NH2, v=0
   29383.4900  0.0800 -6.3452 3   85.2480 39 -71510 3031913 7      2012 8        syn-C2H3C(O)NH2, v=0
   29383.4900  0.0800 -6.3452 3   85.2480 39 -71510 3031913 6      2012 9        syn-C2H3C(O)NH2, v=0
   29407.3708  0.0570 -8.4725 3 1539.4875185  71510 303924646      914745        syn-C2H3C(O)NH2, v=0
   29407.3708  0.0570 -8.4725 3 1539.4875185  71510 303924647      914744        syn-C2H3C(O)NH2, v=0
   29478.9866  0.0009 -7.8225 3    4.8028 11  71510 303 5 3 3       6 0 6        syn-C2H3C(O)NH2, v=0
   29493.3676  0.0019 -6.2821 3   26.5301 29  71510 30314 312      13 4 9        syn-C2H3C(O)NH2, v=0
   29571.7465  0.0038 -7.1879 3   35.8411 33  71510 30316 313      17 216        syn-C2H3C(O)NH2, v=0
   29592.7021  0.0034 -6.9329 3  658.7306115  71510 303573324      583227        syn-C2H3C(O)NH2, v=0
   29592.7021  0.0034 -6.9329 3  658.7306115  71510 303573325      583226        syn-C2H3C(O)NH2, v=0
   29594.8600  0.0500 -6.6208 3  560.9112113 -71510 303562729      552828        syn-C2H3C(O)NH2, v=0
   29594.8600  0.0500 -6.6208 3  560.9112113 -71510 303562730      552827        syn-C2H3C(O)NH2, v=0
   29608.7300  0.1000 -5.9614 3   40.9531 33 -71510 30316 611      15 7 8        syn-C2H3C(O)NH2, v=0
   29648.4000  0.0500 -6.3991 3  304.5579 77 -71510 303382315      392218        syn-C2H3C(O)NH2, v=0
   29648.4000  0.0500 -6.3991 3  304.5579 77 -71510 303382316      392217        syn-C2H3C(O)NH2, v=0
   29742.2322  0.0051 -7.1694 3  540.0739127  71510 303631351      621448        syn-C2H3C(O)NH2, v=0
   29755.0044  0.0130 -7.4538 3 1016.9964151  71510 303753738      743837        syn-C2H3C(O)NH2, v=0
   29755.0044  0.0130 -7.4538 3 1016.9964151  71510 303753739      743836        syn-C2H3C(O)NH2, v=0
   29775.8400  0.0500 -6.0969 3  239.2416 75 -71510 303371721      361818        syn-C2H3C(O)NH2, v=0
   29775.8400  0.0500 -6.0969 3  239.2416 75 -71510 303371720      361819        syn-C2H3C(O)NH2, v=0
   29804.5493  0.0009 -5.3054 3   11.4979 19  71510 303 9 2 7       9 1 8        syn-C2H3C(O)NH2, v=0
   29835.1346  0.0038 -7.3095 3  547.9469127  71510 303631450      641153        syn-C2H3C(O)NH2, v=0
   29987.1053  0.0020 -6.9967 3   57.3107 39  71510 30319 713      20 416        syn-C2H3C(O)NH2, v=0
   30007.2553  0.0006 -5.1236 3   17.8429 23  71510 30311 3 8      11 2 9        syn-C2H3C(O)NH2, v=0
   30045.1670  0.0219 -7.6936 3 1090.4249149  71510 303744232      754135        syn-C2H3C(O)NH2, v=0
   30045.1670  0.0219 -7.6936 3 1090.4249149  71510 303744233      754134        syn-C2H3C(O)NH2, v=0
   30071.4895  0.0046 -6.8683 3  125.5798 61  71510 30330 624      31 527        syn-C2H3C(O)NH2, v=0
   30099.0400  0.0800 -6.3721 3   70.2973 35 -71510 3031712 6      1811 7        syn-C2H3C(O)NH2, v=0
   30099.0400  0.0800 -6.3721 3   70.2973 35 -71510 3031712 5      1811 8        syn-C2H3C(O)NH2, v=0
   30241.6405  0.0003 -7.7589 3    2.4235  9  71510 303 4 2 2       3 2 1        syn-C2H3C(O)NH2, v=0
   30289.4747  0.0051 -7.4465 3  637.1544137  71510 303681454      691357        syn-C2H3C(O)NH2, v=0
   30378.4832  0.0014 -7.1618 3   24.0259 25  71510 30312 5 8      13 211        syn-C2H3C(O)NH2, v=0
   30392.0100  0.1000 -6.8399 3  615.8762111 -71510 303553223      563126        syn-C2H3C(O)NH2, v=0
   30392.0100  0.1000 -6.8399 3  615.8762111 -71510 303553224      563125        syn-C2H3C(O)NH2, v=0
   30398.3300  0.1000 -6.6682 3  601.8923117 -71510 303582830      572929        syn-C2H3C(O)NH2, v=0
   30398.3300  0.1000 -6.6682 3  601.8923117 -71510 303582831      572928        syn-C2H3C(O)NH2, v=0
   30413.1600  0.0500 -6.3481 3  275.6295 73 -71510 303362214      372117        syn-C2H3C(O)NH2, v=0
   30413.1600  0.0500 -6.3481 3  275.6295 73 -71510 303362215      372116        syn-C2H3C(O)NH2, v=0
   30540.1031  0.0003 -5.5711 3    1.4267  9  71510 303 4 1 4       3 0 3        syn-C2H3C(O)NH2, v=0
   30550.0473  0.0014 -6.1549 3   23.1770 27  71510 30313 311      12 4 8        syn-C2H3C(O)NH2, v=0
   30550.2950  0.0013 -6.1102 3  266.2868 79  71510 303391822      381919        syn-C2H3C(O)NH2, v=0
   30550.2956  0.0013 -6.1102 3  266.2868 79  71510 303391821      381920        syn-C2H3C(O)NH2, v=0
   30553.7301  0.0018 -7.4778 3   12.1005 19  71510 303 9 3 7      10 010        syn-C2H3C(O)NH2, v=0
   30556.5212  0.0014 -5.9190 3   52.5644 37  71510 30318 712      17 8 9        syn-C2H3C(O)NH2, v=0
   30562.3010  0.0037 -6.8581 3   81.7099 49  71510 30324 619      25 322        syn-C2H3C(O)NH2, v=0
   30587.8487  0.0159 -7.5326 3 1071.8401155  71510 303773839      763938        syn-C2H3C(O)NH2, v=0
   30587.8487  0.0159 -7.5326 3 1071.8401155  71510 303773840      763937        syn-C2H3C(O)NH2, v=0
   30626.8900  0.0500 -5.4583 3    6.2638 13 -71510 303 6 3 3       6 2 4        syn-C2H3C(O)NH2, v=0
   30646.7150  0.0032 -6.9441 3   51.7637 39  71510 30319 515      20 218        syn-C2H3C(O)NH2, v=0
   30678.9606  0.0004 -5.7084 3    3.5374 11  71510 303 5 2 4       5 1 5        syn-C2H3C(O)NH2, v=0
   30684.3622  0.0044 -6.8032 3  326.2739 99  71510 303491040      481137        syn-C2H3C(O)NH2, v=0
   30712.5857  0.0028 -6.9516 3  104.5880 53  71510 30326 918      27 621        syn-C2H3C(O)NH2, v=0
   30736.9330  0.0038 -6.8168 3  118.3921 59  71510 30329 723      30 426        syn-C2H3C(O)NH2, v=0
   30771.7067  0.0024 -6.8282 3  337.7635 99  71510 303491138      481435        syn-C2H3C(O)NH2, v=0
   30803.6300  0.1000 -6.4186 3   56.7953 31 -71510 3031511 5      1610 6        syn-C2H3C(O)NH2, v=0
   30803.6300  0.1000 -6.4186 3   56.7953 31 -71510 3031511 4      1610 7        syn-C2H3C(O)NH2, v=0
   30807.3274  0.0026 -7.1130 3   28.5580 29  71510 30314 411      15 114        syn-C2H3C(O)NH2, v=0
   30825.7259  0.0023 -8.1487 3   52.7859 39  71510 30319 514      19 515        syn-C2H3C(O)NH2, v=0
   30877.1261  0.0183 -7.5693 3 1035.1508145  71510 303724131      734034        syn-C2H3C(O)NH2, v=0
   30877.1261  0.0183 -7.5693 3 1035.1508145  71510 303724132      734033        syn-C2H3C(O)NH2, v=0
   30892.0500  0.0500 -5.4786 3    2.4454 11 -71510 303 5 0 5       4 1 4        syn-C2H3C(O)NH2, v=0
   30910.3834  0.0602 -8.2053 3  999.2194169  71510 303842163      832460        syn-C2H3C(O)NH2, v=0
   30920.6300  0.0500 -5.9221 3   40.9518 33 -71510 30316 610      15 7 9        syn-C2H3C(O)NH2, v=0
   31039.7018  0.0003 -7.6407 3    1.8036  9  71510 303 4 1 3       3 1 2        syn-C2H3C(O)NH2, v=0
   31041.9100  0.1000 -5.9049 3   52.5640 37 -71510 30318 711      17 810        syn-C2H3C(O)NH2, v=0
   31059.4915  0.0051 -7.4248 3  637.1543137  71510 303681554      691257        syn-C2H3C(O)NH2, v=0
   31151.0658  0.0154 -7.5969 3  807.0094155  71510 303771662      761759        syn-C2H3C(O)NH2, v=0
   31154.3861  0.0817 -8.4343 3 1253.3276193  71510 303961977      952274        syn-C2H3C(O)NH2, v=0
   31173.3000  0.0800 -6.3031 3  248.1460 69 -71510 303342113      352016        syn-C2H3C(O)NH2, v=0
   31173.3000  0.0800 -6.3031 3  248.1460 69 -71510 303342114      352015        syn-C2H3C(O)NH2, v=0
   31187.1200  0.0500 -6.7516 3  574.4602107 -71510 303533122      543025        syn-C2H3C(O)NH2, v=0
   31187.1200  0.0500 -6.7516 3  574.4602107 -71510 303533123      543024        syn-C2H3C(O)NH2, v=0
   31204.1300  0.0500 -6.7196 3  644.3122121 -71510 303602931      593030        syn-C2H3C(O)NH2, v=0
   31204.1300  0.0500 -6.7196 3  644.3122121 -71510 303602932      593029        syn-C2H3C(O)NH2, v=0
   31209.5134  0.0037 -6.8046 3  161.8062 69  71510 30334 827      35 530        syn-C2H3C(O)NH2, v=0
   31315.9753  0.0052 -6.5729 3  165.8181 71  71510 30335 729      34 826        syn-C2H3C(O)NH2, v=0
   31325.7900  0.0500 -5.8894 3   65.6254 41 -71510 30320 813      19 910        syn-C2H3C(O)NH2, v=0
   31327.5800  0.0500 -6.1280 3  294.7772 83 -71510 303411923      402020        syn-C2H3C(O)NH2, v=0
   31327.5800  0.0500 -6.1280 3  294.7772 83 -71510 303411922      402021        syn-C2H3C(O)NH2, v=0
   31423.9043  0.0192 -7.6153 3 1128.1138159  71510 303793940      784039        syn-C2H3C(O)NH2, v=0
   31423.9043  0.0192 -7.6153 3 1128.1138159  71510 303793941      784038        syn-C2H3C(O)NH2, v=0
   31424.2899  0.0026 -8.1014 3  158.3887 67  71510 30333 924      33 925        syn-C2H3C(O)NH2, v=0
   31489.1800  0.0800 -5.9258 3   30.7884 29 -71510 30314 5 9      13 6 8        syn-C2H3C(O)NH2, v=0
   31494.8900  0.1000 -6.4920 3   44.7423 27 -71510 3031310 4      14 9 5        syn-C2H3C(O)NH2, v=0
   31494.8900  0.1000 -6.4920 3   44.7423 27 -71510 3031310 3      14 9 6        syn-C2H3C(O)NH2, v=0
   31496.4500  0.0500 -5.8846 3   65.6252 41 -71510 30320 812      19 911        syn-C2H3C(O)NH2, v=0
   31532.4245  0.0031 -6.9583 3  332.4033 99  71510 303491039      50 942        syn-C2H3C(O)NH2, v=0
   31576.1540  0.0036 -6.8949 3  430.0451113  71510 303561145      551442        syn-C2H3C(O)NH2, v=0
   31685.3620  0.0009 -5.5795 3    6.3279 15  71510 303 7 1 6       7 0 7        syn-C2H3C(O)NH2, v=0
   31704.8574  0.0152 -7.4492 3  981.3071141  71510 303704030      713933        syn-C2H3C(O)NH2, v=0
   31704.8574  0.0152 -7.4492 3  981.3071141  71510 303704031      713932        syn-C2H3C(O)NH2, v=0
   31781.8612  0.0086 -7.5716 3  733.0567147  71510 303731558      741461        syn-C2H3C(O)NH2, v=0
   31924.9065  0.0632 -8.4110 3 1495.5776175  71510 303874938      884841        syn-C2H3C(O)NH2, v=0
   31924.9065  0.0632 -8.4110 3 1495.5776175  71510 303874939      884840        syn-C2H3C(O)NH2, v=0
   31928.7100  0.0800 -6.2646 3  222.1079 65 -71510 303322012      331915        syn-C2H3C(O)NH2, v=0
   31928.7100  0.0800 -6.2646 3  222.1079 65 -71510 303322013      331914        syn-C2H3C(O)NH2, v=0
   31951.9535  0.0034 -6.8147 3  211.9487 79  71510 30339 931      40 634        syn-C2H3C(O)NH2, v=0
   31978.4000  0.0800 -6.6679 3  534.4834103 -71510 303513021      522924        syn-C2H3C(O)NH2, v=0
   31978.4000  0.0800 -6.6679 3  534.4834103 -71510 303513022      522923        syn-C2H3C(O)NH2, v=0
   32012.7100  0.0800 -6.7749 3  688.1701125 -71510 303623032      613131        syn-C2H3C(O)NH2, v=0
   32012.7100  0.0800 -6.7749 3  688.1701125 -71510 303623033      613130        syn-C2H3C(O)NH2, v=0
   32040.8300  0.0500 -5.8676 3   80.1355 45 -71510 30322 914      211011        syn-C2H3C(O)NH2, v=0
   32098.8900  0.0800 -5.8660 3   80.1354 45 -71510 30322 913      211012        syn-C2H3C(O)NH2, v=0
   32107.6100  0.0500 -6.1500 3  324.7123 87 -71510 303432023      422122        syn-C2H3C(O)NH2, v=0
   32107.6100  0.0500 -6.1500 3  324.7123 87 -71510 303432024      422121        syn-C2H3C(O)NH2, v=0
   32166.2376  0.0554 -8.1620 3 1127.0225183  71510 303911873      902170        syn-C2H3C(O)NH2, v=0
   32169.3800  0.0800 -6.6061 3   34.1384 23 -71510 30311 9 3      12 8 4        syn-C2H3C(O)NH2, v=0
   32169.3800  0.0800 -6.6061 3   34.1384 23 -71510 30311 9 2      12 8 5        syn-C2H3C(O)NH2, v=0
   32210.0441  0.0027 -8.0674 3   98.5609 53  71510 30326 719      26 720        syn-C2H3C(O)NH2, v=0
   32263.2454  0.0229 -7.7017 3 1185.8162163  71510 303814041      804140        syn-C2H3C(O)NH2, v=0
   32263.2454  0.0229 -7.7017 3 1185.8162163  71510 303814042      804139        syn-C2H3C(O)NH2, v=0
   32282.7730  0.0085 -7.5581 3  733.0566147  71510 303731658      741361        syn-C2H3C(O)NH2, v=0
   32372.5993  0.0005 -5.7454 3    4.5608 13  71510 303 6 1 5       5 2 4        syn-C2H3C(O)NH2, v=0
   32430.7800  0.0500 -5.9082 3   25.0646 27 -71510 30313 410      12 5 7        syn-C2H3C(O)NH2, v=0
   32469.2694  0.0037 -6.3476 3   53.8142 41  71510 30320 417      19 514        syn-C2H3C(O)NH2, v=0
   32520.4800  0.0500 -5.5402 3    4.7119 11 -71510 303 5 3 2       5 2 3        syn-C2H3C(O)NH2, v=0
   32524.7405  0.0035 -7.1020 3  289.7024 89  71510 303441431      451134        syn-C2H3C(O)NH2, v=0
   32528.3794  0.0125 -7.3334 3  928.8948137  71510 303683929      693832        syn-C2H3C(O)NH2, v=0
   32528.3794  0.0125 -7.3334 3  928.8948137  71510 303683930      693831        syn-C2H3C(O)NH2, v=0
   32548.3730  0.0031 -6.7213 3  344.7013101  71510 303501040      491337        syn-C2H3C(O)NH2, v=0
   32593.4363  0.0011 -7.4103 3   11.4979 17  71510 303 8 4 5       9 1 8        syn-C2H3C(O)NH2, v=0
   32614.9937  0.0008 -8.0661 3    3.4758  9  71510 303 4 3 2       5 0 5        syn-C2H3C(O)NH2, v=0
   32678.8100  0.0500 -6.2329 3  197.5157 61 -71510 303301911      311814        syn-C2H3C(O)NH2, v=0
   32678.8100  0.0500 -6.2329 3  197.5157 61 -71510 303301912      311813        syn-C2H3C(O)NH2, v=0
   32703.7176  0.0041 -7.1058 3  492.1176119  71510 303591445      581742        syn-C2H3C(O)NH2, v=0
   32738.8305  0.0003 -7.4885 3    2.4454 11  71510 303 5 1 5       4 1 4        syn-C2H3C(O)NH2, v=0
   32748.5900  0.0800 -5.8519 3   96.0944 49 -71510 303241015      231112        syn-C2H3C(O)NH2, v=0
   32765.4800  0.0500 -6.5890 3  495.9466 99 -71510 303492920      502823        syn-C2H3C(O)NH2, v=0
   32765.4800  0.0500 -6.5890 3  495.9466 99 -71510 303492921      502822        syn-C2H3C(O)NH2, v=0
   32767.7900  0.0800 -5.8514 3   96.0944 49 -71510 303241014      231113        syn-C2H3C(O)NH2, v=0
   32782.3530  0.0068 -7.3657 3  616.5613133  71510 303661650      651947        syn-C2H3C(O)NH2, v=0
   32784.9390  0.0551 -8.2653 3 1430.8060171  71510 303854837      864740        syn-C2H3C(O)NH2, v=0
   32784.9390  0.0551 -8.2653 3 1430.8060171  71510 303854838      864739        syn-C2H3C(O)NH2, v=0
   32803.8215  0.0044 -6.9450 3   61.4762 43  71510 30321 417      22 320        syn-C2H3C(O)NH2, v=0
   32804.9426  0.0848 -8.3892 3 1253.2732193  71510 303962077      952174        syn-C2H3C(O)NH2, v=0
   32822.7700  0.0012 -6.7911 3   24.9837 19  71510 303 9 8 2      10 7 3        syn-C2H3C(O)NH2, v=0
   32822.8575  0.0012 -6.7911 3   24.9837 19  71510 303 9 8 1      10 7 4        syn-C2H3C(O)NH2, v=0
   32823.8100  0.0500 -6.8342 3  733.4653129 -71510 303643133      633232        syn-C2H3C(O)NH2, v=0
   32823.8100  0.0500 -6.8342 3  733.4653129 -71510 303643134      633231        syn-C2H3C(O)NH2, v=0
   32890.3600  0.1000 -6.1764 3  356.0915 91 -71510 303452124      442223        syn-C2H3C(O)NH2, v=0
   32890.3600  0.1000 -6.1764 3  356.0915 91 -71510 303452125      442222        syn-C2H3C(O)NH2, v=0
   32909.6957  0.0031 -6.8445 3  268.8155 89  71510 303441035      45 738        syn-C2H3C(O)NH2, v=0
   32935.5867  0.0024 -8.1986 3  280.0339 89  71510 303441232      441233        syn-C2H3C(O)NH2, v=0
   32991.3565  0.0042 -6.7928 3  170.2095 71  71510 30335 728      36 631        syn-C2H3C(O)NH2, v=0
   33105.1600  0.0500 -5.9024 3   22.0728 25 -71510 30312 4 8      11 5 7        syn-C2H3C(O)NH2, v=0
   33105.9459  0.0273 -7.7919 3 1244.9462167  71510 303834142      824241        syn-C2H3C(O)NH2, v=0
   33105.9459  0.0273 -7.7919 3 1244.9462167  71510 303834143      824240        syn-C2H3C(O)NH2, v=0
   33116.0100  0.0358 -7.9069 3 1007.3798173  71510 303861769      852066        syn-C2H3C(O)NH2, v=0
   33159.3342  0.0152 -7.7179 3  835.6475157  71510 303781662      791565        syn-C2H3C(O)NH2, v=0
   33347.7057  0.0102 -7.2218 3  877.9149133  71510 303663828      673731        syn-C2H3C(O)NH2, v=0
   33347.7057  0.0102 -7.2218 3  877.9149133  71510 303663829      673730        syn-C2H3C(O)NH2, v=0
   33423.2600  0.0500 -6.2085 3  174.3699 57 -71510 303281810      291713        syn-C2H3C(O)NH2, v=0
   33423.2600  0.0500 -6.2085 3  174.3699 57 -71510 303281811      291712        syn-C2H3C(O)NH2, v=0
   33448.7342  0.0010 -7.1385 3   17.2784 15  71510 303 7 7 1       8 6 2        syn-C2H3C(O)NH2, v=0
   33448.9567  0.0010 -7.1385 3   17.2784 15  71510 303 7 7 0       8 6 3        syn-C2H3C(O)NH2, v=0
   33463.3200  0.0500 -5.8414 3  113.5017 53 -71510 303261116      251213        syn-C2H3C(O)NH2, v=0
   33465.9196  0.0020 -8.1523 3   37.1529 33  71510 30316 412      16 413        syn-C2H3C(O)NH2, v=0
   33469.5400  0.0500 -5.8412 3  113.5017 53 -71510 303261115      251214        syn-C2H3C(O)NH2, v=0
   33479.3842  0.0041 -6.9780 3  509.4799123  71510 303611249      601546        syn-C2H3C(O)NH2, v=0
   33483.4737  0.0151 -7.7095 3  835.6474157  71510 303781762      791465        syn-C2H3C(O)NH2, v=0
   33548.5100  0.0500 -6.5148 3  458.8504 95 -71510 303472819      482722        syn-C2H3C(O)NH2, v=0
   33548.5100  0.0500 -6.5148 3  458.8504 95 -71510 303472820      482721        syn-C2H3C(O)NH2, v=0
   33555.5552  0.0054 -7.3256 3  447.7525111  71510 303551739      561442        syn-C2H3C(O)NH2, v=0
   33572.6753  0.0033 -7.0019 3  402.7063109  71510 303541143      551046        syn-C2H3C(O)NH2, v=0
   33637.6725  0.0047 -6.8973 3  780.1968133  71510 303663234      653333        syn-C2H3C(O)NH2, v=0
   33637.6725  0.0047 -6.8973 3  780.1968133  71510 303663235      653332        syn-C2H3C(O)NH2, v=0
   33640.3888  0.0478 -8.1237 3 1367.4571167  71510 303834736      844639        syn-C2H3C(O)NH2, v=0
   33640.3888  0.0478 -8.1237 3 1367.4571167  71510 303834737      844638        syn-C2H3C(O)NH2, v=0
   33666.0004  0.0021 -7.4139 3   14.4265 21  71510 30310 3 8      11 011        syn-C2H3C(O)NH2, v=0
   33675.4200  0.0500 -6.2068 3  388.9141 95 -71510 303472225      462324        syn-C2H3C(O)NH2, v=0
   33675.4200  0.0500 -6.2068 3  388.9141 95 -71510 303472226      462323        syn-C2H3C(O)NH2, v=0
   33688.1978  0.0033 -6.9318 3  165.8181 67  71510 303331123      34 826        syn-C2H3C(O)NH2, v=0
   33756.6510  0.0024 -6.6446 3  308.2071 95  71510 303471037      461334        syn-C2H3C(O)NH2, v=0
   33795.1486  0.0003 -7.4520 3    2.3485 11  71510 303 5 0 5       4 0 4        syn-C2H3C(O)NH2, v=0
   33932.2136  0.0220 -7.6709 3  894.4097163  71510 303811665      801962        syn-C2H3C(O)NH2, v=0
   33952.0794  0.0322 -7.8858 3 1305.5028171  71510 303854243      844342        syn-C2H3C(O)NH2, v=0
   33952.0794  0.0322 -7.8858 3 1305.5028171  71510 303854244      844341        syn-C2H3C(O)NH2, v=0
   33983.0440  0.0013 -8.3712 3   13.9233 21  71510 30310 2 8      10 2 9        syn-C2H3C(O)NH2, v=0
   34002.4500  0.0800 -5.6686 3    3.4322  9 -71510 303 4 3 1       4 2 2        syn-C2H3C(O)NH2, v=0
   34023.1518  0.0030 -6.8931 3  332.4028 99  71510 303491139      50 842        syn-C2H3C(O)NH2, v=0
   34086.3292  0.0009 -5.0192 3   20.8362 25  71510 30312 3 9      12 210        syn-C2H3C(O)NH2, v=0
   34154.1702  0.0017 -7.0277 3   36.8275 31  71510 30315 610      16 313        syn-C2H3C(O)NH2, v=0
   34161.5900  0.0500 -6.1923 3  152.6708 53 -71510 3032617 9      271612        syn-C2H3C(O)NH2, v=0
   34161.5900  0.0500 -6.1923 3  152.6708 53 -71510 303261710      271611        syn-C2H3C(O)NH2, v=0
   34162.8441  0.0082 -7.1144 3  828.3683129  71510 303643727      653630        syn-C2H3C(O)NH2, v=0
   34162.8441  0.0082 -7.1144 3  828.3683129  71510 303643728      653629        syn-C2H3C(O)NH2, v=0
   34188.2200  0.1000 -5.8357 3  132.3572 57 -71510 303281217      271314        syn-C2H3C(O)NH2, v=0
   34190.1100  0.0800 -5.8356 3  132.3572 57 -71510 303281216      271315        syn-C2H3C(O)NH2, v=0
   34269.0222  0.0049 -6.9022 3  458.0004117  71510 303581247      571344        syn-C2H3C(O)NH2, v=0
   34327.3400  0.0500 -6.4455 3  423.1956 91 -71510 303452718      462621        syn-C2H3C(O)NH2, v=0
   34327.3400  0.0500 -6.4455 3  423.1956 91 -71510 303452719      462620        syn-C2H3C(O)NH2, v=0
   34348.0429  0.0091 -7.3246 3  706.1085145  71510 303721558      711655        syn-C2H3C(O)NH2, v=0
   34362.7808  0.0052 -6.4207 3  121.6633 61  71510 30330 625      29 722        syn-C2H3C(O)NH2, v=0
   34437.1294  0.0257 -7.8841 3  944.9200167  71510 303831766      841669        syn-C2H3C(O)NH2, v=0
   34454.3424  0.0058 -6.9642 3  828.3637137  71510 303683335      673434        syn-C2H3C(O)NH2, v=0
   34454.3424  0.0058 -6.9642 3  828.3637137  71510 303683336      673433        syn-C2H3C(O)NH2, v=0
   34463.2200  0.0800 -6.2414 3  423.1797 99 -71510 303492326      482425        syn-C2H3C(O)NH2, v=0
   34463.2200  0.0800 -6.2414 3  423.1797 99 -71510 303492327      482424        syn-C2H3C(O)NH2, v=0
   34465.4398  0.0050 -7.1046 3  595.6462133  71510 303661353      651650        syn-C2H3C(O)NH2, v=0
   34486.2479  0.0005 -5.5716 3    4.8393 13  71510 303 6 2 5       6 1 6        syn-C2H3C(O)NH2, v=0
   34491.2887  0.0413 -7.9860 3 1305.5321163  71510 303814635      824538        syn-C2H3C(O)NH2, v=0
   34491.2887  0.0413 -7.9860 3 1305.5321163  71510 303814636      824537        syn-C2H3C(O)NH2, v=0
   34518.4093  0.0128 -7.4562 3  788.1232153  71510 303761561      751858        syn-C2H3C(O)NH2, v=0
   34530.3596  0.0031 -7.4339 3   19.6844 25  71510 30312 210      13 113        syn-C2H3C(O)NH2, v=0
   34645.9670  0.0256 -7.8789 3  944.9200167  71510 303831866      841569        syn-C2H3C(O)NH2, v=0
   34655.0030  0.0017 -8.2180 3   24.1961 27  71510 30313 310      13 311        syn-C2H3C(O)NH2, v=0
   34675.4865  0.0584 -8.0964 3 1126.9398183  71510 303911973      902070        syn-C2H3C(O)NH2, v=0
   34717.3989  0.0029 -7.0401 3   32.0983 31  71510 30315 412      16 115        syn-C2H3C(O)NH2, v=0
   34748.7647  0.0074 -7.2660 3  688.5314143  71510 303711457      701754        syn-C2H3C(O)NH2, v=0
   34801.7194  0.0377 -7.9833 3 1367.4848175  71510 303874344      864443        syn-C2H3C(O)NH2, v=0
   34801.7194  0.0377 -7.9833 3 1367.4848175  71510 303874345      864442        syn-C2H3C(O)NH2, v=0
   34893.1000  0.0500 -6.1853 3  132.4190 49 -71510 3032416 8      251511        syn-C2H3C(O)NH2, v=0
   34893.1000  0.0500 -6.1853 3  132.4190 49 -71510 3032416 9      251510        syn-C2H3C(O)NH2, v=0
   34913.0694  0.0003 -5.9147 3    2.4235  7  71510 303 3 3 0       3 2 1        syn-C2H3C(O)NH2, v=0
   34922.2502  0.0015 -5.8347 3  152.6604 61  71510 303301318      291415        syn-C2H3C(O)NH2, v=0
   34922.8750  0.0015 -5.8347 3  152.6604 61  71510 303301317      291416        syn-C2H3C(O)NH2, v=0
   34973.7962  0.0066 -7.0112 3  780.2561125  71510 303623626      633529        syn-C2H3C(O)NH2, v=0
   34973.7962  0.0066 -7.0112 3  780.2561125  71510 303623627      633528        syn-C2H3C(O)NH2, v=0
   34999.4870  0.0029 -6.6321 3  332.2877 99  71510 303491039      481336        syn-C2H3C(O)NH2, v=0
   35031.8308  0.0047 -6.3377 3   84.3183 51  71510 30325 521      24 618        syn-C2H3C(O)NH2, v=0
   35101.7200  0.1000 -6.3812 3  388.9829 87 -71510 303432617      442520        syn-C2H3C(O)NH2, v=0
   35101.7200  0.1000 -6.3812 3  388.9829 87 -71510 303432618      442519        syn-C2H3C(O)NH2, v=0
   35169.3650  0.0555 -8.1984 3  956.2346163  71510 303812458      822161        syn-C2H3C(O)NH2, v=0
   35229.0286  0.0002 -5.7154 3    0.4987  5  71510 303 2 2 1       1 1 0        syn-C2H3C(O)NH2, v=0
   35238.0873  0.0031 -6.9603 3  402.7059109  71510 303541243      55 946        syn-C2H3C(O)NH2, v=0
   35252.5632  0.0012 -5.8468 3   14.8016 21  71510 30310 3 7       9 4 6        syn-C2H3C(O)NH2, v=0
   35253.4300  0.0500 -6.2800 3  458.8875103 -71510 303512427      502526        syn-C2H3C(O)NH2, v=0
   35253.4300  0.0500 -6.2800 3  458.8875103 -71510 303512428      502525        syn-C2H3C(O)NH2, v=0
   35273.8733  0.0073 -7.0348 3  877.9651141  71510 303703436      693535        syn-C2H3C(O)NH2, v=0
   35273.8733  0.0073 -7.0348 3  877.9651141  71510 303703437      693534        syn-C2H3C(O)NH2, v=0
   35318.7800  0.1000 -4.9201 3   25.3520 27 -71510 30313 4 9      13 310        syn-C2H3C(O)NH2, v=0
   35337.6685  0.0354 -7.8523 3 1245.0322159  71510 303794534      804437        syn-C2H3C(O)NH2, v=0
   35337.6685  0.0354 -7.8523 3 1245.0322159  71510 303794535      804436        syn-C2H3C(O)NH2, v=0
   35380.1600  0.0035 -6.8545 3   56.5188 41  71510 30320 516      21 219        syn-C2H3C(O)NH2, v=0
   35407.8355  0.0035 -7.0725 3  479.7204119  71510 303591247      601150        syn-C2H3C(O)NH2, v=0
   35526.9148  0.0027 -6.6030 3  320.1207 97  71510 303481038      471335        syn-C2H3C(O)NH2, v=0
   35604.2995  0.0036 -6.7594 3  221.5676 81  71510 30340 832      41 735        syn-C2H3C(O)NH2, v=0
   35616.9200  0.0800 -6.1888 3  113.6147 45 -71510 3032215 7      231410        syn-C2H3C(O)NH2, v=0
   35616.9200  0.0800 -6.1888 3  113.6147 45 -71510 3032215 8      2314 9        syn-C2H3C(O)NH2, v=0
   35624.7606  0.0409 -8.0693 3 1060.8668177  71510 303881870      891773        syn-C2H3C(O)NH2, v=0
   35627.3437  0.0003 -5.9027 3    2.3993  7  71510 303 3 3 1       3 2 2        syn-C2H3C(O)NH2, v=0
   35641.9378  0.0003 -5.3239 3    2.3485 11  71510 303 5 1 5       4 0 4        syn-C2H3C(O)NH2, v=0
   35654.9390  0.0440 -8.0845 3 1430.8909179  71510 303894445      884544        syn-C2H3C(O)NH2, v=0
   35654.9390  0.0440 -8.0845 3 1430.8909179  71510 303894446      884543        syn-C2H3C(O)NH2, v=0
   35664.5800  0.0500 -5.8383 3  174.4110 65 -71510 303321419      311516        syn-C2H3C(O)NH2, v=0
   35664.5800  0.0500 -5.8383 3  174.4110 65 -71510 303321418      311517        syn-C2H3C(O)NH2, v=0
   35758.8237  0.0408 -8.0660 3 1060.8668177  71510 303881970      891673        syn-C2H3C(O)NH2, v=0
   35780.5900  0.0800 -6.9123 3  733.5791121 -71510 303603525      613428        syn-C2H3C(O)NH2, v=0
   35780.5900  0.0800 -6.9123 3  733.5791121 -71510 303603526      613427        syn-C2H3C(O)NH2, v=0
   35829.3849  0.0009 -5.7769 3    8.9682 17  71510 303 8 2 6       7 3 5        syn-C2H3C(O)NH2, v=0
   35843.7328  0.0027 -8.0446 3  198.2603 75  71510 303371027      371028        syn-C2H3C(O)NH2, v=0
   35871.8348  0.0018 -6.3222 3  356.2129 83  71510 303412516      422419        syn-C2H3C(O)NH2, v=0
   35871.8348  0.0018 -6.3222 3  356.2129 83  71510 303412517      422418        syn-C2H3C(O)NH2, v=0
   35918.0216  0.0003 -7.4673 3    3.3627 11  71510 303 5 2 4       4 2 3        syn-C2H3C(O)NH2, v=0
   35935.6119  0.0011 -5.7709 3   34.2586 31  71510 30315 511      14 6 8        syn-C2H3C(O)NH2, v=0
   35978.8324  0.0046 -6.5614 3  263.0918 89  71510 30344 936      431033        syn-C2H3C(O)NH2, v=0
   35986.3917  0.0026 -6.8887 3   76.1694 45  71510 30322 815      23 518        syn-C2H3C(O)NH2, v=0
   35989.0584  0.0046 -6.7856 3   93.8530 53  71510 30326 521      27 424        syn-C2H3C(O)NH2, v=0
   36007.2655  0.0003 -5.6362 3    3.3627  9  71510 303 4 3 2       4 2 3        syn-C2H3C(O)NH2, v=0
   36044.8823  0.0038 -6.7520 3   87.6806 51  71510 30325 620      26 323        syn-C2H3C(O)NH2, v=0
   36046.2800  0.0500 -6.3225 3  496.0369107 -71510 303532528      522627        syn-C2H3C(O)NH2, v=0
   36046.2800  0.0500 -6.3225 3  496.0369107 -71510 303532529      522626        syn-C2H3C(O)NH2, v=0
   36089.0700  0.1000 -4.9521 3   21.9732 25 -71510 30312 4 8      12 3 9        syn-C2H3C(O)NH2, v=0
   36096.3362  0.0090 -7.1092 3  929.0001145  71510 303723537      713636        syn-C2H3C(O)NH2, v=0
   36096.3362  0.0090 -7.1092 3  929.0001145  71510 303723538      713635        syn-C2H3C(O)NH2, v=0
   36123.6000  0.1000 -4.8716 3   28.9647 29 -71510 30314 410      14 311        syn-C2H3C(O)NH2, v=0
   36166.1245  0.0011 -5.1626 3   13.8505 21  71510 30310 2 8      10 1 9        syn-C2H3C(O)NH2, v=0
   36179.5556  0.0302 -7.7226 3 1185.9586155  71510 303774433      784336        syn-C2H3C(O)NH2, v=0
   36179.5556  0.0302 -7.7226 3 1185.9586155  71510 303774434      784335        syn-C2H3C(O)NH2, v=0
   36332.1100  0.0500 -6.2048 3   96.2583 41 -71510 3032014 6      2113 9        syn-C2H3C(O)NH2, v=0
   36332.1100  0.0500 -6.2048 3   96.2583 41 -71510 3032014 7      2113 8        syn-C2H3C(O)NH2, v=0
   36413.6300  0.1000 -5.8463 3  197.6086 69 -71510 303341520      331617        syn-C2H3C(O)NH2, v=0
   36413.6300  0.1000 -5.8463 3  197.6086 69 -71510 303341519      331618        syn-C2H3C(O)NH2, v=0
   36509.5851  0.0034 -7.0461 3  479.7201119  71510 303591347      601050        syn-C2H3C(O)NH2, v=0
   36511.8110  0.0510 -8.1893 3 1495.7199183  71510 303914546      904645        syn-C2H3C(O)NH2, v=0
   36511.8110  0.0510 -8.1893 3 1495.7199183  71510 303914547      904644        syn-C2H3C(O)NH2, v=0
   36565.0719  0.0002 -5.7222 3    0.4591  5  71510 303 2 2 0       1 1 1        syn-C2H3C(O)NH2, v=0
   36574.8731  0.0003 -7.8235 3    6.2155 11  71510 303 5 4 2       4 4 1        syn-C2H3C(O)NH2, v=0
   36580.9052  0.0003 -7.8233 3    6.2155 11  71510 303 5 4 1       4 4 0        syn-C2H3C(O)NH2, v=0
   36583.1000  0.0500 -6.8177 3  688.3381117 -71510 303583424      593327        syn-C2H3C(O)NH2, v=0
   36583.1000  0.0500 -6.8177 3  688.3381117 -71510 303583425      593326        syn-C2H3C(O)NH2, v=0
   36637.2700  0.0500 -6.2684 3  324.8863 79 -71510 303392415      402318        syn-C2H3C(O)NH2, v=0
   36637.2700  0.0500 -6.2684 3  324.8863 79 -71510 303392416      402317        syn-C2H3C(O)NH2, v=0
   36644.9682  0.0003 -7.5688 3    4.5637 11  71510 303 5 3 3       4 3 2        syn-C2H3C(O)NH2, v=0
   36727.7237  0.0618 -8.2729 3 1183.4801187  71510 303931974      941877        syn-C2H3C(O)NH2, v=0
   36734.2121  0.0003 -5.4757 3    4.5608 11  71510 303 5 3 3       5 2 4        syn-C2H3C(O)NH2, v=0
   36813.5253  0.0617 -8.2709 3 1183.4801187  71510 303932074      941777        syn-C2H3C(O)NH2, v=0
   36828.3293  0.0027 -7.9934 3   76.7969 47  71510 30323 617      23 618        syn-C2H3C(O)NH2, v=0
   36830.5457  0.0026 -8.1921 3  332.2877 97  71510 303481335      481336        syn-C2H3C(O)NH2, v=0
   36841.6600  0.0500 -6.3690 3  534.6271111 -71510 303552629      542728        syn-C2H3C(O)NH2, v=0
   36841.6600  0.0500 -6.3690 3  534.6271111 -71510 303552630      542727        syn-C2H3C(O)NH2, v=0
   36853.7958  0.0039 -6.6976 3  125.5785 61  71510 30330 724      31 427        syn-C2H3C(O)NH2, v=0
   36881.7595  0.0003 -7.5632 3    4.5664 11  71510 303 5 3 2       4 3 1        syn-C2H3C(O)NH2, v=0
   36902.9927  0.0386 -7.8122 3 1007.2549173  71510 303861869      851966        syn-C2H3C(O)NH2, v=0
   36921.8026  0.0111 -7.1873 3  981.4677149  71510 303743638      733737        syn-C2H3C(O)NH2, v=0
   36921.8026  0.0111 -7.1873 3  981.4677149  71510 303743639      733736        syn-C2H3C(O)NH2, v=0
   37016.9739  0.0257 -7.5970 3 1128.3124151  71510 303754332      764235        syn-C2H3C(O)NH2, v=0
   37016.9739  0.0257 -7.5970 3 1128.3124151  71510 303754333      764234        syn-C2H3C(O)NH2, v=0
   37037.2600  0.1000 -6.2362 3   80.3501 37 -71510 3031813 6      1912 7        syn-C2H3C(O)NH2, v=0
   37037.2600  0.1000 -6.2362 3   80.3501 37 -71510 3031813 5      1912 8        syn-C2H3C(O)NH2, v=0
   37042.7236  0.0035 -6.7166 3  416.1321111  71510 303551144      541441        syn-C2H3C(O)NH2, v=0
   37069.9382  0.0014 -7.1822 3   20.8362 23  71510 30311 5 7      12 210        syn-C2H3C(O)NH2, v=0
   37079.8190  0.0040 -7.1671 3  563.4404129  71510 303641351      651254        syn-C2H3C(O)NH2, v=0
   37168.2800  0.0800 -5.8586 3  222.2527 73 -71510 303361621      351718        syn-C2H3C(O)NH2, v=0
   37168.2800  0.0800 -5.8586 3  222.2527 73 -71510 303361620      351719        syn-C2H3C(O)NH2, v=0
   37278.5436  0.0097 -7.5775 3  639.8970133  71510 303662047      671750        syn-C2H3C(O)NH2, v=0
   37364.7550  0.0029 -7.9703 3  130.5079 61  71510 30330 822      30 823        syn-C2H3C(O)NH2, v=0
   37372.4077  0.0588 -8.2976 3 1561.9707187  71510 303934647      924746        syn-C2H3C(O)NH2, v=0
   37372.4077  0.0588 -8.2976 3 1561.9707187  71510 303934648      924745        syn-C2H3C(O)NH2, v=0
   37381.4700  0.0800 -6.7275 3  644.5342113 -71510 303563323      573226        syn-C2H3C(O)NH2, v=0
   37381.4700  0.0800 -6.7275 3  644.5342113 -71510 303563324      573225        syn-C2H3C(O)NH2, v=0
   37397.8300  0.0500 -6.2203 3  295.0035 75 -71510 303372314      382217        syn-C2H3C(O)NH2, v=0
   37397.8300  0.0500 -6.2203 3  295.0035 75 -71510 303372315      382216        syn-C2H3C(O)NH2, v=0
   37614.4299  0.0024 -7.3502 3   16.9543 23  71510 30311 3 9      12 012        syn-C2H3C(O)NH2, v=0
   37639.6600  0.0800 -6.4192 3  574.6575115 -71510 303572730      562829        syn-C2H3C(O)NH2, v=0
   37639.6600  0.0800 -6.4192 3  574.6575115 -71510 303572731      562828        syn-C2H3C(O)NH2, v=0
   37730.6100  0.1000 -6.2876 3   65.8904 33 -71510 3031612 5      1711 6        syn-C2H3C(O)NH2, v=0
   37730.6100  0.1000 -6.2876 3   65.8904 33 -71510 3031612 4      1711 7        syn-C2H3C(O)NH2, v=0
   37750.3443  0.0137 -7.2690 3 1035.3670153  71510 303763739      753838        syn-C2H3C(O)NH2, v=0
   37750.3443  0.0137 -7.2690 3 1035.3670153  71510 303763740      753837        syn-C2H3C(O)NH2, v=0
   37802.5259  0.0039 -7.1505 3  563.4403129  71510 303641451      651154        syn-C2H3C(O)NH2, v=0
   37836.6172  0.0037 -6.6767 3  170.2086 71  71510 30335 828      36 531        syn-C2H3C(O)NH2, v=0
   37849.9436  0.0216 -7.4753 3 1072.0947147  71510 303734231      744134        syn-C2H3C(O)NH2, v=0
   37849.9436  0.0216 -7.4753 3 1072.0947147  71510 303734232      744133        syn-C2H3C(O)NH2, v=0
   37864.3600  0.1000 -5.7024 3   44.9084 35 -71510 30317 612      16 7 9        syn-C2H3C(O)NH2, v=0
   37923.6180  0.0004 -5.3530 3    5.9896 13  71510 303 6 3 4       6 2 5        syn-C2H3C(O)NH2, v=0
   37927.9900  0.0800 -5.8752 3  248.3428 77 -71510 303381722      371819        syn-C2H3C(O)NH2, v=0
   37927.9900  0.0800 -5.8752 3  248.3428 77 -71510 303381721      371820        syn-C2H3C(O)NH2, v=0
   37929.6419  0.0031 -6.7616 3  279.6499 91  71510 30345 936      46 839        syn-C2H3C(O)NH2, v=0
   37934.2000  0.0500 -5.1835 3    3.5374 13 -71510 303 6 0 6       5 1 5        syn-C2H3C(O)NH2, v=0
   38001.8617  0.0039 -7.0237 3   39.7839 35  71510 30317 314      18 217        syn-C2H3C(O)NH2, v=0
   38041.6300  0.1000 -4.9739 3   18.8439 23 -71510 30311 4 7      11 3 8        syn-C2H3C(O)NH2, v=0
   38136.6283  0.0010 -5.7507 3   28.3135 29  71510 30314 411      13 5 8        syn-C2H3C(O)NH2, v=0
   38153.4600  0.0800 -6.1781 3  266.5653 71 -71510 303352213      362116        syn-C2H3C(O)NH2, v=0
   38153.4600  0.0800 -6.1781 3  266.5653 71 -71510 303352214      362115        syn-C2H3C(O)NH2, v=0
   38175.5200  0.0800 -6.6416 3  602.1681109 -71510 303543222      553125        syn-C2H3C(O)NH2, v=0
   38175.5200  0.0800 -6.6416 3  602.1681109 -71510 303543223      553124        syn-C2H3C(O)NH2, v=0
   38256.8673  0.0062 -7.0582 3  611.8731135  71510 303671454      661551        syn-C2H3C(O)NH2, v=0
   38280.6304  0.0033 -6.8272 3  442.1368113  71510 303561343      551640        syn-C2H3C(O)NH2, v=0
   38320.7749  0.0011 -7.5450 3    9.3408 15  71510 303 7 4 4       8 1 7        syn-C2H3C(O)NH2, v=0
   38338.0547  0.0025 -6.6079 3  350.1829101  71510 303501139      491436        syn-C2H3C(O)NH2, v=0
   38363.6638  0.0004 -7.4077 3    3.4322 11  71510 303 5 2 3       4 2 2        syn-C2H3C(O)NH2, v=0
   38409.8000  0.0800 -6.3665 3   52.8794 29 -71510 3031411 4      1510 5        syn-C2H3C(O)NH2, v=0
   38409.8000  0.0800 -6.3665 3   52.8794 29 -71510 3031411 3      1510 6        syn-C2H3C(O)NH2, v=0
   38440.2000  0.0500 -6.4733 3  616.1273119 -71510 303592831      582930        syn-C2H3C(O)NH2, v=0
   38440.2000  0.0500 -6.4733 3  616.1273119 -71510 303592832      582929        syn-C2H3C(O)NH2, v=0
   38441.3909  0.0003 -7.3520 3    2.8389 11  71510 303 5 1 4       4 1 3        syn-C2H3C(O)NH2, v=0
   38582.0336  0.0166 -7.3543 3 1090.6968157  71510 303783840      773939        syn-C2H3C(O)NH2, v=0
   38582.0336  0.0166 -7.3543 3 1090.6968157  71510 303783841      773938        syn-C2H3C(O)NH2, v=0
   38619.6018  0.0055 -7.2837 3  653.8607139  71510 303691455      701358        syn-C2H3C(O)NH2, v=0
   38640.4821  0.0010 -5.4226 3    8.0519 17  71510 303 8 1 7       8 0 8        syn-C2H3C(O)NH2, v=0
   38678.4809  0.0181 -7.3576 3 1017.3065143  71510 303714130      724033        syn-C2H3C(O)NH2, v=0
   38678.4809  0.0181 -7.3576 3 1017.3065143  71510 303714131      724032        syn-C2H3C(O)NH2, v=0
   38692.1400  0.1000 -5.8959 3  275.8785 81 -71510 303401823      391920        syn-C2H3C(O)NH2, v=0
   38692.1400  0.1000 -5.8959 3  275.8785 81 -71510 303401822      391921        syn-C2H3C(O)NH2, v=0
   38737.1700  0.1000 -4.8045 3   32.7949 31 -71510 30315 411      15 312        syn-C2H3C(O)NH2, v=0
   38865.3384  0.0006 -5.4485 3    6.3485 15  71510 303 7 2 6       7 1 7        syn-C2H3C(O)NH2, v=0
   38903.6300  0.0800 -6.1422 3  239.5721 67 -71510 303332112      342015        syn-C2H3C(O)NH2, v=0
   38903.6300  0.0800 -6.1422 3  239.5721 67 -71510 303332113      342014        syn-C2H3C(O)NH2, v=0
   38942.1265  0.0044 -6.6855 3  132.9663 63  71510 30331 625      32 528        syn-C2H3C(O)NH2, v=0
   38965.3000  0.0800 -6.5602 3  561.2406105 -71510 303523121      533024        syn-C2H3C(O)NH2, v=0
   38965.3000  0.0800 -6.5602 3  561.2406105 -71510 303523122      533023        syn-C2H3C(O)NH2, v=0
   38973.4239  0.0033 -6.6824 3  221.5669 81  71510 30340 932      41 635        syn-C2H3C(O)NH2, v=0
   38984.1887  0.0253 -7.6498 3  839.0524155  71510 303771958      762255        syn-C2H3C(O)NH2, v=0
   39003.5075  0.0014 -5.6655 3   57.0100 39  71510 30319 713      18 810        syn-C2H3C(O)NH2, v=0
   39029.2812  0.0004 -7.2543 3    3.5374 13  71510 303 6 1 6       5 1 5        syn-C2H3C(O)NH2, v=0
   39055.8021  0.0031 -6.0672 3   48.8429 39  71510 30319 416      18 513        syn-C2H3C(O)NH2, v=0
   39071.9967  0.0014 -6.4870 3   41.3173 25  71510 3031210 3      13 9 4        syn-C2H3C(O)NH2, v=0
   39071.9991  0.0014 -6.4870 3   41.3173 25  71510 3031210 2      13 9 5        syn-C2H3C(O)NH2, v=0
   39090.4336  0.0055 -7.2732 3  653.8606139  71510 303691555      701258        syn-C2H3C(O)NH2, v=0
   39243.4034  0.0028 -6.5312 3  659.0356123  71510 303612932      603031        syn-C2H3C(O)NH2, v=0
   39243.4034  0.0028 -6.5312 3  659.0356123  71510 303612933      603030        syn-C2H3C(O)NH2, v=0
   39358.3147  0.0031 -6.9676 3   35.8400 33  71510 30316 413      17 116        syn-C2H3C(O)NH2, v=0
   39416.9426  0.0200 -7.4432 3 1147.4561161  71510 303803941      794040        syn-C2H3C(O)NH2, v=0
   39416.9426  0.0200 -7.4432 3 1147.4561161  71510 303803942      794039        syn-C2H3C(O)NH2, v=0
   39460.0966  0.0013 -5.9207 3  304.8592 85  71510 303421924      412021        syn-C2H3C(O)NH2, v=0
   39460.0972  0.0013 -5.9207 3  304.8592 85  71510 303421923      412022        syn-C2H3C(O)NH2, v=0
   39487.0760  0.0035 -6.9123 3  240.9746 81  71510 303401328      411031        syn-C2H3C(O)NH2, v=0
   39502.5973  0.0150 -7.2439 3  963.9491139  71510 303694029      703932        syn-C2H3C(O)NH2, v=0
   39502.5973  0.0150 -7.2439 3  963.9491139  71510 303694030      703931        syn-C2H3C(O)NH2, v=0
   39527.4865  0.0048 -6.6475 3  382.6089107  71510 303531143      521240        syn-C2H3C(O)NH2, v=0
   39595.6505  0.0244 -7.5356 3  894.2231163  71510 303811765      801862        syn-C2H3C(O)NH2, v=0
   39647.1331  0.0033 -6.8216 3  129.4776 59  71510 303291020      30 723        syn-C2H3C(O)NH2, v=0
   39647.9526  0.0018 -6.1130 3  214.0244 63  71510 303312011      321914        syn-C2H3C(O)NH2, v=0
   39647.9526  0.0018 -6.1130 3  214.0244 63  71510 303312012      321913        syn-C2H3C(O)NH2, v=0
   39672.2056  0.0004 -5.2478 3    7.6449 15  71510 303 7 3 5       7 2 6        syn-C2H3C(O)NH2, v=0
   39713.2895  0.0013 -6.6800 3   31.2042 21  71510 30310 9 2      11 8 3        syn-C2H3C(O)NH2, v=0
   39713.2959  0.0013 -6.6800 3   31.2042 21  71510 30310 9 1      11 8 4        syn-C2H3C(O)NH2, v=0
   39733.2410  0.0623 -8.1936 3 1474.1035173  71510 303864937      874840        syn-C2H3C(O)NH2, v=0
   39733.2410  0.0623 -8.1936 3 1474.1035173  71510 303864938      874839        syn-C2H3C(O)NH2, v=0
   39750.6053  0.0020 -6.4834 3  521.7526101  71510 303503020      512923        syn-C2H3C(O)NH2, v=0
   39750.6053  0.0020 -6.4834 3  521.7526101  71510 303503021      512922        syn-C2H3C(O)NH2, v=0
   39756.5470  0.0013 -4.9069 3   24.0259 27  71510 30313 310      13 211        syn-C2H3C(O)NH2, v=0
   39780.9753  0.0004 -7.2341 3    3.4758 13  71510 303 6 0 6       5 0 5        syn-C2H3C(O)NH2, v=0
   39807.8353  0.0015 -5.6440 3   70.5618 43  71510 30321 814      20 911        syn-C2H3C(O)NH2, v=0
   40004.3194  0.0015 -5.6426 3   57.0090 39  71510 30319 712      18 811        syn-C2H3C(O)NH2, v=0
   40012.4698  0.0030 -6.7941 3  344.4523101  71510 303501040      51 943        syn-C2H3C(O)NH2, v=0
   40021.1075  0.0027 -6.6680 3  394.8256107  71510 303531241      521538        syn-C2H3C(O)NH2, v=0
   40048.7389  0.0095 -7.4207 3  750.9751149  71510 303741559      751462        syn-C2H3C(O)NH2, v=0
   40049.3669  0.0033 -6.5927 3  703.3817127  71510 303633033      623132        syn-C2H3C(O)NH2, v=0
   40049.3669  0.0033 -6.5927 3  703.3817127  71510 303633034      623131        syn-C2H3C(O)NH2, v=0
   40119.1151  0.0040 -6.7766 3  494.3156121  71510 303601248      591545        syn-C2H3C(O)NH2, v=0
   40173.1439  0.0015 -5.6358 3   70.5615 43  71510 30321 813      20 912        syn-C2H3C(O)NH2, v=0
   40226.2479  0.0030 -6.7113 3  279.6495 91  71510 303451036      46 739        syn-C2H3C(O)NH2, v=0
   40231.8166  0.0013 -5.9495 3  335.2845 89  71510 303442025      432122        syn-C2H3C(O)NH2, v=0
   40231.8167  0.0013 -5.9495 3  335.2845 89  71510 303442024      432123        syn-C2H3C(O)NH2, v=0
   40255.1440  0.0239 -7.5356 3 1205.6439165  71510 303824042      814141        syn-C2H3C(O)NH2, v=0
   40255.1440  0.0239 -7.5356 3 1205.6439165  71510 303824043      814140        syn-C2H3C(O)NH2, v=0
   40322.2989  0.0123 -7.1343 3  912.0233135  71510 303673928      683831        syn-C2H3C(O)NH2, v=0
   40322.2989  0.0123 -7.1343 3  912.0233135  71510 303673929      683830        syn-C2H3C(O)NH2, v=0
   40328.2516  0.0011 -7.0383 3   22.5402 17  71510 303 8 8 1       9 7 2        syn-C2H3C(O)NH2, v=0
   40328.2672  0.0011 -7.0383 3   22.5402 17  71510 303 8 8 0       9 7 3        syn-C2H3C(O)NH2, v=0
   40348.9037  0.0023 -6.9058 3   52.2378 37  71510 30318 712      19 415        syn-C2H3C(O)NH2, v=0
   40353.7620  0.0094 -7.4142 3  750.9750149  71510 303741659      751362        syn-C2H3C(O)NH2, v=0
   40386.1740  0.0018 -6.0912 3  189.9227 59  71510 303291910      301813        syn-C2H3C(O)NH2, v=0
   40386.1740  0.0018 -6.0912 3  189.9227 59  71510 303291911      301812        syn-C2H3C(O)NH2, v=0
   40405.1517  0.0027 -8.0097 3  242.6042 83  71510 303411130      411131        syn-C2H3C(O)NH2, v=0
   40441.9324  0.0015 -5.6415 3   44.9052 35  71510 30317 611      16 710        syn-C2H3C(O)NH2, v=0
   40497.8430  0.0015 -5.6310 3   85.5630 47  71510 30323 915      221012        syn-C2H3C(O)NH2, v=0
   40531.5197  0.0019 -6.4112 3  483.7047 97  71510 303482919      492822        syn-C2H3C(O)NH2, v=0
   40531.5197  0.0019 -6.4112 3  483.7047 97  71510 303482920      492821        syn-C2H3C(O)NH2, v=0
   40532.8931  0.0026 -7.9619 3   57.6990 41  71510 30320 515      20 516        syn-C2H3C(O)NH2, v=0
   40590.3304  0.0770 -8.1441 3 1229.5995191  71510 303951976      942273        syn-C2H3C(O)NH2, v=0
   40590.6249  0.0543 -8.0539 3 1409.8156169  71510 303844836      854739        syn-C2H3C(O)NH2, v=0
   40590.6249  0.0543 -8.0539 3 1409.8156169  71510 303844837      854738        syn-C2H3C(O)NH2, v=0
   40625.6077  0.0015 -5.6282 3   85.5628 47  71510 30323 914      221013        syn-C2H3C(O)NH2, v=0
   40652.6910  0.0006 -4.9930 3   15.9775 21  71510 30310 4 6      10 3 7        syn-C2H3C(O)NH2, v=0
   40704.3514  0.0037 -6.7705 3   61.4752 43  71510 30321 517      22 220        syn-C2H3C(O)NH2, v=0
   40858.0974  0.0040 -6.6579 3  749.1648131  71510 303653134      643233        syn-C2H3C(O)NH2, v=0
   40858.0974  0.0040 -6.6579 3  749.1648131  71510 303653135      643232        syn-C2H3C(O)NH2, v=0
   40861.6669  0.0031 -8.2031 3  389.0070105  71510 303521438      521439        syn-C2H3C(O)NH2, v=0
   40876.0705  0.0004 -5.1069 3    3.4758 13  71510 303 6 1 6       5 0 5        syn-C2H3C(O)NH2, v=0
   40979.4310  0.0050 -6.3529 3  206.6398 79  71510 30339 832      38 929        syn-C2H3C(O)NH2, v=0
   41006.9508  0.0014 -5.9823 3  367.1537 93  71510 303462125      452224        syn-C2H3C(O)NH2, v=0
   41006.9508  0.0014 -5.9823 3  367.1537 93  71510 303462126      452223        syn-C2H3C(O)NH2, v=0
   41096.7102  0.0283 -7.6316 3 1265.2590169  71510 303844143      834242        syn-C2H3C(O)NH2, v=0
   41096.7102  0.0283 -7.6316 3 1265.2590169  71510 303844144      834241        syn-C2H3C(O)NH2, v=0
   41117.6459  0.0018 -6.0775 3  167.2674 55  71510 3032718 9      281712        syn-C2H3C(O)NH2, v=0
   41117.6459  0.0018 -6.0775 3  167.2674 55  71510 303271810      281711        syn-C2H3C(O)NH2, v=0
   41137.5859  0.0100 -7.0287 3  861.5302131  71510 303653827      663730        syn-C2H3C(O)NH2, v=0
   41137.5859  0.0100 -7.0287 3  861.5302131  71510 303653828      663729        syn-C2H3C(O)NH2, v=0
   41163.9726  0.0015 -5.6239 3  102.0130 51  71510 303251016      241113        syn-C2H3C(O)NH2, v=0
   41187.6564  0.0047 -7.0850 3  386.6612103  71510 303511636      521339        syn-C2H3C(O)NH2, v=0
   41207.2762  0.0015 -5.6230 3  102.0129 51  71510 303251015      241114        syn-C2H3C(O)NH2, v=0
   41249.0016  0.0033 -6.5882 3  402.4502109  71510 303541143      531440        syn-C2H3C(O)NH2, v=0
   41290.4202  0.0002 -5.5330 3    1.0220  7  71510 303 3 2 2       2 1 1        syn-C2H3C(O)NH2, v=0
   41307.8793  0.0018 -6.3438 3  447.0976 93  71510 303462818      472721        syn-C2H3C(O)NH2, v=0
   41307.8793  0.0018 -6.3438 3  447.0976 93  71510 303462819      472720        syn-C2H3C(O)NH2, v=0
   41334.3731  0.0044 -6.7897 3   66.6335 45  71510 30322 418      23 321        syn-C2H3C(O)NH2, v=0
   41381.4976  0.0167 -7.5772 3  854.7771159  71510 303791663      801566        syn-C2H3C(O)NH2, v=0
   41391.6485  0.0880 -8.1150 3 1095.5861177  71510 303882266      872563        syn-C2H3C(O)NH2, v=0
   41443.2871  0.0471 -7.9181 3 1346.9507165  71510 303824735      834638        syn-C2H3C(O)NH2, v=0
   41443.2871  0.0471 -7.9181 3 1346.9507165  71510 303824736      834637        syn-C2H3C(O)NH2, v=0
   41550.9013  0.0517 -7.8812 3 1104.5033181  71510 303901872      892169        syn-C2H3C(O)NH2, v=0
   41554.6939  0.0029 -6.7617 3  344.4520101  71510 303501140      51 843        syn-C2H3C(O)NH2, v=0
   41578.1890  0.0166 -7.5731 3  854.7770159  71510 303791763      801466        syn-C2H3C(O)NH2, v=0
   41606.1678  0.0039 -6.6320 3  178.8118 73  71510 30336 729      37 632        syn-C2H3C(O)NH2, v=0
   41669.6504  0.0049 -6.7268 3  796.3839135  71510 303673235      663334        syn-C2H3C(O)NH2, v=0
   41669.6504  0.0049 -6.7268 3  796.3839135  71510 303673236      663333        syn-C2H3C(O)NH2, v=0
   41785.3265  0.0015 -6.0190 3  400.4662 97  71510 303482226      472325        syn-C2H3C(O)NH2, v=0
   41785.3265  0.0015 -6.0190 3  400.4662 97  71510 303482227      472324        syn-C2H3C(O)NH2, v=0
   41826.5756  0.0006 -5.3550 3    5.9896 15  71510 303 7 1 6       6 2 5        syn-C2H3C(O)NH2, v=0
   41837.2241  0.0015 -5.6215 3  119.9114 55  71510 303271117      261214        syn-C2H3C(O)NH2, v=0
   41841.6863  0.0018 -6.0729 3  146.0591 51  71510 3032517 8      261611        syn-C2H3C(O)NH2, v=0
   41841.6863  0.0018 -6.0729 3  146.0591 51  71510 3032517 9      261610        syn-C2H3C(O)NH2, v=0
   41851.5513  0.0015 -5.6212 3  119.9114 55  71510 303271116      261215        syn-C2H3C(O)NH2, v=0
   41899.1477  0.0032 -6.8533 3  415.9702111  71510 303551144      561047        syn-C2H3C(O)NH2, v=0
   41941.7135  0.0334 -7.7311 3 1326.3003173  71510 303864244      854343        syn-C2H3C(O)NH2, v=0
   41941.7135  0.0334 -7.7311 3 1326.3003173  71510 303864245      854342        syn-C2H3C(O)NH2, v=0
   41948.4513  0.0081 -6.9272 3  812.4707127  71510 303633726      643629        syn-C2H3C(O)NH2, v=0
   41948.4513  0.0081 -6.9272 3  812.4707127  71510 303633727      643628        syn-C2H3C(O)NH2, v=0
   41970.7516  0.0040 -6.6581 3   93.8521 53  71510 30326 621      27 324        syn-C2H3C(O)NH2, v=0
   41971.5541  0.0015 -5.6210 3   34.2495 31  71510 30315 510      14 6 9        syn-C2H3C(O)NH2, v=0
   42020.4496  0.0048 -6.8848 3  579.2392131  71510 303651352      641649        syn-C2H3C(O)NH2, v=0
   42046.8256  0.0005 -5.1519 3    9.5218 17  71510 303 8 3 6       8 2 7        syn-C2H3C(O)NH2, v=0
   42079.5612  0.0018 -6.2813 3  411.9322 89  71510 303442717      452620        syn-C2H3C(O)NH2, v=0
   42079.5612  0.0018 -6.2813 3  411.9322 89  71510 303442718      452619        syn-C2H3C(O)NH2, v=0
   42236.1555  0.0027 -7.2884 3   19.6840 25  71510 30312 310      13 013        syn-C2H3C(O)NH2, v=0
   42268.4725  0.0033 -7.3157 3   22.6160 27  71510 30313 211      14 114        syn-C2H3C(O)NH2, v=0
   42291.2525  0.0407 -7.7860 3 1285.5100161  71510 303804634      814537        syn-C2H3C(O)NH2, v=0
   42291.2525  0.0407 -7.7860 3 1285.5100161  71510 303804635      814536        syn-C2H3C(O)NH2, v=0
   42384.0419  0.0331 -7.6361 3  986.0727171  71510 303851768      842065        syn-C2H3C(O)NH2, v=0
   42465.6383  0.0049 -6.9745 3  560.4890127  71510 303631548      621845        syn-C2H3C(O)NH2, v=0
   42484.0841  0.0062 -6.7992 3  845.0382139  71510 303693336      683435        syn-C2H3C(O)NH2, v=0
   42484.0841  0.0062 -6.7992 3  845.0382139  71510 303693337      683434        syn-C2H3C(O)NH2, v=0
   42496.4947  0.0011 -5.6673 3   31.8388 31  71510 30315 412      14 5 9        syn-C2H3C(O)NH2, v=0
   42525.3334  0.0015 -5.6236 3  139.2579 59  71510 303291218      281315        syn-C2H3C(O)NH2, v=0
   42529.9838  0.0015 -5.6235 3  139.2579 59  71510 303291217      281316        syn-C2H3C(O)NH2, v=0
   42557.4528  0.0018 -6.0790 3  126.2979 47  71510 3032316 7      241510        syn-C2H3C(O)NH2, v=0
   42557.4528  0.0018 -6.0790 3  126.2979 47  71510 3032316 8      2415 9        syn-C2H3C(O)NH2, v=0
   42566.8187  0.0016 -6.0595 3  435.2214101  71510 303502327      492426        syn-C2H3C(O)NH2, v=0
   42566.8187  0.0016 -6.0595 3  435.2214101  71510 303502328      492425        syn-C2H3C(O)NH2, v=0
   42626.8138  0.0278 -7.7524 3  965.2596169  71510 303841767      851670        syn-C2H3C(O)NH2, v=0
   42651.5048  0.0030 -7.9004 3  166.9310 69  71510 30334 925      34 926        syn-C2H3C(O)NH2, v=0
   42753.1599  0.0277 -7.7498 3  965.2596169  71510 303841867      851570        syn-C2H3C(O)NH2, v=0
   42754.8808  0.0065 -6.8298 3  764.8458123  71510 303613625      623528        syn-C2H3C(O)NH2, v=0
   42754.8808  0.0065 -6.8298 3  764.8458123  71510 303613626      623527        syn-C2H3C(O)NH2, v=0
   42790.2264  0.0391 -7.8341 3 1388.7666177  71510 303884345      874444        syn-C2H3C(O)NH2, v=0
   42790.2264  0.0391 -7.8341 3 1388.7666177  71510 303884346      874443        syn-C2H3C(O)NH2, v=0
   42795.0371  0.0027 -6.5026 3  362.8668103  71510 303511140      501437        syn-C2H3C(O)NH2, v=0
   42805.7393  0.0099 -7.2487 3  692.8012141  71510 303701753      692050        syn-C2H3C(O)NH2, v=0
   42836.5686  0.0004 -7.2141 3    4.5608 13  71510 303 6 2 5       5 2 4        syn-C2H3C(O)NH2, v=0
   42846.4151  0.0018 -6.2238 3  378.2090 85  71510 303422616      432519        syn-C2H3C(O)NH2, v=0
   42846.4151  0.0018 -6.2238 3  378.2090 85  71510 303422617      432518        syn-C2H3C(O)NH2, v=0
   42882.5715  0.0023 -7.9769 3   41.2697 35  71510 30317 413      17 414        syn-C2H3C(O)NH2, v=0
   42890.2483  0.0147 -7.2653 3  787.8476153  71510 303761661      751758        syn-C2H3C(O)NH2, v=0
   42922.8482  0.0031 -6.8325 3  415.9699111  71510 303551244      56 947        syn-C2H3C(O)NH2, v=0
   42926.8001  0.0031 -7.8763 3  105.2881 55  71510 30327 720      27 721        syn-C2H3C(O)NH2, v=0
   42988.6719  0.0069 -7.0309 3  670.8896141  71510 303701456      691753        syn-C2H3C(O)NH2, v=0
   42989.2614  0.0054 -6.7985 3  524.3061125  71510 303621350      611447        syn-C2H3C(O)NH2, v=0
   42992.2395  0.0201 -7.4108 3  874.3190161  71510 303801664      791961        syn-C2H3C(O)NH2, v=0
   43134.5431  0.0350 -7.6578 3 1225.4948157  71510 303784533      794436        syn-C2H3C(O)NH2, v=0
   43134.5431  0.0350 -7.6578 3 1225.4948157  71510 303784534      794435        syn-C2H3C(O)NH2, v=0
   43168.9803  0.0814 -8.0902 3 1229.5146191  71510 303952076      942173        syn-C2H3C(O)NH2, v=0
   43220.9615  0.0012 -4.7218 3   36.8275 33  71510 30316 412      16 313        syn-C2H3C(O)NH2, v=0
   43228.2673  0.0014 -5.6299 3  160.0521 63  71510 303311319      301416        syn-C2H3C(O)NH2, v=0
   43229.7534  0.0014 -5.6298 3  160.0521 63  71510 303311318      301417        syn-C2H3C(O)NH2, v=0
   43244.0982  0.0011 -5.5777 3   37.9871 33  71510 30316 512      15 6 9        syn-C2H3C(O)NH2, v=0
   43247.5998  0.0116 -7.2078 3  769.2539151  71510 303751560      741857        syn-C2H3C(O)NH2, v=0
   43263.8989  0.0017 -6.0977 3  107.9844 43  71510 3032115 6      2214 9        syn-C2H3C(O)NH2, v=0
   43263.8989  0.0017 -6.0977 3  107.9844 43  71510 3032115 7      2214 8        syn-C2H3C(O)NH2, v=0
   43276.1358  0.0039 -6.5969 3  132.9656 63  71510 30331 725      32 428        syn-C2H3C(O)NH2, v=0
   43301.4591  0.0077 -6.8753 3  895.1268143  71510 303713437      703536        syn-C2H3C(O)NH2, v=0
   43301.4591  0.0077 -6.8753 3  895.1268143  71510 303713438      703535        syn-C2H3C(O)NH2, v=0
   43339.7783  0.0013 -5.0283 3   16.3973 23  71510 30311 2 9      11 110        syn-C2H3C(O)NH2, v=0
   43351.3393  0.0017 -6.1038 3  471.4187105  71510 303522428      512527        syn-C2H3C(O)NH2, v=0
   43351.3393  0.0017 -6.1038 3  471.4187105  71510 303522429      512526        syn-C2H3C(O)NH2, v=0
   43359.0085  0.0006 -5.0170 3   13.3849 19  71510 303 9 4 5       9 3 6        syn-C2H3C(O)NH2, v=0
   43461.2146  0.0025 -5.8594 3   44.1523 37  71510 30318 415      17 512        syn-C2H3C(O)NH2, v=0
   43494.3689  0.0019 -8.0488 3   27.5139 29  71510 30314 311      14 312        syn-C2H3C(O)NH2, v=0
   43535.4968  0.0004 -4.6619 3   42.7001 35  71510 30317 512      17 413        syn-C2H3C(O)NH2, v=0
   43556.8508  0.0051 -6.7366 3  718.6563119  71510 303593524      603427        syn-C2H3C(O)NH2, v=0
   43556.8508  0.0051 -6.7366 3  718.6563119  71510 303593525      603426        syn-C2H3C(O)NH2, v=0
   43607.6913  0.0019 -7.0163 3   32.7949 29  71510 30314 6 9      15 312        syn-C2H3C(O)NH2, v=0
   43608.2582  0.0018 -6.1717 3  345.9286 81  71510 303402515      412418        syn-C2H3C(O)NH2, v=0
   43608.2582  0.0018 -6.1717 3  345.9286 81  71510 303402516      412417        syn-C2H3C(O)NH2, v=0
   43628.2113  0.0035 -6.9363 3  494.1986121  71510 303601248      611151        syn-C2H3C(O)NH2, v=0
   43642.3211  0.0456 -7.9405 3 1452.6567181  71510 303904446      894545        syn-C2H3C(O)NH2, v=0
   43642.3211  0.0456 -7.9405 3 1452.6567181  71510 303904447      894544        syn-C2H3C(O)NH2, v=0
   43734.4954  0.0008 -5.3367 3    8.0630 17  71510 303 8 2 7       8 1 8        syn-C2H3C(O)NH2, v=0
   43789.8487  0.0439 -7.9456 3 1082.4154179  71510 303891871      901774        syn-C2H3C(O)NH2, v=0
   43854.5053  0.0356 -7.8626 3  866.0594155  71510 303772355      782058        syn-C2H3C(O)NH2, v=0
   43858.4558  0.0031 -6.5066 3  389.0070107  71510 303531142      521439        syn-C2H3C(O)NH2, v=0
   43867.5271  0.0004 -7.6648 3    9.5592 13  71510 303 6 5 2       5 5 1        syn-C2H3C(O)NH2, v=0
   43867.9717  0.0004 -7.6648 3    9.5592 13  71510 303 6 5 1       5 5 0        syn-C2H3C(O)NH2, v=0
   43870.7471  0.0438 -7.9440 3 1082.4153179  71510 303891971      901674        syn-C2H3C(O)NH2, v=0
   43944.0019  0.0014 -5.6403 3  182.2936 67  71510 303331420      321517        syn-C2H3C(O)NH2, v=0
   43944.4708  0.0014 -5.6402 3  182.2936 67  71510 303331419      321518        syn-C2H3C(O)NH2, v=0
   43959.7163  0.0017 -6.1321 3   91.1188 39  71510 3031914 5      2013 8        syn-C2H3C(O)NH2, v=0
   43959.7163  0.0017 -6.1321 3   91.1188 39  71510 3031914 6      2013 7        syn-C2H3C(O)NH2, v=0
   43973.1772  0.0298 -7.5335 3 1166.9063153  71510 303764432      774335        syn-C2H3C(O)NH2, v=0
   43973.1772  0.0298 -7.5335 3 1166.9063153  71510 303764433      774334        syn-C2H3C(O)NH2, v=0
   43990.5025  0.0004 -7.3984 3    7.4355 13  71510 303 6 4 3       5 4 2        syn-C2H3C(O)NH2, v=0
   43995.0900  0.0034 -6.6164 3  231.3856 83  71510 30341 833      42 736        syn-C2H3C(O)NH2, v=0
   44017.3203  0.0004 -7.3978 3    7.4358 13  71510 303 6 4 2       5 4 1        syn-C2H3C(O)NH2, v=0
   44025.9745  0.0004 -7.2643 3    5.7861 13  71510 303 6 3 4       5 3 3        syn-C2H3C(O)NH2, v=0
   44121.8378  0.0095 -6.9548 3  946.6486147  71510 303733538      723637        syn-C2H3C(O)NH2, v=0
   44121.8378  0.0095 -6.9548 3  946.6486147  71510 303733539      723636        syn-C2H3C(O)NH2, v=0
   44138.8293  0.0019 -6.1518 3  509.0573109  71510 303542529      532628        syn-C2H3C(O)NH2, v=0
   44138.8293  0.0019 -6.1518 3  509.0573109  71510 303542530      532627        syn-C2H3C(O)NH2, v=0
   44301.5194  0.0035 -6.9231 3  494.1984121  71510 303601348      611051        syn-C2H3C(O)NH2, v=0
   44354.3277  0.0041 -6.6476 3  673.9033115  71510 303573423      583326        syn-C2H3C(O)NH2, v=0
   44354.3277  0.0041 -6.6476 3  673.9033115  71510 303573424      583325        syn-C2H3C(O)NH2, v=0
   44364.8695  0.0018 -6.1250 3  315.0918 77  71510 303382414      392317        syn-C2H3C(O)NH2, v=0
   44364.8695  0.0018 -6.1250 3  315.0918 77  71510 303382415      392316        syn-C2H3C(O)NH2, v=0
   44385.6099  0.0005 -4.6270 3   47.3623 37  71510 30318 513      18 414        syn-C2H3C(O)NH2, v=0
   44408.6063  0.0045 -6.6446 3  100.2253 55  71510 30327 522      28 425        syn-C2H3C(O)NH2, v=0
   44488.7111  0.0006 -4.6795 3   38.2692 33  71510 30316 511      16 412        syn-C2H3C(O)NH2, v=0
   44498.0693  0.0527 -8.0503 3 1517.9693185  71510 303924547      914646        syn-C2H3C(O)NH2, v=0
   44498.0693  0.0527 -8.0503 3 1517.9693185  71510 303924548      914645        syn-C2H3C(O)NH2, v=0
   44503.7285  0.0029 -6.4750 3  375.8102105  71510 303521141      511438        syn-C2H3C(O)NH2, v=0
   44559.2565  0.0034 -6.8987 3   39.7834 35  71510 30317 414      18 117        syn-C2H3C(O)NH2, v=0
   44585.1790  0.0042 -6.0188 3   78.0253 49  71510 30324 520      23 617        syn-C2H3C(O)NH2, v=0
   44627.4615  0.0004 -4.9526 3    4.8393 15  71510 303 7 0 7       6 1 6        syn-C2H3C(O)NH2, v=0
   44631.1920  0.0004 -7.2524 3    5.7967 13  71510 303 6 3 3       5 3 2        syn-C2H3C(O)NH2, v=0
   44643.2565  0.0016 -6.1867 3   75.7014 35  71510 3031713 4      1812 7        syn-C2H3C(O)NH2, v=0
   44643.2565  0.0016 -6.1867 3   75.7014 35  71510 3031713 5      1812 6        syn-C2H3C(O)NH2, v=0
   44650.6130  0.0036 -6.5722 3  178.8114 73  71510 30336 829      37 532        syn-C2H3C(O)NH2, v=0
   44670.3946  0.0013 -5.6547 3  205.9819 71  71510 303351521      341618        syn-C2H3C(O)NH2, v=0
   44670.5410  0.0013 -5.6547 3  205.9819 71  71510 303351520      341619        syn-C2H3C(O)NH2, v=0
   44696.5047  0.0015 -5.5693 3   25.0392 27  71510 30313 4 9      12 5 8        syn-C2H3C(O)NH2, v=0
   44760.1197  0.0053 -6.1855 3  156.9529 69  71510 30334 728      33 825        syn-C2H3C(O)NH2, v=0
   44807.1694  0.0253 -7.4130 3 1109.7454149  71510 303744331      754234        syn-C2H3C(O)NH2, v=0
   44807.1694  0.0253 -7.4130 3 1109.7454149  71510 303744332      754233        syn-C2H3C(O)NH2, v=0
   44861.0737  0.0032 -6.7737 3   97.6203 51  71510 30325 917      26 620        syn-C2H3C(O)NH2, v=0
   44929.2527  0.0020 -6.2036 3  548.1365113  71510 303562630      552729        syn-C2H3C(O)NH2, v=0
   44929.2527  0.0020 -6.2036 3  548.1365113  71510 303562631      552728        syn-C2H3C(O)NH2, v=0
   44945.2842  0.0117 -7.0379 3  999.6028151  71510 303753639      743738        syn-C2H3C(O)NH2, v=0
   44945.2842  0.0117 -7.0379 3  999.6028151  71510 303753640      743737        syn-C2H3C(O)NH2, v=0
   45068.6467  0.0014 -5.6575 3   35.6495 33  71510 30316 413      15 510        syn-C2H3C(O)NH2, v=0
   45077.2708  0.0006 -5.0616 3   11.6160 19  71510 303 9 3 7       9 2 8        syn-C2H3C(O)NH2, v=0
   45106.0353  0.0028 -7.9945 3  291.4185 91  71510 303451233      451234        syn-C2H3C(O)NH2, v=0
   45115.9826  0.0018 -6.0842 3  285.6990 73  71510 303362313      372216        syn-C2H3C(O)NH2, v=0
   45115.9826  0.0018 -6.0842 3  285.6990 73  71510 303362314      372215        syn-C2H3C(O)NH2, v=0
   45147.2663  0.0033 -6.5629 3  630.5874111  71510 303553322      563225        syn-C2H3C(O)NH2, v=0
   45147.2663  0.0033 -6.5629 3  630.5874111  71510 303553323      563224        syn-C2H3C(O)NH2, v=0
   45228.5863  0.0041 -7.0412 3  579.1321131  71510 303651352      661255        syn-C2H3C(O)NH2, v=0
   45243.6725  0.0004 -7.0592 3    4.8393 15  71510 303 7 1 7       6 1 6        syn-C2H3C(O)NH2, v=0
   45249.1108  0.0047 -6.4106 3  313.9139 97  71510 303481039      471136        syn-C2H3C(O)NH2, v=0
   45312.4257  0.0016 -6.2694 3   61.7325 31  71510 3031512 4      1611 5        syn-C2H3C(O)NH2, v=0
   45312.4258  0.0016 -6.2694 3   61.7325 31  71510 3031512 3      1611 6        syn-C2H3C(O)NH2, v=0
   45348.3728  0.0074 -7.3085 3  566.4701125  71510 303621944      631647        syn-C2H3C(O)NH2, v=0
   45405.6627  0.0013 -5.6732 3  231.1167 75  71510 303371622      361719        syn-C2H3C(O)NH2, v=0
   45405.7079  0.0013 -5.6732 3  231.1167 75  71510 303371621      361720        syn-C2H3C(O)NH2, v=0
   45441.0399  0.0560 -7.8028 3 1104.3751181  71510 303901972      892069        syn-C2H3C(O)NH2, v=0
   45465.8205  0.0019 -5.7220 3   39.7531 35  71510 30317 414      16 511        syn-C2H3C(O)NH2, v=0
   45479.2555  0.0015 -7.2630 3   17.8429 21  71510 30310 5 6      11 2 9        syn-C2H3C(O)NH2, v=0
   45510.4184  0.0011 -7.7853 3    7.3848 13  71510 303 6 4 3       7 1 6        syn-C2H3C(O)NH2, v=0
   45550.7771  0.0004 -7.1256 3    4.1212 13  71510 303 6 1 5       5 1 4        syn-C2H3C(O)NH2, v=0
   45580.1016  0.0003 -5.5710 3    0.9031  7  71510 303 3 2 1       2 1 2        syn-C2H3C(O)NH2, v=0
   45632.3610  0.0011 -5.2872 3    9.9758 19  71510 303 9 1 8       9 0 9        syn-C2H3C(O)NH2, v=0
   45636.5298  0.0213 -7.2964 3 1054.0134145  71510 303724230      734133        syn-C2H3C(O)NH2, v=0
   45636.5298  0.0213 -7.2964 3 1054.0134145  71510 303724231      734132        syn-C2H3C(O)NH2, v=0
   45668.1725  0.0041 -7.0328 3  579.1321131  71510 303651452      661155        syn-C2H3C(O)NH2, v=0
   45698.1088  0.0005 -5.0542 3   11.0726 17  71510 303 8 4 4       8 3 5        syn-C2H3C(O)NH2, v=0
   45722.5567  0.0004 -7.0486 3    4.8028 15  71510 303 7 0 7       6 0 6        syn-C2H3C(O)NH2, v=0
   45722.5918  0.0022 -6.2590 3  588.6557117  71510 303582731      572830        syn-C2H3C(O)NH2, v=0
   45722.5918  0.0022 -6.2590 3  588.6557117  71510 303582732      572829        syn-C2H3C(O)NH2, v=0
   45771.8638  0.0143 -7.1245 3 1053.9883155  71510 303773740      763839        syn-C2H3C(O)NH2, v=0
   45771.8638  0.0143 -7.1245 3 1053.9883155  71510 303773741      763838        syn-C2H3C(O)NH2, v=0
   45791.8966  0.0038 -6.6205 3  479.3740119  71510 303591247      581544        syn-C2H3C(O)NH2, v=0
   45861.2763  0.0018 -6.0497 3  257.7509 69  71510 303342212      352115        syn-C2H3C(O)NH2, v=0
   45861.2763  0.0018 -6.0497 3  257.7509 69  71510 303342213      352114        syn-C2H3C(O)NH2, v=0
   45865.5123  0.0036 -6.7801 3  196.7240 73  71510 303361225      37 928        syn-C2H3C(O)NH2, v=0
   45935.6082  0.0027 -6.4826 3  588.7096107  71510 303533221      543124        syn-C2H3C(O)NH2, v=0
   45935.6082  0.0027 -6.4826 3  588.7096107  71510 303533222      543123        syn-C2H3C(O)NH2, v=0
   45964.5411  0.0015 -6.3945 3   49.2122 27  71510 3031311 3      1410 4        syn-C2H3C(O)NH2, v=0
   45964.5413  0.0015 -6.3945 3   49.2122 27  71510 3031311 2      1410 5        syn-C2H3C(O)NH2, v=0
   45965.1774  0.0040 -6.9053 3   43.9289 37  71510 30318 315      19 218        syn-C2H3C(O)NH2, v=0
   46013.5678  0.0013 -5.4973 3   49.1227 37  71510 30318 613      17 710        syn-C2H3C(O)NH2, v=0
   46086.2558  0.0032 -6.5768 3  231.3853 83  71510 30341 933      42 636        syn-C2H3C(O)NH2, v=0
   46148.4248  0.0012 -5.6956 3  257.6973 79  71510 303391723      381820        syn-C2H3C(O)NH2, v=0
   46148.4387  0.0012 -5.6956 3  257.6973 79  71510 303391722      381821        syn-C2H3C(O)NH2, v=0
   46148.9101  0.0030 -6.6326 3  290.6834 93  71510 30346 937      47 840        syn-C2H3C(O)NH2, v=0
   46274.4891  0.0050 -6.0687 3  114.0699 59  71510 30329 624      28 721        syn-C2H3C(O)NH2, v=0
   46338.7676  0.0004 -4.9154 3    4.8028 15  71510 303 7 1 7       6 0 6        syn-C2H3C(O)NH2, v=0
   46457.0135  0.0039 -6.6944 3   66.6329 45  71510 30322 518      23 221        syn-C2H3C(O)NH2, v=0
   46461.2635  0.0178 -7.1836 3  999.7112141  71510 303704129      714032        syn-C2H3C(O)NH2, v=0
   46461.2635  0.0178 -7.1836 3  999.7112141  71510 303704130      714031        syn-C2H3C(O)NH2, v=0
   46518.8438  0.0025 -6.3180 3  630.6141121  71510 303602832      592931        syn-C2H3C(O)NH2, v=0
   46518.8438  0.0025 -6.3180 3  630.6141121  71510 303602833      592930        syn-C2H3C(O)NH2, v=0
   46524.7527  0.0004 -7.1385 3    4.7119 13  71510 303 6 2 4       5 2 3        syn-C2H3C(O)NH2, v=0
   46596.1372  0.0014 -6.5935 3   38.1406 23  71510 3031110 2      12 9 3        syn-C2H3C(O)NH2, v=0
   46596.1377  0.0014 -6.5935 3   38.1406 23  71510 3031110 1      12 9 4        syn-C2H3C(O)NH2, v=0
   46600.3635  0.0018 -6.0219 3  231.2478 65  71510 303322111      332014        syn-C2H3C(O)NH2, v=0
   46600.3635  0.0018 -6.0219 3  231.2478 65  71510 303322112      332013        syn-C2H3C(O)NH2, v=0
   46601.6428  0.0174 -7.2146 3 1109.8040159  71510 303793841      783940        syn-C2H3C(O)NH2, v=0
   46601.6428  0.0174 -7.2146 3 1109.8040159  71510 303793842      783939        syn-C2H3C(O)NH2, v=0
   46714.2461  0.0016 -4.7931 3   27.4065 29  71510 30314 311      14 212        syn-C2H3C(O)NH2, v=0
   46719.2795  0.0023 -6.4068 3  548.2707103  71510 303513120      523023        syn-C2H3C(O)NH2, v=0
   46719.2795  0.0023 -6.4068 3  548.2707103  71510 303513121      523022        syn-C2H3C(O)NH2, v=0
   46720.6428  0.0060 -7.1665 3  670.7652141  71510 303701456      711359        syn-C2H3C(O)NH2, v=0
   46741.2490  0.0003 -5.3659 3    1.8036  9  71510 303 4 2 3       3 1 2        syn-C2H3C(O)NH2, v=0
   46842.1600  0.0008 -4.6850 3   34.0870 31  71510 30315 510      15 411        syn-C2H3C(O)NH2, v=0
   46897.6332  0.0012 -5.7220 3  285.7234 83  71510 303411824      401921        syn-C2H3C(O)NH2, v=0
   46897.6374  0.0012 -5.7220 3  285.7234 83  71510 303411823      401922        syn-C2H3C(O)NH2, v=0
   46939.7482  0.0088 -7.0006 3  688.1304143  71510 303711557      701654        syn-C2H3C(O)NH2, v=0
   46998.4841  0.0010 -5.3957 3   10.9244 19  71510 303 9 2 7       8 3 6        syn-C2H3C(O)NH2, v=0
   47005.9089  0.0059 -7.1613 3  670.7651141  71510 303701556      711259        syn-C2H3C(O)NH2, v=0
   47186.7455  0.0042 -6.5589 3  140.5539 65  71510 30332 626      33 529        syn-C2H3C(O)NH2, v=0
   47202.7114  0.0012 -6.9600 3   28.5179 19  71510 303 9 9 1      10 8 2        syn-C2H3C(O)NH2, v=0
   47202.7124  0.0012 -6.9600 3   28.5179 19  71510 303 9 9 0      10 8 3        syn-C2H3C(O)NH2, v=0
   47238.1724  0.0013 -5.4864 3   17.2682 23  71510 30311 3 8      10 4 7        syn-C2H3C(O)NH2, v=0
   47258.5084  0.0010 -4.5737 3   52.2378 39  71510 30319 514      19 415        syn-C2H3C(O)NH2, v=0
   47281.3699  0.0148 -7.0748 3  946.8401137  71510 303684028      693931        syn-C2H3C(O)NH2, v=0
   47281.3699  0.0148 -7.0748 3  946.8401137  71510 303684029      693930        syn-C2H3C(O)NH2, v=0
   47318.0179  0.0029 -6.3806 3  674.0107125  71510 303622933      613032        syn-C2H3C(O)NH2, v=0
   47318.0179  0.0029 -6.3806 3  674.0107125  71510 303622934      613031        syn-C2H3C(O)NH2, v=0
   47332.7775  0.0018 -6.0014 3  206.1905 61  71510 303302010      311913        syn-C2H3C(O)NH2, v=0
   47332.7775  0.0018 -6.0014 3  206.1905 61  71510 303302011      311912        syn-C2H3C(O)NH2, v=0
   47375.5515  0.0029 -7.2301 3   22.6158 27  71510 30313 311      14 014        syn-C2H3C(O)NH2, v=0
   47423.5839  0.0005 -5.1132 3    9.0412 15  71510 303 7 4 3       7 3 4        syn-C2H3C(O)NH2, v=0
   47434.6885  0.0209 -7.3081 3 1167.0489163  71510 303813942      804041        syn-C2H3C(O)NH2, v=0
   47434.6885  0.0209 -7.3081 3 1167.0489163  71510 303813943      804040        syn-C2H3C(O)NH2, v=0
   47498.1888  0.0020 -6.3355 3  509.2714 99  71510 303493019      502922        syn-C2H3C(O)NH2, v=0
   47498.1888  0.0020 -6.3355 3  509.2714 99  71510 303493020      502921        syn-C2H3C(O)NH2, v=0
   47510.5861  0.0014 -5.4598 3   61.7130 41  71510 30320 714      19 811        syn-C2H3C(O)NH2, v=0
   47526.0727  0.0616 -8.0117 3 1452.8776171  71510 303854936      864839        syn-C2H3C(O)NH2, v=0
   47526.0727  0.0616 -8.0117 3 1452.8776171  71510 303854937      864838        syn-C2H3C(O)NH2, v=0
   47561.4526  0.0029 -6.6068 3  290.6832 93  71510 303461037      47 740        syn-C2H3C(O)NH2, v=0
   47633.3023  0.0030 -7.8189 3   82.7294 49  71510 30324 618      24 619        syn-C2H3C(O)NH2, v=0
   47652.4944  0.0012 -5.7522 3  315.1944 87  71510 303431925      422022        syn-C2H3C(O)NH2, v=0
   47652.4957  0.0012 -5.7522 3  315.1944 87  71510 303431924      422023        syn-C2H3C(O)NH2, v=0
   47667.4925  0.0028 -6.4921 3  408.2748109  71510 303541242      531539        syn-C2H3C(O)NH2, v=0
   47983.4470  0.0038 -6.7198 3  507.0844121  71510 303601446      591743        syn-C2H3C(O)NH2, v=0
   48057.9540  0.0018 -5.9891 3  182.5792 57  71510 3032819 9      291812        syn-C2H3C(O)NH2, v=0
   48057.9540  0.0018 -5.9891 3  182.5792 57  71510 303281910      291811        syn-C2H3C(O)NH2, v=0
   48070.1320  0.0030 -7.8540 3  207.8290 77  71510 303381028      381029        syn-C2H3C(O)NH2, v=0
   48096.8423  0.0122 -6.9700 3  895.4008133  71510 303663927      673830        syn-C2H3C(O)NH2, v=0
   48096.8423  0.0122 -6.9700 3  895.4008133  71510 303663928      673829        syn-C2H3C(O)NH2, v=0
   48110.3903  0.0029 -6.6764 3  356.7009103  71510 303511041      52 944        syn-C2H3C(O)NH2, v=0
   48118.0046  0.0104 -7.3113 3  769.0914151  71510 303751560      761463        syn-C2H3C(O)NH2, v=0
   48120.1333  0.0035 -6.4468 3  718.8450129  71510 303643034      633133        syn-C2H3C(O)NH2, v=0
   48120.1333  0.0035 -6.4468 3  718.8450129  71510 303643035      633132        syn-C2H3C(O)NH2, v=0
   48197.2624  0.0041 -6.5765 3  100.2248 55  71510 30327 622      28 325        syn-C2H3C(O)NH2, v=0
   48200.8870  0.0370 -7.5232 3  985.8812171  71510 303851868      841965        syn-C2H3C(O)NH2, v=0
   48271.0688  0.0249 -7.4050 3 1225.7220167  71510 303834043      824142        syn-C2H3C(O)NH2, v=0
   48271.0688  0.0249 -7.4050 3 1225.7220167  71510 303834044      824141        syn-C2H3C(O)NH2, v=0
   48272.2243  0.0019 -6.2689 3  471.7124 95  71510 303472918      482821        syn-C2H3C(O)NH2, v=0
   48272.2243  0.0019 -6.2689 3  471.7124 95  71510 303472919      482820        syn-C2H3C(O)NH2, v=0
   48302.2048  0.0104 -7.3080 3  769.0914151  71510 303751660      761363        syn-C2H3C(O)NH2, v=0
   48327.7247  0.0041 -6.8989 3  330.0397 95  71510 303471533      481236        syn-C2H3C(O)NH2, v=0
   48380.5167  0.0537 -7.8766 3 1389.0734167  71510 303834835      844738        syn-C2H3C(O)NH2, v=0
   48380.5167  0.0537 -7.8766 3 1389.0734167  71510 303834836      844737        syn-C2H3C(O)NH2, v=0
   48412.4058  0.0013 -5.7861 3  346.1097 91  71510 303452026      442123        syn-C2H3C(O)NH2, v=0
   48412.4062  0.0013 -5.7861 3  346.1097 91  71510 303452025      442124        syn-C2H3C(O)NH2, v=0
   48417.5313  0.0015 -5.4425 3   75.7548 45  71510 30322 815      21 912        syn-C2H3C(O)NH2, v=0
   48524.1385  0.0004 -5.2044 3    7.2854 13  71510 303 6 4 2       6 3 3        syn-C2H3C(O)NH2, v=0
   48543.6858  0.0053 -6.5476 3  443.4137115  71510 303571246      561343        syn-C2H3C(O)NH2, v=0
   48753.4825  0.0007 -4.9753 3   13.9233 21  71510 30310 3 8      10 2 9        syn-C2H3C(O)NH2, v=0
   48775.2090  0.0018 -5.9860 3  160.4144 53  71510 3032618 8      271711        syn-C2H3C(O)NH2, v=0
   48775.2090  0.0018 -5.9860 3  160.4144 53  71510 3032618 9      271710        syn-C2H3C(O)NH2, v=0
   48874.3894  0.0046 -6.7078 3  563.0470129  71510 303641351      631648        syn-C2H3C(O)NH2, v=0
   48907.6666  0.0099 -6.8692 3  845.3946129  71510 303643826      653729        syn-C2H3C(O)NH2, v=0
   48907.6666  0.0099 -6.8692 3  845.3946129  71510 303643827      653728        syn-C2H3C(O)NH2, v=0
   48925.2172  0.0042 -6.5166 3  765.1159133  71510 303663135      653234        syn-C2H3C(O)NH2, v=0
   48925.2172  0.0042 -6.5166 3  765.1159133  71510 303663136      653233        syn-C2H3C(O)NH2, v=0
   48997.2847  0.0009 -5.2348 3    9.9816 19  71510 303 9 2 8       9 1 9        syn-C2H3C(O)NH2, v=0
   49041.2504  0.0019 -6.2071 3  435.5945 91  71510 303452817      462720        syn-C2H3C(O)NH2, v=0
   49041.2504  0.0019 -6.2071 3  435.5945 91  71510 303452818      462719        syn-C2H3C(O)NH2, v=0
   49052.3562  0.0029 -6.6598 3  356.7007103  71510 303511141      52 844        syn-C2H3C(O)NH2, v=0
   49098.6258  0.0015 -5.4355 3   91.2464 49  71510 30324 916      231013        syn-C2H3C(O)NH2, v=0
   49110.8521  0.0295 -7.5053 3 1285.8220171  71510 303854144      844243        syn-C2H3C(O)NH2, v=0
   49110.8521  0.0295 -7.5053 3 1285.8220171  71510 303854145      844242        syn-C2H3C(O)NH2, v=0
   49129.6175  0.0032 -7.7900 3  138.2585 63  71510 30331 823      31 824        syn-C2H3C(O)NH2, v=0
   49138.0102  0.0004 -5.3475 3    5.7967 11  71510 303 5 4 1       5 3 2        syn-C2H3C(O)NH2, v=0
   49162.6928  0.0016 -5.4287 3   75.7540 45  71510 30322 814      21 913        syn-C2H3C(O)NH2, v=0
   49176.9071  0.0014 -5.8239 3  378.4688 95  71510 303472127      462224        syn-C2H3C(O)NH2, v=0
   49176.9072  0.0014 -5.8239 3  378.4688 95  71510 303472126      462225        syn-C2H3C(O)NH2, v=0
   49215.0517  0.0030 -6.7887 3   70.2480 43  71510 30321 814      22 517        syn-C2H3C(O)NH2, v=0
   49230.0912  0.0466 -7.7452 3 1326.6926163  71510 303814734      824637        syn-C2H3C(O)NH2, v=0
   49230.0912  0.0466 -7.7452 3 1326.6926163  71510 303814735      824636        syn-C2H3C(O)NH2, v=0
   49293.6658  0.0044 -6.6787 3   71.9926 47  71510 30323 419      24 322        syn-C2H3C(O)NH2, v=0
   49368.0068  0.0016 -5.4307 3   91.2462 49  71510 30324 915      231014        syn-C2H3C(O)NH2, v=0
   49413.3760  0.0004 -5.1919 3    7.2546 13  71510 303 6 4 3       6 3 4        syn-C2H3C(O)NH2, v=0
   49423.8512  0.0016 -4.6294 3   41.0515 35  71510 30317 413      17 314        syn-C2H3C(O)NH2, v=0
   49429.2940  0.0182 -7.4747 3  874.1043161  71510 303801664      811567        syn-C2H3C(O)NH2, v=0
   49436.3104  0.0393 -7.5885 3  927.5850163  71510 303812061      802358        syn-C2H3C(O)NH2, v=0
   49438.8644  0.0004 -5.6099 3    4.5664  9  71510 303 4 4 0       4 3 1        syn-C2H3C(O)NH2, v=0
   49448.8480  0.0004 -5.3430 3    5.7861 11  71510 303 5 4 2       5 3 3        syn-C2H3C(O)NH2, v=0
   49467.5853  0.0016 -5.4227 3   61.7105 41  71510 30320 713      19 812        syn-C2H3C(O)NH2, v=0
   49483.7104  0.0018 -5.9937 3  139.6966 49  71510 3032417 7      251610        syn-C2H3C(O)NH2, v=0
   49483.7104  0.0018 -5.9937 3  139.6966 49  71510 3032417 8      2516 9        syn-C2H3C(O)NH2, v=0
   49490.7831  0.0004 -5.0845 3    8.9682 15  71510 303 7 4 4       7 3 5        syn-C2H3C(O)NH2, v=0
   49518.9431  0.0004 -5.6088 3    4.5637  9  71510 303 4 4 1       4 3 2        syn-C2H3C(O)NH2, v=0
   49547.7420  0.0182 -7.4726 3  874.1042161  71510 303801764      811467        syn-C2H3C(O)NH2, v=0
   49575.1870  0.0031 -6.5636 3  456.3467115  71510 303571344      561641        syn-C2H3C(O)NH2, v=0
   49622.7629  0.0004 -7.0094 3    5.9896 15  71510 303 7 2 6       6 2 5        syn-C2H3C(O)NH2, v=0
   49670.4433  0.0035 -7.2249 3   25.7497 29  71510 30314 212      15 115        syn-C2H3C(O)NH2, v=0
   49686.7690  0.0038 -6.5177 3  187.6150 75  71510 30337 730      38 633        syn-C2H3C(O)NH2, v=0
   49713.8206  0.0080 -6.7724 3  796.8222125  71510 303623725      633628        syn-C2H3C(O)NH2, v=0
   49713.8206  0.0080 -6.7724 3  796.8222125  71510 303623726      633627        syn-C2H3C(O)NH2, v=0
   49718.0301  0.0015 -5.4349 3  108.1871 53  71510 303261017      251114        syn-C2H3C(O)NH2, v=0
   49733.3036  0.0052 -6.5898 3  812.8226137  71510 303683236      673335        syn-C2H3C(O)NH2, v=0
   49733.3036  0.0052 -6.5898 3  812.8226137  71510 303683237      673334        syn-C2H3C(O)NH2, v=0
   49787.3711  0.0004 -4.9990 3   10.9244 17  71510 303 8 4 5       8 3 6        syn-C2H3C(O)NH2, v=0
   49805.1040  0.0019 -6.1504 3  400.9183 87  71510 303432716      442619        syn-C2H3C(O)NH2, v=0
   49805.1040  0.0019 -6.1504 3  400.9183 87  71510 303432717      442618        syn-C2H3C(O)NH2, v=0
   49811.8332  0.0015 -5.4332 3  108.1870 53  71510 303261016      251115        syn-C2H3C(O)NH2, v=0
   49829.6552  0.0011 -5.4382 3   41.9832 35  71510 30317 513      16 610        syn-C2H3C(O)NH2, v=0
   49886.7984  0.0039 -6.5121 3  140.5536 65  71510 30332 726      33 429        syn-C2H3C(O)NH2, v=0
   49915.8379  0.0032 -6.7448 3  429.4334113  71510 303561145      571048        syn-C2H3C(O)NH2, v=0
   49943.4394  0.0032 -7.9974 3  344.7013 99  71510 303491336      491337        syn-C2H3C(O)NH2, v=0
   49945.6457  0.0015 -5.8653 3  412.2711 99  71510 303492228      482325        syn-C2H3C(O)NH2, v=0
   49945.6458  0.0015 -5.8653 3  412.2711 99  71510 303492227      482326        syn-C2H3C(O)NH2, v=0
   49954.1072  0.0348 -7.6090 3 1347.3478175  71510 303874245      864344        syn-C2H3C(O)NH2, v=0
   49954.1072  0.0348 -7.6090 3 1347.3478175  71510 303874246      864343        syn-C2H3C(O)NH2, v=0
   50039.7058  0.0009 -4.6846 3   30.1697 29  71510 30314 5 9      14 410        syn-C2H3C(O)NH2, v=0
   50074.8132  0.0402 -7.6175 3 1265.7364159  71510 303794633      804536        syn-C2H3C(O)NH2, v=0
   50074.8132  0.0402 -7.6175 3 1265.7364159  71510 303794634      804535        syn-C2H3C(O)NH2, v=0
   50145.4726  0.0724 -7.9003 3 1206.0605189  71510 303941975      932272        syn-C2H3C(O)NH2, v=0
   50168.3437  0.0036 -6.8355 3   43.9286 37  71510 30318 415      19 118        syn-C2H3C(O)NH2, v=0
   50182.4406  0.0018 -6.0141 3  120.4260 45  71510 3032216 6      2315 9        syn-C2H3C(O)NH2, v=0
   50182.4406  0.0018 -6.0141 3  120.4260 45  71510 3032216 7      2315 8        syn-C2H3C(O)NH2, v=0
   50189.6863  0.0036 -6.5039 3  464.6628117  71510 303581246      571543        syn-C2H3C(O)NH2, v=0
   50337.9882  0.0015 -5.4389 3  126.5763 57  71510 303281118      271215        syn-C2H3C(O)NH2, v=0
   50369.7359  0.0015 -5.4383 3  126.5763 57  71510 303281117      271216        syn-C2H3C(O)NH2, v=0
   50424.9649  0.0004 -4.9255 3   13.1196 19  71510 303 9 4 6       9 3 7        syn-C2H3C(O)NH2, v=0
   50515.2729  0.0064 -6.6797 3  749.6847121  71510 303603624      613527        syn-C2H3C(O)NH2, v=0
   50515.2729  0.0064 -6.6797 3  749.6847121  71510 303603625      613526        syn-C2H3C(O)NH2, v=0
   50537.6793  0.0031 -6.7341 3  429.4332113  71510 303561245      57 948        syn-C2H3C(O)NH2, v=0
   50544.4321  0.0065 -6.6665 3  861.9642141  71510 303703337      693436        syn-C2H3C(O)NH2, v=0
   50544.4321  0.0065 -6.6665 3  861.9642141  71510 303703338      693435        syn-C2H3C(O)NH2, v=0
   50563.5895  0.0019 -6.0989 3  367.6846 83  71510 303412615      422518        syn-C2H3C(O)NH2, v=0
   50563.5895  0.0019 -6.0989 3  367.6846 83  71510 303412616      422517        syn-C2H3C(O)NH2, v=0
   50659.5526  0.0301 -7.6561 3  985.7966171  71510 303851768      861671        syn-C2H3C(O)NH2, v=0
   50718.3512  0.0016 -5.9104 3  447.5158103  71510 303512328      502427        syn-C2H3C(O)NH2, v=0
   50718.3512  0.0016 -5.9104 3  447.5158103  71510 303512329      502426        syn-C2H3C(O)NH2, v=0
   50735.4559  0.0300 -7.6548 3  985.7966171  71510 303851868      861571        syn-C2H3C(O)NH2, v=0
   50757.6996  0.0064 -6.8374 3  653.4558139  71510 303691455      681752        syn-C2H3C(O)NH2, v=0
   50773.8459  0.0017 -5.4038 3   49.1154 37  71510 30318 612      17 711        syn-C2H3C(O)NH2, v=0
   50800.9032  0.0407 -7.7161 3 1410.2983179  71510 303894346      884445        syn-C2H3C(O)NH2, v=0
   50800.9032  0.0407 -7.7161 3 1410.2983179  71510 303894347      884444        syn-C2H3C(O)NH2, v=0
   50830.4023  0.0049 -6.1980 3  251.9405 87  71510 30343 935      421032        syn-C2H3C(O)NH2, v=0
   50842.2138  0.0006 -5.0461 3    7.6449 17  71510 303 8 1 7       7 2 6        syn-C2H3C(O)NH2, v=0
   50860.2024  0.0015 -4.9061 3   19.1397 25  71510 30312 210      12 111        syn-C2H3C(O)NH2, v=0
   50870.1495  0.0018 -6.0504 3  102.6031 41  71510 3032015 5      2114 8        syn-C2H3C(O)NH2, v=0
   50870.1495  0.0018 -6.0504 3  102.6031 41  71510 3032015 6      2114 7        syn-C2H3C(O)NH2, v=0
   50914.6961  0.0346 -7.4936 3 1206.2060155  71510 303774532      784435        syn-C2H3C(O)NH2, v=0
   50914.6961  0.0346 -7.4936 3 1206.2060155  71510 303774533      784434        syn-C2H3C(O)NH2, v=0
   50976.9991  0.0015 -5.4470 3  146.4136 61  71510 303301219      291316        syn-C2H3C(O)NH2, v=0
   50987.5061  0.0015 -5.4468 3  146.4136 61  71510 303301218      291317        syn-C2H3C(O)NH2, v=0
   50999.5875  0.0482 -7.6450 3 1082.1749179  71510 303891871      882168        syn-C2H3C(O)NH2, v=0
   51040.9611  0.0028 -7.7994 3   62.8329 43  71510 30321 516      21 517        syn-C2H3C(O)NH2, v=0
   51067.0700  0.0005 -4.7637 3    6.3485 17  71510 303 8 0 8       7 1 7        syn-C2H3C(O)NH2, v=0
   51160.6047  0.0004 -7.5343 3   13.6187 15  71510 303 7 6 2       6 6 1        syn-C2H3C(O)NH2, v=0
   51160.6342  0.0004 -7.5343 3   13.6187 15  71510 303 7 6 1       6 6 0        syn-C2H3C(O)NH2, v=0
   51272.4075  0.0004 -7.2607 3   11.0224 15  71510 303 7 5 3       6 5 2        syn-C2H3C(O)NH2, v=0
   51274.8319  0.0004 -7.2607 3   11.0225 15  71510 303 7 5 2       6 5 1        syn-C2H3C(O)NH2, v=0
   51311.9818  0.0051 -6.5911 3  703.9829117  71510 303583523      593426        syn-C2H3C(O)NH2, v=0
   51311.9818  0.0051 -6.5911 3  703.9829117  71510 303583524      593425        syn-C2H3C(O)NH2, v=0
   51316.4736  0.0019 -6.0529 3  335.8939 79  71510 303392514      402417        syn-C2H3C(O)NH2, v=0
   51316.4736  0.0019 -6.0529 3  335.8939 79  71510 303392515      402416        syn-C2H3C(O)NH2, v=0
   51358.6469  0.0081 -6.7467 3  912.5397145  71510 303723438      713537        syn-C2H3C(O)NH2, v=0
   51358.6469  0.0081 -6.7467 3  912.5397145  71510 303723439      713536        syn-C2H3C(O)NH2, v=0
   51371.3505  0.0004 -7.0302 3    7.2546 15  71510 303 7 3 5       6 3 4        syn-C2H3C(O)NH2, v=0
   51400.8221  0.0005 -6.8919 3    6.3485 17  71510 303 8 1 8       7 1 7        syn-C2H3C(O)NH2, v=0
   51448.7576  0.0004 -7.1152 3    8.9029 15  71510 303 7 4 4       6 4 3        syn-C2H3C(O)NH2, v=0
   51494.8168  0.0018 -5.9592 3  484.2024107  71510 303532429      522528        syn-C2H3C(O)NH2, v=0
   51494.8168  0.0018 -5.9592 3  484.2024107  71510 303532430      522527        syn-C2H3C(O)NH2, v=0
   51509.6356  0.0004 -4.4716 3   64.5355 43  71510 30321 615      21 516        syn-C2H3C(O)NH2, v=0
   51524.4324  0.0005 -4.8583 3   15.5495 21  71510 30310 4 7      10 3 8        syn-C2H3C(O)NH2, v=0
   51536.3544  0.0004 -7.1137 3    8.9040 15  71510 303 7 4 3       6 4 2        syn-C2H3C(O)NH2, v=0
   51545.2920  0.0017 -6.1073 3   86.2281 37  71510 3031814 4      1913 7        syn-C2H3C(O)NH2, v=0
   51545.2920  0.0017 -6.1073 3   86.2281 37  71510 3031814 5      1913 6        syn-C2H3C(O)NH2, v=0
   51561.2050  0.0036 -6.4863 3  187.6147 75  71510 30337 830      38 533        syn-C2H3C(O)NH2, v=0
   51592.6844  0.0233 -7.2502 3  874.0360161  71510 303801764      791861        syn-C2H3C(O)NH2, v=0
   51592.9551  0.0035 -6.8356 3  508.8757123  71510 303611249      621152        syn-C2H3C(O)NH2, v=0
   51595.3032  0.0038 -6.6976 3  156.9529 65  71510 303321122      33 825        syn-C2H3C(O)NH2, v=0
   51619.5687  0.0003 -5.2119 3    2.8389 11  71510 303 5 2 4       4 1 3        syn-C2H3C(O)NH2, v=0
   51634.9172  0.0305 -7.4084 3  964.9592169  71510 303841767      832064        syn-C2H3C(O)NH2, v=0
   51637.5183  0.0014 -5.4590 3  167.6986 65  71510 303321320      311417        syn-C2H3C(O)NH2, v=0
   51640.9333  0.0014 -5.4590 3  167.6986 65  71510 303321319      311418        syn-C2H3C(O)NH2, v=0
   51651.3094  0.0473 -7.8265 3 1474.6723183  71510 303914447      904546        syn-C2H3C(O)NH2, v=0
   51651.3094  0.0473 -7.8265 3 1474.6723183  71510 303914448      904545        syn-C2H3C(O)NH2, v=0
   51683.2810  0.0005 -6.8866 3    6.3279 17  71510 303 8 0 8       7 0 7        syn-C2H3C(O)NH2, v=0
   51696.2316  0.0106 -7.0009 3  750.5866149  71510 303741559      731856        syn-C2H3C(O)NH2, v=0
   51749.7492  0.0295 -7.3735 3 1148.1025151  71510 303754431      764334        syn-C2H3C(O)NH2, v=0
   51749.7492  0.0295 -7.3735 3 1148.1025151  71510 303754432      764333        syn-C2H3C(O)NH2, v=0
   51811.3131  0.0470 -7.8552 3 1104.1610181  71510 303901872      911775        syn-C2H3C(O)NH2, v=0
   51859.8123  0.0469 -7.8543 3 1104.1610181  71510 303901972      911675        syn-C2H3C(O)NH2, v=0
   51873.8104  0.0064 -6.7414 3  595.0743133  71510 303661453      651550        syn-C2H3C(O)NH2, v=0
   51921.9441  0.0183 -7.1926 3  854.4255159  71510 303791663      781960        syn-C2H3C(O)NH2, v=0
   51948.6721  0.0032 -6.5122 3  241.4041 85  71510 30342 834      43 737        syn-C2H3C(O)NH2, v=0
   52000.1504  0.0035 -6.8289 3  508.8757123  71510 303611349      621052        syn-C2H3C(O)NH2, v=0
   52017.0331  0.0005 -4.7460 3    6.3279 17  71510 303 8 1 8       7 0 7        syn-C2H3C(O)NH2, v=0
   52063.4780  0.0019 -6.0127 3  305.5468 75  71510 303372413      382316        syn-C2H3C(O)NH2, v=0
   52063.4780  0.0019 -6.0127 3  305.5468 75  71510 303372414      382315        syn-C2H3C(O)NH2, v=0
   52103.8935  0.0040 -6.5068 3  659.7177113  71510 303563422      573325        syn-C2H3C(O)NH2, v=0
   52103.8935  0.0040 -6.5068 3  659.7177113  71510 303563423      573324        syn-C2H3C(O)NH2, v=0
   52113.7283  0.0029 -6.4091 3  421.9889111  71510 303551243      541540        syn-C2H3C(O)NH2, v=0
   52172.1033  0.0015 -4.5048 3   57.3107 41  71510 30320 515      20 416        syn-C2H3C(O)NH2, v=0
   52175.9963  0.0101 -6.8303 3  964.5483149  71510 303743539      733638        syn-C2H3C(O)NH2, v=0
   52175.9963  0.0101 -6.8303 3  964.5483149  71510 303743540      733637        syn-C2H3C(O)NH2, v=0
   52178.6118  0.0220 -7.5795 3  780.3294147  71510 303732252      741955        syn-C2H3C(O)NH2, v=0
   52205.9469  0.0016 -6.1927 3   71.3013 33  71510 3031613 3      1712 6        syn-C2H3C(O)NH2, v=0
   52205.9469  0.0016 -6.1927 3   71.3013 33  71510 3031613 4      1712 5        syn-C2H3C(O)NH2, v=0
   52274.8854  0.0019 -6.0116 3  522.3302111  71510 303552530      542629        syn-C2H3C(O)NH2, v=0
   52274.8854  0.0019 -6.0116 3  522.3302111  71510 303552531      542628        syn-C2H3C(O)NH2, v=0
   52275.8879  0.0044 -6.5427 3  106.7991 57  71510 30328 523      29 426        syn-C2H3C(O)NH2, v=0
   52290.5450  0.0004 -6.9421 3    5.6406 15  71510 303 7 1 6       6 1 5        syn-C2H3C(O)NH2, v=0
   52317.2109  0.0014 -5.4749 3  190.4307 69  71510 303341421      331518        syn-C2H3C(O)NH2, v=0
   52318.3044  0.0014 -5.4749 3  190.4307 69  71510 303341420      331519        syn-C2H3C(O)NH2, v=0
   52329.7359  0.0036 -5.7642 3   71.9980 47  71510 30323 519      22 616        syn-C2H3C(O)NH2, v=0
   52463.2747  0.0012 -5.1719 3   12.1005 21  71510 30310 1 9      10 010        syn-C2H3C(O)NH2, v=0
   52464.9750  0.0006 -4.4457 3   70.2480 45  71510 30322 616      22 517        syn-C2H3C(O)NH2, v=0
   52502.6555  0.0040 -6.6269 3   71.9923 47  71510 30323 519      24 222        syn-C2H3C(O)NH2, v=0
   52505.3951  0.0547 -7.9403 3 1540.4684187  71510 303934548      924647        syn-C2H3C(O)NH2, v=0
   52505.3951  0.0547 -7.9403 3 1540.4684187  71510 303934549      924646        syn-C2H3C(O)NH2, v=0
   52521.9335  0.0064 -6.8981 3  633.3110135  71510 303671651      661948        syn-C2H3C(O)NH2, v=0
   52533.4944  0.0020 -7.8993 3   31.0426 31  71510 30315 312      15 313        syn-C2H3C(O)NH2, v=0
   52556.4953  0.0026 -6.8767 3   47.3623 35  71510 30317 711      18 414        syn-C2H3C(O)NH2, v=0
   52571.3430  0.0007 -4.4801 3   59.0510 41  71510 30320 614      20 515        syn-C2H3C(O)NH2, v=0
   52579.9770  0.0250 -7.2572 3 1091.4271147  71510 303734330      744233        syn-C2H3C(O)NH2, v=0
   52579.9770  0.0250 -7.2572 3 1091.4271147  71510 303734331      744232        syn-C2H3C(O)NH2, v=0
   52636.9089  0.0005 -7.0086 3    7.2854 15  71510 303 7 3 4       6 3 3        syn-C2H3C(O)NH2, v=0
   52772.1250  0.0024 -7.8223 3   45.6020 37  71510 30318 414      18 415        syn-C2H3C(O)NH2, v=0
   52804.2713  0.0019 -5.9788 3  276.6439 71  71510 303352312      362215        syn-C2H3C(O)NH2, v=0
   52804.2713  0.0019 -5.9788 3  276.6439 71  71510 303352313      362214        syn-C2H3C(O)NH2, v=0
   52849.7112  0.0016 -6.3213 3   57.8228 29  71510 3031412 2      1511 5        syn-C2H3C(O)NH2, v=0
   52849.7112  0.0016 -6.3213 3   57.8228 29  71510 3031412 3      1511 4        syn-C2H3C(O)NH2, v=0
   52890.9405  0.0032 -6.4268 3  616.8900109  71510 303543321      553224        syn-C2H3C(O)NH2, v=0
   52890.9405  0.0032 -6.4268 3  616.8900109  71510 303543322      553223        syn-C2H3C(O)NH2, v=0
   52893.0056  0.0032 -7.1763 3   25.7496 29  71510 30314 312      15 015        syn-C2H3C(O)NH2, v=0
   52966.4003  0.0034 -6.4265 3  450.1897115  71510 303571245      561542        syn-C2H3C(O)NH2, v=0
   52987.5572  0.0063 -7.0879 3  497.5038117  71510 303581841      591544        syn-C2H3C(O)NH2, v=0
   52996.5317  0.0124 -6.9173 3 1017.9889153  71510 303763640      753739        syn-C2H3C(O)NH2, v=0
   52996.5317  0.0124 -6.9173 3 1017.9889153  71510 303763641      753738        syn-C2H3C(O)NH2, v=0
   53012.9258  0.0013 -5.4946 3  214.6096 73  71510 303361522      351619        syn-C2H3C(O)NH2, v=0
   53013.2716  0.0013 -5.4946 3  214.6096 73  71510 303361521      351620        syn-C2H3C(O)NH2, v=0
   53027.8521  0.0009 -4.8928 3   16.4402 23  71510 30311 3 9      11 210        syn-C2H3C(O)NH2, v=0
   53058.4396  0.0021 -6.0675 3  561.8984115  71510 303572631      562730        syn-C2H3C(O)NH2, v=0
   53058.4396  0.0021 -6.0675 3  561.8984115  71510 303572632      562729        syn-C2H3C(O)NH2, v=0
   53114.0175  0.0156 -7.1880 3  773.4852149  71510 303741856      732153        syn-C2H3C(O)NH2, v=0
   53161.5437  0.0043 -6.9473 3  595.0226133  71510 303661353      671256        syn-C2H3C(O)NH2, v=0
   53189.3032  0.0005 -4.7943 3   18.2090 23  71510 30311 4 8      11 3 9        syn-C2H3C(O)NH2, v=0
   53225.1268  0.0031 -6.4916 3  241.4039 85  71510 30342 934      43 637        syn-C2H3C(O)NH2, v=0
   53405.3790  0.0211 -7.1447 3 1036.1808143  71510 303714229      724132        syn-C2H3C(O)NH2, v=0
   53405.3790  0.0211 -7.1447 3 1036.1808143  71510 303714230      724131        syn-C2H3C(O)NH2, v=0
   53426.4287  0.0042 -6.9431 3  595.0225133  71510 303661453      671156        syn-C2H3C(O)NH2, v=0
   53462.4054  0.0041 -6.8169 3   48.2758 39  71510 30319 316      20 219        syn-C2H3C(O)NH2, v=0
   53465.3915  0.0008 -4.6848 3   26.5301 27  71510 30313 5 8      13 4 9        syn-C2H3C(O)NH2, v=0
   53473.5642  0.0015 -6.5248 3   45.7928 25  71510 3031211 1      1310 4        syn-C2H3C(O)NH2, v=0
   53473.5642  0.0015 -6.5248 3   45.7928 25  71510 3031211 2      1310 3        syn-C2H3C(O)NH2, v=0
   53538.4587  0.0019 -5.9517 3  249.1858 67  71510 303332211      342114        syn-C2H3C(O)NH2, v=0
   53538.4587  0.0019 -5.9517 3  249.1858 67  71510 303332212      342113        syn-C2H3C(O)NH2, v=0
   53555.5024  0.0018 -5.3598 3   37.9667 33  71510 30316 511      15 610        syn-C2H3C(O)NH2, v=0
   53619.2963  0.0030 -7.8284 3  253.2002 85  71510 303421131      421132        syn-C2H3C(O)NH2, v=0
   53673.0400  0.0026 -6.3512 3  575.5005105  71510 303523220      533123        syn-C2H3C(O)NH2, v=0
   53673.0400  0.0026 -6.3512 3  575.5005105  71510 303523221      533122        syn-C2H3C(O)NH2, v=0
   53721.8674  0.0012 -5.5180 3  240.2348 77  71510 303381623      371720        syn-C2H3C(O)NH2, v=0
   53721.9755  0.0012 -5.5180 3  240.2348 77  71510 303381622      371721        syn-C2H3C(O)NH2, v=0
   53742.6119  0.0032 -6.3922 3  435.9627113  71510 303561244      551541        syn-C2H3C(O)NH2, v=0
   53820.3072  0.0151 -7.0078 3 1072.8604157  71510 303783741      773840        syn-C2H3C(O)NH2, v=0
   53820.3072  0.0151 -7.0078 3 1072.8604157  71510 303783742      773839        syn-C2H3C(O)NH2, v=0
   53845.3933  0.0023 -6.1270 3  602.9063119  71510 303592732      582831        syn-C2H3C(O)NH2, v=0
   53845.3933  0.0023 -6.1270 3  602.9063119  71510 303592733      582830        syn-C2H3C(O)NH2, v=0
   53880.1785  0.0013 -5.3343 3   53.5994 39  71510 30319 614      18 711        syn-C2H3C(O)NH2, v=0
   54014.5884  0.0029 -6.5369 3  301.9171 95  71510 30347 938      48 841        syn-C2H3C(O)NH2, v=0
   54073.7011  0.0013 -6.8975 3   35.2114 21  71510 3031010 0      11 9 3        syn-C2H3C(O)NH2, v=0
   54073.7011  0.0013 -6.8975 3   35.2114 21  71510 3031010 1      11 9 2        syn-C2H3C(O)NH2, v=0
   54132.5578  0.0786 -7.8332 3 1205.9292189  71510 303942075      932172        syn-C2H3C(O)NH2, v=0
   54225.9488  0.0176 -7.0361 3  982.3647139  71510 303694128      704031        syn-C2H3C(O)NH2, v=0
   54225.9488  0.0176 -7.0361 3  982.3647139  71510 303694129      704030        syn-C2H3C(O)NH2, v=0
   54265.5696  0.0019 -5.9318 3  223.1729 63  71510 303312110      322013        syn-C2H3C(O)NH2, v=0
   54265.5696  0.0019 -5.9318 3  223.1729 63  71510 303312111      322012        syn-C2H3C(O)NH2, v=0
   54441.8117  0.0012 -5.5452 3  267.3059 81  71510 303401724      391821        syn-C2H3C(O)NH2, v=0
   54441.8452  0.0012 -5.5452 3  267.3059 81  71510 303401723      391822        syn-C2H3C(O)NH2, v=0
   54450.0913  0.0023 -6.2802 3  535.5501101  71510 303503119      513022        syn-C2H3C(O)NH2, v=0
   54450.0913  0.0023 -6.2802 3  535.5501101  71510 303503120      513021        syn-C2H3C(O)NH2, v=0
   54484.7698  0.0018 -4.6832 3   30.9775 31  71510 30315 312      15 213        syn-C2H3C(O)NH2, v=0
   54555.8123  0.0010 -5.1419 3   12.1035 21  71510 30310 2 9      10 110        syn-C2H3C(O)NH2, v=0
   54557.6033  0.0005 -6.9225 3    6.2638 15  71510 303 7 2 5       6 2 4        syn-C2H3C(O)NH2, v=0
   54612.1008  0.0041 -6.5063 3  106.7988 57  71510 30328 623      29 326        syn-C2H3C(O)NH2, v=0
   54635.0579  0.0065 -7.0788 3  687.8681143  71510 303711457      721360        syn-C2H3C(O)NH2, v=0
   54635.6859  0.0026 -6.1900 3  645.3531123  71510 303612833      602932        syn-C2H3C(O)NH2, v=0
   54635.6859  0.0026 -6.1900 3  645.3531123  71510 303612834      602931        syn-C2H3C(O)NH2, v=0
   54647.3794  0.0183 -7.1016 3 1129.1620161  71510 303803842      793941        syn-C2H3C(O)NH2, v=0
   54647.3794  0.0183 -7.1016 3 1129.1620161  71510 303803843      793940        syn-C2H3C(O)NH2, v=0
   54673.6903  0.0021 -7.0637 3   28.9647 27  71510 30313 6 8      14 311        syn-C2H3C(O)NH2, v=0
   54684.5733  0.0051 -6.3099 3  369.2094105  71510 303521142      511239        syn-C2H3C(O)NH2, v=0
   54755.6774  0.0044 -6.5660 3  547.0767127  71510 303631350      621647        syn-C2H3C(O)NH2, v=0
   54789.9095  0.0033 -7.7122 3  112.2423 57  71510 30328 721      28 722        syn-C2H3C(O)NH2, v=0
   54806.4332  0.0065 -7.0761 3  687.8680143  71510 303711557      721260        syn-C2H3C(O)NH2, v=0
   54871.2195  0.0028 -6.5234 3  301.9169 95  71510 303471038      48 741        syn-C2H3C(O)NH2, v=0
   54932.5257  0.0038 -6.7571 3  277.8908 87  71510 303431430      441133        syn-C2H3C(O)NH2, v=0
   54951.9166  0.0041 -6.4656 3  148.3428 67  71510 30333 627      34 530        syn-C2H3C(O)NH2, v=0
   54985.0416  0.0019 -5.9203 3  198.6057 59  71510 3032920 9      301912        syn-C2H3C(O)NH2, v=0
   54985.0416  0.0019 -5.9203 3  198.6057 59  71510 303292010      301911        syn-C2H3C(O)NH2, v=0
   55041.6735  0.0146 -6.9313 3  929.9799135  71510 303674027      683930        syn-C2H3C(O)NH2, v=0
   55041.6735  0.0146 -6.9313 3  929.9799135  71510 303674028      683929        syn-C2H3C(O)NH2, v=0
   55171.0481  0.0012 -5.5761 3  295.8222 85  71510 303421825      411922        syn-C2H3C(O)NH2, v=0
   55171.0584  0.0012 -5.5761 3  295.8222 85  71510 303421824      411923        syn-C2H3C(O)NH2, v=0
   55221.9730  0.0020 -6.2137 3  497.0395 97  71510 303483018      492921        syn-C2H3C(O)NH2, v=0
   55221.9730  0.0020 -6.2137 3  497.0395 97  71510 303483019      492920        syn-C2H3C(O)NH2, v=0
   55243.2968  0.0010 -4.4756 3   53.8142 39  71510 30319 613      19 514        syn-C2H3C(O)NH2, v=0
   55255.6296  0.0016 -7.4167 3   15.0568 19  71510 303 9 5 5      10 2 8        syn-C2H3C(O)NH2, v=0
   55303.7286  0.0609 -7.8548 3 1431.8996169  71510 303844935      854838        syn-C2H3C(O)NH2, v=0
   55303.7286  0.0609 -7.8548 3 1431.8996169  71510 303844936      854837        syn-C2H3C(O)NH2, v=0
   55316.6665  0.0012 -5.3502 3   46.2542 37  71510 30318 514      17 611        syn-C2H3C(O)NH2, v=0
   55351.1172  0.0052 -6.0164 3  196.7240 77  71510 30338 831      37 928        syn-C2H3C(O)NH2, v=0
   55429.2775  0.0031 -6.2565 3  689.2380127  71510 303632934      623033        syn-C2H3C(O)NH2, v=0
   55429.2775  0.0031 -6.2565 3  689.2380127  71510 303632935      623032        syn-C2H3C(O)NH2, v=0
   55441.1114  0.0033 -7.7296 3  175.7066 71  71510 30335 926      35 927        syn-C2H3C(O)NH2, v=0
   55477.8067  0.0219 -7.1987 3 1186.8924165  71510 303823943      814042        syn-C2H3C(O)NH2, v=0
   55477.8067  0.0219 -7.1987 3 1186.8924165  71510 303823944      814041        syn-C2H3C(O)NH2, v=0
   55492.5595  0.0006 -4.7317 3   21.0929 25  71510 30312 4 9      12 310        syn-C2H3C(O)NH2, v=0
   55637.4804  0.0012 -4.4018 3   76.1694 47  71510 30323 617      23 518        syn-C2H3C(O)NH2, v=0
   55696.2015  0.0019 -5.9180 3  175.4848 55  71510 3032719 8      281811        syn-C2H3C(O)NH2, v=0
   55696.2015  0.0019 -5.9180 3  175.4848 55  71510 3032719 9      281810        syn-C2H3C(O)NH2, v=0
   55780.5459  0.0141 -6.9828 3  768.8419151  71510 303751660      741757        syn-C2H3C(O)NH2, v=0
   55852.5327  0.0120 -6.8306 3  879.0273131  71510 303653926      663829        syn-C2H3C(O)NH2, v=0
   55852.5327  0.0120 -6.8306 3  879.0273131  71510 303653927      663828        syn-C2H3C(O)NH2, v=0
   55908.2691  0.0012 -5.6106 3  325.7833 89  71510 303441926      432023        syn-C2H3C(O)NH2, v=0
   55908.2723  0.0012 -5.6106 3  325.7833 89  71510 303441925      432024        syn-C2H3C(O)NH2, v=0
   55920.5023  0.0029 -6.5878 3  369.1493105  71510 303521042      53 945        syn-C2H3C(O)NH2, v=0
   55942.8189  0.0004 -5.4686 3    1.5662  9  71510 303 4 2 2       3 1 3        syn-C2H3C(O)NH2, v=0
   55988.5404  0.0019 -6.1521 3  459.9695 93  71510 303462917      472820        syn-C2H3C(O)NH2, v=0
   55988.5404  0.0019 -6.1521 3  459.9695 93  71510 303462918      472819        syn-C2H3C(O)NH2, v=0
   55992.2891  0.0014 -5.2896 3   66.6758 43  71510 30321 715      20 812        syn-C2H3C(O)NH2, v=0
   56014.7464  0.0004 -5.0661 3    4.1212 13  71510 303 6 2 5       5 1 4        syn-C2H3C(O)NH2, v=0
   56022.1750  0.0115 -7.2292 3  787.4059153  71510 303761561      771464        syn-C2H3C(O)NH2, v=0
   56058.3426  0.0038 -6.7786 3   48.2757 39  71510 30319 416      20 119        syn-C2H3C(O)NH2, v=0
   56132.5514  0.0115 -7.2275 3  787.4059153  71510 303761661      771364        syn-C2H3C(O)NH2, v=0
   56154.9550  0.0531 -7.7234 3 1368.5793165  71510 303824834      834737        syn-C2H3C(O)NH2, v=0
   56154.9550  0.0531 -7.7234 3 1368.5793165  71510 303824835      834736        syn-C2H3C(O)NH2, v=0
   56226.1451  0.0037 -6.3264 3  734.5602131  71510 303653035      643134        syn-C2H3C(O)NH2, v=0
   56226.1451  0.0037 -6.3264 3  734.5602131  71510 303653036      643133        syn-C2H3C(O)NH2, v=0
   56269.9791  0.0005 -6.8380 3    7.6449 17  71510 303 8 2 7       7 2 6        syn-C2H3C(O)NH2, v=0
   56311.6492  0.0261 -7.2992 3 1246.0505169  71510 303844044      834143        syn-C2H3C(O)NH2, v=0
   56311.6492  0.0261 -7.2992 3 1246.0505169  71510 303844045      834142        syn-C2H3C(O)NH2, v=0
   56398.2407  0.0019 -5.9265 3  153.8103 51  71510 3032518 7      261710        syn-C2H3C(O)NH2, v=0
   56398.2407  0.0019 -5.9265 3  153.8103 51  71510 3032518 8      2617 9        syn-C2H3C(O)NH2, v=0
   56488.8757  0.0028 -6.5791 3  369.1492105  71510 303521142      53 845        syn-C2H3C(O)NH2, v=0
   56587.5552  0.0007 -4.6917 3   23.1770 25  71510 30312 5 7      12 4 8        syn-C2H3C(O)NH2, v=0
   56597.7152  0.0038 -6.6627 3  121.6633 57  71510 303281019      29 722        syn-C2H3C(O)NH2, v=0
   56598.6569  0.0039 -6.4408 3  148.3426 67  71510 30333 727      34 430        syn-C2H3C(O)NH2, v=0
   56652.4713  0.0013 -5.6488 3  357.1886 93  71510 303462027      452124        syn-C2H3C(O)NH2, v=0
   56652.4723  0.0013 -5.6488 3  357.1886 93  71510 303462026      452125        syn-C2H3C(O)NH2, v=0
   56658.4978  0.0098 -6.7337 3  829.5079127  71510 303633825      643728        syn-C2H3C(O)NH2, v=0
   56658.4978  0.0098 -6.7337 3  829.5079127  71510 303633826      643727        syn-C2H3C(O)NH2, v=0
   56718.8157  0.0036 -7.1542 3   29.0856 31  71510 30315 213      16 116        syn-C2H3C(O)NH2, v=0
   56749.6211  0.0019 -6.0955 3  424.3407 89  71510 303442816      452719        syn-C2H3C(O)NH2, v=0
   56749.6211  0.0019 -6.0955 3  424.3407 89  71510 303442817      452718        syn-C2H3C(O)NH2, v=0
   56780.6159  0.0044 -6.5956 3   77.5535 49  71510 30324 420      25 323        syn-C2H3C(O)NH2, v=0
   56959.6481  0.0540 -7.5478 3 1081.9787179  71510 303891971      882068        syn-C2H3C(O)NH2, v=0
   56967.1335  0.0020 -4.5336 3   45.4621 37  71510 30318 414      18 315        syn-C2H3C(O)NH2, v=0
   56974.9295  0.0046 -5.7826 3  106.7200 57  71510 30328 623      27 720        syn-C2H3C(O)NH2, v=0
   57001.1564  0.0461 -7.5957 3 1306.6826161  71510 303804733      814636        syn-C2H3C(O)NH2, v=0
   57001.1564  0.0461 -7.5957 3 1306.6826161  71510 303804734      814635        syn-C2H3C(O)NH2, v=0
   57026.2800  0.0500 -6.3998 3  781.3188135 -71510 303673136      663235        syn-C2H3C(O)NH2, v=0
   57026.2800  0.0500 -6.3998 3  781.3188135 -71510 303673137      663234        syn-C2H3C(O)NH2, v=0
   57090.1841  0.0018 -5.9480 3  133.5829 47  71510 3032317 6      2416 9        syn-C2H3C(O)NH2, v=0
   57090.1841  0.0018 -5.9480 3  133.5829 47  71510 3032317 7      2416 8        syn-C2H3C(O)NH2, v=0
   57124.5011  0.0015 -5.2728 3   81.2061 47  71510 30323 816      22 913        syn-C2H3C(O)NH2, v=0
   57148.9684  0.0309 -7.4031 3 1306.6353173  71510 303864145      854244        syn-C2H3C(O)NH2, v=0
   57148.9684  0.0309 -7.4031 3 1306.6353173  71510 303864146      854243        syn-C2H3C(O)NH2, v=0
   57227.3771  0.0003 -5.0847 3    1.6788  7  71510 303 3 3 1       2 2 0        syn-C2H3C(O)NH2, v=0
   57264.8273  0.0017 -5.2822 3   28.2595 29  71510 30314 410      13 5 9        syn-C2H3C(O)NH2, v=0
   57273.2537  0.0031 -6.4191 3  470.8262117  71510 303581345      571642        syn-C2H3C(O)NH2, v=0
   57328.1083  0.0199 -7.3978 3  893.6293163  71510 303811665      821568        syn-C2H3C(O)NH2, v=0
   57342.8948  0.0005 -4.6036 3    8.0630 19  71510 303 9 0 9       8 1 8        syn-C2H3C(O)NH2, v=0
   57370.8162  0.0036 -6.4319 3  196.6190 77  71510 30338 731      39 634        syn-C2H3C(O)NH2, v=0
   57387.1500  0.0003 -5.0835 3    1.6738  7  71510 303 3 3 0       2 2 1        syn-C2H3C(O)NH2, v=0
   57398.9296  0.0199 -7.3967 3  893.6293163  71510 303811765      821468        syn-C2H3C(O)NH2, v=0
   57402.8794  0.0014 -5.6906 3  390.0374 97  71510 303482128      472225        syn-C2H3C(O)NH2, v=0
   57402.8797  0.0014 -5.6906 3  390.0374 97  71510 303482127      472226        syn-C2H3C(O)NH2, v=0
   57459.3700  0.1000 -6.6410 3  781.4227123 -71510 303613724      623627        syn-C2H3C(O)NH2, v=0
   57459.3700  0.1000 -6.6410 3  781.4227123 -71510 303613725      623626        syn-C2H3C(O)NH2, v=0
   57505.0110  0.0019 -6.0442 3  390.1538 85  71510 303422715      432618        syn-C2H3C(O)NH2, v=0
   57505.0110  0.0019 -6.0442 3  390.1538 85  71510 303422716      432617        syn-C2H3C(O)NH2, v=0
   57518.6202  0.0005 -6.7456 3    8.0630 19  71510 303 9 1 9       8 1 8        syn-C2H3C(O)NH2, v=0
   57676.6469  0.0005 -6.7430 3    8.0519 19  71510 303 9 0 9       8 0 8        syn-C2H3C(O)NH2, v=0
   57694.1914  0.0032 -6.6624 3  443.0961115  71510 303571146      581049        syn-C2H3C(O)NH2, v=0
   57716.8424  0.0058 -6.4894 3  508.6850123  71510 303611349      601446        syn-C2H3C(O)NH2, v=0
   57734.7969  0.0051 -5.8738 3  148.3047 67  71510 30333 727      32 824        syn-C2H3C(O)NH2, v=0
   57770.8520  0.0018 -5.9856 3  114.8027 43  71510 3032116 5      2215 8        syn-C2H3C(O)NH2, v=0
   57770.8520  0.0018 -5.9856 3  114.8027 43  71510 3032116 6      2215 7        syn-C2H3C(O)NH2, v=0
   57822.9224  0.0010 -4.8143 3   19.1641 25  71510 30312 310      12 211        syn-C2H3C(O)NH2, v=0
   57825.9038  0.0060 -6.6766 3  636.2359137  71510 303681454      671751        syn-C2H3C(O)NH2, v=0
   57827.7563  0.0030 -5.5651 3   66.2536 45  71510 30322 518      21 615        syn-C2H3C(O)NH2, v=0
   57829.6000  0.1000 -6.4766 3  829.5129139 -71510 303693237      683336        syn-C2H3C(O)NH2, v=0
   57829.6000  0.1000 -6.4766 3  829.5129139 -71510 303693238      683335        syn-C2H3C(O)NH2, v=0
   57840.0738  0.0015 -5.2695 3   97.1874 51  71510 30325 917      241014        syn-C2H3C(O)NH2, v=0
   57842.3415  0.0398 -7.4717 3 1246.2110157  71510 303784632      794535        syn-C2H3C(O)NH2, v=0
   57842.3415  0.0398 -7.4717 3 1246.2110157  71510 303784633      794534        syn-C2H3C(O)NH2, v=0
   57852.3723  0.0005 -4.5953 3    8.0519 19  71510 303 9 1 9       8 0 8        syn-C2H3C(O)NH2, v=0
   57970.2693  0.0046 -6.6570 3  576.4857129  71510 303641549      631846        syn-C2H3C(O)NH2, v=0
   57989.8267  0.0363 -7.5102 3 1368.6456177  71510 303884246      874345        syn-C2H3C(O)NH2, v=0
   57989.8267  0.0363 -7.5102 3 1368.6456177  71510 303884247      874344        syn-C2H3C(O)NH2, v=0
   58067.8976  0.0031 -6.6569 3  443.0960115  71510 303571246      58 949        syn-C2H3C(O)NH2, v=0
   58075.6690  0.0010 -5.0765 3   13.1196 21  71510 30310 2 8       9 3 7        syn-C2H3C(O)NH2, v=0
   58158.8901  0.0015 -5.7360 3  424.3293101  71510 303502229      492326        syn-C2H3C(O)NH2, v=0
   58158.8902  0.0015 -5.7360 3  424.3293101  71510 303502228      492327        syn-C2H3C(O)NH2, v=0
   58254.4600  0.0500 -5.9983 3  357.4095 81 -71510 303402614      412517        syn-C2H3C(O)NH2, v=0
   58254.4600  0.0500 -5.9983 3  357.4095 81 -71510 303402615      412516        syn-C2H3C(O)NH2, v=0
   58255.5823  0.0063 -6.5524 3  734.7726119  71510 303593623      603526        syn-C2H3C(O)NH2, v=0
   58255.5823  0.0063 -6.5524 3  734.7726119  71510 303593624      603525        syn-C2H3C(O)NH2, v=0
   58346.7144  0.0015 -4.7982 3   22.0797 27  71510 30313 211      13 112        syn-C2H3C(O)NH2, v=0
   58384.8062  0.0016 -5.2610 3   97.1867 51  71510 30325 916      241015        syn-C2H3C(O)NH2, v=0
   58418.2292  0.0015 -5.2737 3  114.6181 55  71510 303271018      261115        syn-C2H3C(O)NH2, v=0
   58438.7700  0.0800 -6.0441 3   97.4702 39 -71510 3031915 4      2014 7        syn-C2H3C(O)NH2, v=0
   58438.7700  0.0800 -6.0441 3   97.4702 39 -71510 3031915 5      2014 6        syn-C2H3C(O)NH2, v=0
   58454.7140  0.0005 -7.4245 3   18.3942 17  71510 303 8 7 2       7 7 1        syn-C2H3C(O)NH2, v=0
   58454.7158  0.0005 -7.4245 3   18.3942 17  71510 303 8 7 1       7 7 0        syn-C2H3C(O)NH2, v=0
   58468.2548  0.0008 -4.6696 3   24.1961 27  71510 30313 410      13 311        syn-C2H3C(O)NH2, v=0
   58505.0415  0.0035 -6.4154 3  196.6188 77  71510 30338 831      39 534        syn-C2H3C(O)NH2, v=0
   58554.4202  0.0005 -7.1456 3   15.3253 17  71510 303 8 6 3       7 6 2        syn-C2H3C(O)NH2, v=0
   58554.6106  0.0005 -7.1456 3   15.3253 17  71510 303 8 6 2       7 6 1        syn-C2H3C(O)NH2, v=0
   58555.6123  0.0325 -7.5841 3 1006.5312173  71510 303861769      871672        syn-C2H3C(O)NH2, v=0
   58576.3934  0.0016 -5.2498 3   81.2042 47  71510 30323 815      22 914        syn-C2H3C(O)NH2, v=0
   58600.9103  0.0325 -7.5835 3 1006.5312173  71510 303861869      871572        syn-C2H3C(O)NH2, v=0
   58613.6911  0.0015 -5.2707 3  114.6179 55  71510 303271017      261116        syn-C2H3C(O)NH2, v=0
   58636.4300  0.0800 -6.5568 3  879.1417143 -71510 303713338      703437        syn-C2H3C(O)NH2, v=0
   58636.4300  0.0800 -6.5568 3  879.1417143 -71510 303713339      703436        syn-C2H3C(O)NH2, v=0
   58638.4011  0.0005 -6.7895 3    7.3848 17  71510 303 8 1 7       7 1 6        syn-C2H3C(O)NH2, v=0
   58644.5992  0.0005 -6.8392 3    8.9682 17  71510 303 8 3 6       7 3 5        syn-C2H3C(O)NH2, v=0
   58671.3844  0.0034 -7.1275 3   29.0855 31  71510 30315 313      16 016        syn-C2H3C(O)NH2, v=0
   58678.5149  0.0342 -7.3515 3 1187.1654153  71510 303764531      774434        syn-C2H3C(O)NH2, v=0
   58678.5149  0.0342 -7.3515 3 1187.1654153  71510 303764532      774433        syn-C2H3C(O)NH2, v=0
   58719.3161  0.0005 -6.9939 3   12.7327 17  71510 303 8 5 4       7 5 3        syn-C2H3C(O)NH2, v=0
   58728.8890  0.0005 -6.9938 3   12.7328 17  71510 303 8 5 3       7 5 2        syn-C2H3C(O)NH2, v=0
   58734.5459  0.0041 -6.5677 3   77.5533 49  71510 30324 520      25 223        syn-C2H3C(O)NH2, v=0
   58834.2877  0.0423 -7.6206 3 1432.0802181  71510 303904347      894446        syn-C2H3C(O)NH2, v=0
   58834.2877  0.0423 -7.6206 3 1432.0802181  71510 303904348      894445        syn-C2H3C(O)NH2, v=0
   58910.8635  0.0020 -4.4258 3   62.5704 43  71510 30321 516      21 417        syn-C2H3C(O)NH2, v=0
   58920.0000  0.0500 -5.7849 3  460.0634105 -71510 303522329      512428        syn-C2H3C(O)NH2, v=0
   58920.0000  0.0500 -5.7849 3  460.0634105 -71510 303522330      512427        syn-C2H3C(O)NH2, v=0
   58941.1872  0.0005 -6.8963 3   10.6190 17  71510 303 8 4 5       7 4 4        syn-C2H3C(O)NH2, v=0
   58944.7313  0.0011 -4.4637 3   48.8429 37  71510 30318 612      18 513        syn-C2H3C(O)NH2, v=0
   58975.9145  0.0015 -5.2828 3  133.4977 59  71510 303291119      281216        syn-C2H3C(O)NH2, v=0
   58997.7000  0.0500 -5.9583 3  326.1083 77 -71510 303382513      392416        syn-C2H3C(O)NH2, v=0
   58997.7000  0.0500 -5.9583 3  326.1083 77 -71510 303382514      392415        syn-C2H3C(O)NH2, v=0
   59043.7485  0.0015 -5.2817 3  133.4976 59  71510 303291118      281217        syn-C2H3C(O)NH2, v=0
   59046.3200  0.1000 -6.4679 3  689.5584115 -71510 303573522      583425        syn-C2H3C(O)NH2, v=0
   59046.3200  0.1000 -6.4679 3  689.5584115 -71510 303573523      583424        syn-C2H3C(O)NH2, v=0
   59081.5716  0.0013 -5.0737 3   14.4265 23  71510 30311 110      11 011        syn-C2H3C(O)NH2, v=0
   59084.0275  0.0006 -4.7106 3   20.1128 23  71510 30311 5 6      11 4 7        syn-C2H3C(O)NH2, v=0
   59092.3300  0.0500 -6.1315 3   81.5855 35 -71510 3031714 3      1813 6        syn-C2H3C(O)NH2, v=0
   59092.3300  0.0500 -6.1315 3   81.5855 35 -71510 3031714 4      1813 5        syn-C2H3C(O)NH2, v=0
   59174.4485  0.0005 -6.8928 3   10.6231 17  71510 303 8 4 4       7 4 3        syn-C2H3C(O)NH2, v=0
   59180.6383  0.0032 -7.6668 3   88.8829 51  71510 30325 619      25 620        syn-C2H3C(O)NH2, v=0
   59240.7604  0.0006 -4.8002 3    9.5218 19  71510 303 9 1 8       8 2 7        syn-C2H3C(O)NH2, v=0
   59265.3095  0.0013 -5.3158 3   50.8090 39  71510 30319 515      18 612        syn-C2H3C(O)NH2, v=0
   59296.7632  0.0032 -7.8217 3  303.0426 93  71510 303461234      461235        syn-C2H3C(O)NH2, v=0
   59298.4746  0.0004 -4.3297 3   90.8570 51  71510 30325 718      25 619        syn-C2H3C(O)NH2, v=0
   59349.5876  0.0041 -6.4572 3  531.3360125  71510 303621349      611646        syn-C2H3C(O)NH2, v=0
   59355.8159  0.0036 -6.7588 3  523.7521125  71510 303621250      631153        syn-C2H3C(O)NH2, v=0
   59407.0249  0.0036 -6.5008 3  522.3245123  71510 303611447      601744        syn-C2H3C(O)NH2, v=0
   59446.5100  0.1000 -6.6404 3  930.2042147 -71510 303733439      723538        syn-C2H3C(O)NH2, v=0
   59446.5100  0.1000 -6.6404 3  930.2042147 -71510 303733440      723537        syn-C2H3C(O)NH2, v=0
   59509.6761  0.0292 -7.2349 3 1129.5471149  71510 303744430      754333        syn-C2H3C(O)NH2, v=0
   59509.6761  0.0292 -7.2349 3 1129.5471149  71510 303744431      754332        syn-C2H3C(O)NH2, v=0
   59553.2900  0.1000 -5.2959 3  153.8253 63 -71510 303311220      301317        syn-C2H3C(O)NH2, v=0
   59576.0800  0.0500 -5.2956 3  153.8253 63 -71510 303311219      301318        syn-C2H3C(O)NH2, v=0
   59579.1879  0.0031 -6.4329 3  251.6232 87  71510 30343 835      44 738        syn-C2H3C(O)NH2, v=0
   59599.7268  0.0036 -6.7553 3  523.7521125  71510 303621350      631053        syn-C2H3C(O)NH2, v=0
   59625.1147  0.0017 -5.2307 3   66.6703 43  71510 30321 714      20 813        syn-C2H3C(O)NH2, v=0
   59659.0455  0.0014 -5.1771 3   19.9832 25  71510 30312 3 9      11 4 8        syn-C2H3C(O)NH2, v=0
   59677.8919  0.0096 -6.8253 3  732.1262147  71510 303731558      721855        syn-C2H3C(O)NH2, v=0
   59682.4156  0.0492 -7.7343 3 1496.9378185  71510 303924448      914547        syn-C2H3C(O)NH2, v=0
   59682.4156  0.0492 -7.7343 3 1496.9378185  71510 303924449      914546        syn-C2H3C(O)NH2, v=0
   59685.9400  0.0500 -5.8374 3  497.2393109 -71510 303542430      532529        syn-C2H3C(O)NH2, v=0
   59685.9400  0.0500 -5.8374 3  497.2393109 -71510 303542431      532528        syn-C2H3C(O)NH2, v=0
   59705.7197  0.0503 -7.7878 3 1126.1039183  71510 303911873      921776        syn-C2H3C(O)NH2, v=0
   59722.9749  0.0043 -6.4656 3  113.5744 59  71510 30329 524      30 427        syn-C2H3C(O)NH2, v=0
   59729.1977  0.0016 -6.2626 3   67.1490 31  71510 3031513 2      1612 5        syn-C2H3C(O)NH2, v=0
   59729.1977  0.0016 -6.2626 3   67.1490 31  71510 3031513 3      1612 4        syn-C2H3C(O)NH2, v=0
   59734.3800  0.0500 -5.9245 3  296.2510 73 -71510 303362412      372315        syn-C2H3C(O)NH2, v=0
   59734.3800  0.0500 -5.9245 3  296.2510 73 -71510 303362413      372314        syn-C2H3C(O)NH2, v=0
   59734.6159  0.0503 -7.7874 3 1126.1039183  71510 303911973      921676        syn-C2H3C(O)NH2, v=0
   59771.8904  0.0678 -7.6877 3 1182.7114187  71510 303931974      922271        syn-C2H3C(O)NH2, v=0
   59832.4500  0.0500 -6.3877 3  645.7811111 -71510 303553421      563324        syn-C2H3C(O)NH2, v=0
   59832.4500  0.0500 -6.3877 3  645.7811111 -71510 303553422      563323        syn-C2H3C(O)NH2, v=0
   60086.7322  0.0005 -4.9244 3    5.6406 15  71510 303 7 2 6       6 1 5        syn-C2H3C(O)NH2, v=0
   60118.3256  0.0136 -7.3366 3  699.0489139  71510 303692149      701852        syn-C2H3C(O)NH2, v=0
   60148.1279  0.0588 -7.5746 3 1020.5505171  71510 303852164      842461        syn-C2H3C(O)NH2, v=0
   60158.9500  0.0500 -5.3127 3  175.6007 67 -71510 303331321      321418        syn-C2H3C(O)NH2, v=0
   60164.1362  0.0055 -6.9063 3  433.0015109  71510 303541738      551441        syn-C2H3C(O)NH2, v=0
   60166.5200  0.0500 -5.3126 3  175.6007 67 -71510 303331320      321419        syn-C2H3C(O)NH2, v=0
   60259.6700  0.0500 -6.7274 3  982.6993151 -71510 303753540      743639        syn-C2H3C(O)NH2, v=0
   60259.6700  0.0500 -6.7274 3  982.6993151 -71510 303753541      743638        syn-C2H3C(O)NH2, v=0
   60322.1355  0.0012 -5.0572 3   14.4281 23  71510 30311 210      11 111        syn-C2H3C(O)NH2, v=0
   60335.8198  0.0248 -7.1222 3 1073.3572145  71510 303724329      734232        syn-C2H3C(O)NH2, v=0
   60335.8198  0.0248 -7.1222 3 1073.3572145  71510 303724330      734231        syn-C2H3C(O)NH2, v=0
   60346.8442  0.0015 -6.4696 3   54.1606 27  71510 3031312 1      1411 4        syn-C2H3C(O)NH2, v=0
   60346.8442  0.0015 -6.4696 3   54.1606 27  71510 3031312 2      1411 3        syn-C2H3C(O)NH2, v=0
   60347.0731  0.0030 -6.4220 3  251.6231 87  71510 30343 935      44 638        syn-C2H3C(O)NH2, v=0
   60406.5678  0.0008 -4.3319 3   84.3183 49  71510 30324 717      24 618        syn-C2H3C(O)NH2, v=0
   60409.3239  0.0007 -4.3103 3   97.6203 53  71510 30326 719      26 620        syn-C2H3C(O)NH2, v=0
   60438.4046  0.0446 -7.4395 3 1060.0391177  71510 303881870      872167        syn-C2H3C(O)NH2, v=0
   60447.4862  0.0357 -7.2694 3  964.6694169  71510 303841867      831964        syn-C2H3C(O)NH2, v=0
   60456.2800  0.0500 -5.8934 3  535.8560113 -71510 303562531      552630        syn-C2H3C(O)NH2, v=0
   60456.2800  0.0500 -5.8934 3  535.8560113 -71510 303562532      552629        syn-C2H3C(O)NH2, v=0
   60464.1700  0.0500 -5.8975 3  267.8379 69 -71510 303342311      352214        syn-C2H3C(O)NH2, v=0
   60464.1700  0.0500 -5.8975 3  267.8379 69 -71510 303342312      352213        syn-C2H3C(O)NH2, v=0
   60534.2752  0.0568 -7.8513 3 1563.2173189  71510 303944549      934648        syn-C2H3C(O)NH2, v=0
   60534.2752  0.0568 -7.8513 3 1563.2173189  71510 303944550      934647        syn-C2H3C(O)NH2, v=0
   60573.7029  0.0041 -6.7488 3   52.8249 41  71510 30320 317      21 220        syn-C2H3C(O)NH2, v=0
   60577.0484  0.0166 -7.0051 3  834.7330157  71510 303781662      771959        syn-C2H3C(O)NH2, v=0
   60613.1732  0.0032 -6.3119 3  603.4415107  71510 303533320      543223        syn-C2H3C(O)NH2, v=0
   60613.1732  0.0032 -6.3119 3  603.4415107  71510 303533321      543222        syn-C2H3C(O)NH2, v=0
   60762.4198  0.0279 -7.2111 3  944.0419167  71510 303831766      822063        syn-C2H3C(O)NH2, v=0
   60774.6578  0.0036 -6.6781 3   90.8570 49  71510 30324 916      25 619        syn-C2H3C(O)NH2, v=0
   60791.7567  0.0013 -5.3332 3  198.8232 71  71510 303351422      341519        syn-C2H3C(O)NH2, v=0
   60794.2286  0.0013 -5.3332 3  198.8232 71  71510 303351421      341520        syn-C2H3C(O)NH2, v=0
   60807.1004  0.0023 -5.4223 3   60.8046 43  71510 30321 517      20 614        syn-C2H3C(O)NH2, v=0
   60838.4902  0.0049 -6.0906 3  301.7179 95  71510 303471038      461135        syn-C2H3C(O)NH2, v=0
   60876.6729  0.0006 -4.7451 3   17.3335 21  71510 30310 5 5      10 4 6        syn-C2H3C(O)NH2, v=0
   60899.9237  0.0006 -6.8052 3    9.0412 17  71510 303 8 3 5       7 3 4        syn-C2H3C(O)NH2, v=0
   60911.1663  0.0088 -6.7205 3  670.3013141  71510 303701556      691653        syn-C2H3C(O)NH2, v=0
   60919.3413  0.0045 -6.8756 3  611.1119135  71510 303671354      681257        syn-C2H3C(O)NH2, v=0
   60942.0081  0.0014 -6.8471 3   42.6206 23  71510 3031111 0      1210 3        syn-C2H3C(O)NH2, v=0
   60942.0081  0.0014 -6.8471 3   42.6206 23  71510 3031111 1      1210 2        syn-C2H3C(O)NH2, v=0
   60952.1441  0.0038 -6.6544 3  230.2171 79  71510 303391327      401030        syn-C2H3C(O)NH2, v=0
   61000.7720  0.0017 -4.3426 3   82.2835 49  71510 30324 618      24 519        syn-C2H3C(O)NH2, v=0
   61076.3600  0.0131 -6.8176 3 1036.6262155  71510 303773641      763740        syn-C2H3C(O)NH2, v=0
   61076.3600  0.0131 -6.8176 3 1036.6262155  71510 303773642      763739        syn-C2H3C(O)NH2, v=0
   61077.5785  0.0045 -6.8733 3  611.1119135  71510 303671454      681157        syn-C2H3C(O)NH2, v=0
   61131.8149  0.0041 -6.4461 3  113.5743 59  71510 30329 624      30 327        syn-C2H3C(O)NH2, v=0
   61156.9342  0.0209 -7.0133 3 1018.5967141  71510 303704228      714131        syn-C2H3C(O)NH2, v=0
   61156.9342  0.0209 -7.0133 3 1018.5967141  71510 303704229      714130        syn-C2H3C(O)NH2, v=0
   61186.4695  0.0019 -5.8778 3  240.8697 65  71510 303322210      332113        syn-C2H3C(O)NH2, v=0
   61186.4695  0.0019 -5.8778 3  240.8697 65  71510 303322211      332112        syn-C2H3C(O)NH2, v=0
   61216.7950  0.0012 -5.2086 3   58.3434 41  71510 30320 615      19 712        syn-C2H3C(O)NH2, v=0
   61221.2301  0.0017 -5.3389 3   55.6569 41  71510 30320 516      19 613        syn-C2H3C(O)NH2, v=0
   61230.9035  0.0021 -5.9528 3  575.9130117  71510 303582632      572731        syn-C2H3C(O)NH2, v=0
   61230.9035  0.0021 -5.9528 3  575.9130117  71510 303582633      572730        syn-C2H3C(O)NH2, v=0
   61388.5462  0.0026 -6.2407 3  562.5404103  71510 303513219      523122        syn-C2H3C(O)NH2, v=0
   61388.5462  0.0026 -6.2407 3  562.5404103  71510 303513220      523121        syn-C2H3C(O)NH2, v=0
   61411.1398  0.0020 -7.7687 3   34.7790 33  71510 30316 313      16 314        syn-C2H3C(O)NH2, v=0
   61447.6011  0.0012 -5.3573 3  223.4925 75  71510 303371523      361620        syn-C2H3C(O)NH2, v=0
   61448.3941  0.0012 -5.3573 3  223.4925 75  71510 303371522      361621        syn-C2H3C(O)NH2, v=0
   61615.8012  0.0028 -6.4632 3  313.3510 97  71510 30348 939      49 842        syn-C2H3C(O)NH2, v=0
   61686.9034  0.0033 -6.3532 3  485.5710119  71510 303591346      581643        syn-C2H3C(O)NH2, v=0
   61862.9396  0.0032 -7.6917 3  217.6307 79  71510 303391029      391030        syn-C2H3C(O)NH2, v=0
   61896.4424  0.0160 -6.9113 3 1091.9838159  71510 303793742      783841        syn-C2H3C(O)NH2, v=0
   61896.4424  0.0160 -6.9113 3 1091.9838159  71510 303793743      783840        syn-C2H3C(O)NH2, v=0
   61900.8292  0.0019 -5.8665 3  215.3469 61  71510 3033021 9      312012        syn-C2H3C(O)NH2, v=0
   61900.8292  0.0019 -5.8665 3  215.3469 61  71510 303302110      312011        syn-C2H3C(O)NH2, v=0
   61920.3022  0.0029 -7.6560 3   68.1826 45  71510 30322 517      22 518        syn-C2H3C(O)NH2, v=0
   61973.0012  0.0175 -6.9082 3  965.2667137  71510 303684127      694030        syn-C2H3C(O)NH2, v=0
   61973.0012  0.0175 -6.9082 3  965.2667137  71510 303684128      694029        syn-C2H3C(O)NH2, v=0
   62009.5661  0.0024 -6.0157 3  617.4095121  71510 303602733      592832        syn-C2H3C(O)NH2, v=0
   62009.5661  0.0024 -6.0157 3  617.4095121  71510 303602734      592831        syn-C2H3C(O)NH2, v=0
   62015.9353  0.0034 -7.6348 3  146.2361 65  71510 30332 824      32 825        syn-C2H3C(O)NH2, v=0
   62061.9974  0.0006 -4.7974 3   14.8312 19  71510 303 9 5 4       9 4 5        syn-C2H3C(O)NH2, v=0
   62108.6521  0.0009 -4.6079 3   27.5139 29  71510 30314 411      14 312        syn-C2H3C(O)NH2, v=0
   62122.4343  0.0012 -5.3849 3  249.6079 79  71510 303391624      381721        syn-C2H3C(O)NH2, v=0
   62122.6857  0.0012 -5.3849 3  249.6079 79  71510 303391623      381722        syn-C2H3C(O)NH2, v=0
   62128.8315  0.0027 -6.4561 3  313.3509 97  71510 303481039      49 742        syn-C2H3C(O)NH2, v=0
   62129.1414  0.0040 -6.7281 3   52.8248 41  71510 30320 417      21 120        syn-C2H3C(O)NH2, v=0
   62152.9015  0.0019 -5.1932 3   53.5837 39  71510 30319 613      18 712        syn-C2H3C(O)NH2, v=0
   62158.4768  0.0023 -6.1740 3  523.0785 99  71510 303493118      503021        syn-C2H3C(O)NH2, v=0
   62158.4768  0.0023 -6.1740 3  523.0785 99  71510 303493119      503020        syn-C2H3C(O)NH2, v=0
   62213.5923  0.0689 -7.8483 3 1475.4289171  71510 303855035      864938        syn-C2H3C(O)NH2, v=0
   62213.5923  0.0689 -7.8483 3 1475.4289171  71510 303855036      864937        syn-C2H3C(O)NH2, v=0
   62301.1878  0.0039 -6.3822 3  515.8330123  71510 303611348      601645        syn-C2H3C(O)NH2, v=0
   62347.1810  0.0005 -6.7448 3    8.0837 17  71510 303 8 2 6       7 2 5        syn-C2H3C(O)NH2, v=0
   62364.2953  0.0040 -6.3940 3  156.3329 69  71510 30334 628      35 531        syn-C2H3C(O)NH2, v=0
   62394.0134  0.0072 -7.0118 3  705.1696145  71510 303721458      731361        syn-C2H3C(O)NH2, v=0
   62496.1572  0.0072 -7.0103 3  705.1696145  71510 303721558      731261        syn-C2H3C(O)NH2, v=0
   62555.6745  0.0019 -4.5815 3   34.7408 33  71510 30316 313      16 214        syn-C2H3C(O)NH2, v=0
   62606.5675  0.0019 -5.8646 3  191.2698 57  71510 3032820 8      291911        syn-C2H3C(O)NH2, v=0
   62606.5675  0.0019 -5.8646 3  191.2698 57  71510 3032820 9      291910        syn-C2H3C(O)NH2, v=0
   62642.6545  0.0005 -4.6693 3   19.9832 23  71510 30311 5 7      11 4 8        syn-C2H3C(O)NH2, v=0
   62710.1726  0.0005 -4.7236 3   17.2682 21  71510 30310 5 6      10 4 7        syn-C2H3C(O)NH2, v=0
   62719.9678  0.0193 -7.0082 3 1148.7709163  71510 303813843      803942        syn-C2H3C(O)NH2, v=0
   62719.9678  0.0193 -7.0082 3 1148.7709163  71510 303813844      803941        syn-C2H3C(O)NH2, v=0
   62721.4563  0.0025 -7.6858 3   50.1456 39  71510 30319 415      19 416        syn-C2H3C(O)NH2, v=0
   62781.4095  0.0005 -6.6907 3    9.5218 19  71510 303 9 2 8       8 2 7        syn-C2H3C(O)NH2, v=0
   62783.9949  0.0145 -6.8070 3  913.3683133  71510 303664026      673929        syn-C2H3C(O)NH2, v=0
   62783.9949  0.0145 -6.8070 3  913.3683133  71510 303664027      673928        syn-C2H3C(O)NH2, v=0
   62792.1468  0.0027 -6.0821 3  660.3446125  71510 303622834      612933        syn-C2H3C(O)NH2, v=0
   62792.1468  0.0027 -6.0821 3  660.3446125  71510 303622835      612932        syn-C2H3C(O)NH2, v=0
   62802.1559  0.0005 -4.8705 3   12.5969 17  71510 303 8 5 3       8 4 4        syn-C2H3C(O)NH2, v=0
   62812.9351  0.0012 -5.4161 3  277.1691 83  71510 303411725      401822        syn-C2H3C(O)NH2, v=0
   62813.0140  0.0012 -5.4161 3  277.1691 83  71510 303411724      401823        syn-C2H3C(O)NH2, v=0
   62815.0221  0.0005 -4.6209 3   22.9439 25  71510 30312 5 8      12 4 9        syn-C2H3C(O)NH2, v=0
   62849.7139  0.0096 -6.8624 3  710.5804143  71510 303711754      702051        syn-C2H3C(O)NH2, v=0
   62906.3337  0.0005 -4.7874 3   14.8016 19  71510 303 9 5 5       9 4 6        syn-C2H3C(O)NH2, v=0
   62922.8134  0.0021 -6.1121 3  485.0567 95  71510 303473017      482920        syn-C2H3C(O)NH2, v=0
   62922.8134  0.0021 -6.1121 3  485.0567 95  71510 303473018      482919        syn-C2H3C(O)NH2, v=0
   63014.0310  0.0011 -4.4502 3   44.1523 35  71510 30317 611      17 512        syn-C2H3C(O)NH2, v=0
   63043.3522  0.0012 -4.7400 3   22.0932 27  71510 30313 311      13 212        syn-C2H3C(O)NH2, v=0
   63066.5292  0.0604 -7.7166 3 1411.1695167  71510 303834934      844837        syn-C2H3C(O)NH2, v=0
   63066.5292  0.0604 -7.7166 3 1411.1695167  71510 303834935      844836        syn-C2H3C(O)NH2, v=0
   63144.1365  0.0005 -4.8664 3   12.5851 17  71510 303 8 5 4       8 4 5        syn-C2H3C(O)NH2, v=0
   63219.7951  0.0036 -6.3450 3  500.5754121  71510 303601347      591644        syn-C2H3C(O)NH2, v=0
   63247.7154  0.0005 -4.9717 3   10.6231 15  71510 303 7 5 2       7 4 3        syn-C2H3C(O)NH2, v=0
   63302.9074  0.0019 -5.8736 3  168.6390 53  71510 3032619 7      271810        syn-C2H3C(O)NH2, v=0
   63302.9074  0.0019 -5.8736 3  168.6390 53  71510 3032619 8      2718 9        syn-C2H3C(O)NH2, v=0
   63328.6921  0.0011 -4.3205 3   78.0253 47  71510 30323 716      23 617        syn-C2H3C(O)NH2, v=0
   63350.6637  0.0039 -6.3808 3  156.3328 69  71510 30334 728      35 431        syn-C2H3C(O)NH2, v=0
   63351.3003  0.0005 -4.5759 3   26.1464 27  71510 30313 5 9      13 410        syn-C2H3C(O)NH2, v=0
   63366.0075  0.0005 -4.9703 3   10.6190 15  71510 303 7 5 3       7 4 4        syn-C2H3C(O)NH2, v=0
   63473.7952  0.0037 -7.0979 3   32.6236 33  71510 30316 214      17 117        syn-C2H3C(O)NH2, v=0
   63509.2379  0.0006 -5.1214 3    8.9040 13  71510 303 6 5 1       6 4 2        syn-C2H3C(O)NH2, v=0
   63510.5301  0.0029 -6.5192 3  381.7977107  71510 303531043      54 946        syn-C2H3C(O)NH2, v=0
   63516.5070  0.0012 -5.4509 3  306.1755 87  71510 303431826      421923        syn-C2H3C(O)NH2, v=0
   63516.5315  0.0012 -5.4509 3  306.1755 87  71510 303431825      421924        syn-C2H3C(O)NH2, v=0
   63520.8253  0.0006 -4.4643 3    9.9816 21  71510 30310 010       9 1 9        syn-C2H3C(O)NH2, v=0
   63542.3577  0.0006 -5.1210 3    8.9029 13  71510 303 6 5 2       6 4 3        syn-C2H3C(O)NH2, v=0
   63546.9817  0.0231 -7.1084 3 1206.9867167  71510 303833944      824043        syn-C2H3C(O)NH2, v=0
   63546.9817  0.0231 -7.1084 3 1206.9867167  71510 303833945      824042        syn-C2H3C(O)NH2, v=0
   63578.5386  0.0032 -6.1518 3  704.7176129  71510 303642935      633034        syn-C2H3C(O)NH2, v=0
   63578.5386  0.0032 -6.1518 3  704.7176129  71510 303642936      633033        syn-C2H3C(O)NH2, v=0
   63589.8811  0.0120 -6.7098 3  862.9024129  71510 303643925      653828        syn-C2H3C(O)NH2, v=0
   63589.8811  0.0120 -6.7098 3  862.9024129  71510 303643926      653827        syn-C2H3C(O)NH2, v=0
   63611.3681  0.0006 -6.6157 3    9.9816 21  71510 30310 110       9 1 9        syn-C2H3C(O)NH2, v=0
   63658.5866  0.0006 -5.3902 3    7.4358 11  71510 303 5 5 0       5 4 1        syn-C2H3C(O)NH2, v=0
   63665.3331  0.0006 -5.3901 3    7.4355 11  71510 303 5 5 1       5 4 2        syn-C2H3C(O)NH2, v=0
   63681.3779  0.0020 -6.0553 3  448.4755 91  71510 303452916      462819        syn-C2H3C(O)NH2, v=0
   63681.3779  0.0020 -6.0553 3  448.4755 91  71510 303452917      462818        syn-C2H3C(O)NH2, v=0
   63686.4136  0.0245 -7.1688 3  858.6098157  71510 303781959      772256        syn-C2H3C(O)NH2, v=0
   63696.5507  0.0006 -6.6144 3    9.9758 21  71510 30310 010       9 0 9        syn-C2H3C(O)NH2, v=0
   63785.6102  0.0127 -7.1666 3  805.9187155  71510 303771562      781465        syn-C2H3C(O)NH2, v=0
   63787.0935  0.0006 -4.4604 3    9.9758 21  71510 30310 110       9 0 9        syn-C2H3C(O)NH2, v=0
   63849.7302  0.0028 -6.5146 3  381.7976107  71510 303531143      54 846        syn-C2H3C(O)NH2, v=0
   63851.2703  0.0127 -7.1657 3  805.9186155  71510 303771662      781365        syn-C2H3C(O)NH2, v=0
   63911.3903  0.0044 -6.5312 3   83.3162 51  71510 30325 421      26 324        syn-C2H3C(O)NH2, v=0
   63914.2740  0.0527 -7.5884 3 1348.3331163  71510 303814833      824736        syn-C2H3C(O)NH2, v=0
   63914.2740  0.0527 -7.5884 3 1348.3331163  71510 303814834      824735        syn-C2H3C(O)NH2, v=0
   63915.7265  0.0013 -4.2733 3  104.5880 55  71510 30327 720      27 621        syn-C2H3C(O)NH2, v=0
   63917.3201  0.0055 -6.5448 3  619.2370135  71510 303671453      661750        syn-C2H3C(O)NH2, v=0
   63988.9240  0.0019 -5.8956 3  147.4547 49  71510 3032418 6      2517 9        syn-C2H3C(O)NH2, v=0
   63988.9240  0.0019 -5.8956 3  147.4547 49  71510 3032418 7      2517 8        syn-C2H3C(O)NH2, v=0
   64000.3252  0.0032 -6.7521 3   64.5355 41  71510 30320 813      21 516        syn-C2H3C(O)NH2, v=0
   64066.1664  0.0005 -4.7852 3    7.3848 17  71510 303 8 2 7       7 1 6        syn-C2H3C(O)NH2, v=0
   64163.1632  0.0003 -4.9843 3    2.4235  9  71510 303 4 3 2       3 2 1        syn-C2H3C(O)NH2, v=0
   64231.1496  0.0012 -5.4891 3  336.6265 91  71510 303451927      442024        syn-C2H3C(O)NH2, v=0
   64231.1571  0.0012 -5.4891 3  336.6265 91  71510 303451926      442025        syn-C2H3C(O)NH2, v=0
   64266.2698  0.0056 -6.2476 3  428.9753113  71510 303561245      551342        syn-C2H3C(O)NH2, v=0
   64312.2311  0.0014 -5.1488 3   71.9015 45  71510 30322 716      21 813        syn-C2H3C(O)NH2, v=0
   64368.6613  0.0039 -6.2249 3  750.5277133  71510 303663036      653135        syn-C2H3C(O)NH2, v=0
   64368.6613  0.0039 -6.2249 3  750.5277133  71510 303663037      653134        syn-C2H3C(O)NH2, v=0
   64373.0217  0.0006 -4.5322 3   29.5856 29  71510 30314 510      14 411        syn-C2H3C(O)NH2, v=0
   64377.5328  0.0274 -7.2119 3 1266.6299171  71510 303854045      844144        syn-C2H3C(O)NH2, v=0
   64377.5328  0.0274 -7.2119 3 1266.6299171  71510 303854046      844143        syn-C2H3C(O)NH2, v=0
   64390.6162  0.0097 -6.6166 3  813.8699125  71510 303623824      633727        syn-C2H3C(O)NH2, v=0
   64390.6162  0.0097 -6.6166 3  813.8699125  71510 303623825      633726        syn-C2H3C(O)NH2, v=0
   64433.9609  0.0020 -6.0037 3  413.3358 87  71510 303432815      442718        syn-C2H3C(O)NH2, v=0
   64433.9609  0.0020 -6.0037 3  413.3358 87  71510 303432816      442717        syn-C2H3C(O)NH2, v=0
   64618.9491  0.0036 -7.0836 3   32.6235 33  71510 30316 314      17 017        syn-C2H3C(O)NH2, v=0
   64663.5123  0.0019 -5.9340 3  127.7175 45  71510 3032217 5      2316 8        syn-C2H3C(O)NH2, v=0
   64663.5123  0.0019 -5.9340 3  127.7175 45  71510 3032217 6      2316 7        syn-C2H3C(O)NH2, v=0
   64668.5258  0.0005 -6.6583 3    9.3408 19  71510 303 9 1 8       8 1 7        syn-C2H3C(O)NH2, v=0
   64756.8311  0.0457 -7.4640 3 1286.9207159  71510 303794732      804635        syn-C2H3C(O)NH2, v=0
   64756.8311  0.0457 -7.4640 3 1286.9207159  71510 303794733      804634        syn-C2H3C(O)NH2, v=0
   64764.4352  0.0034 -6.3653 3  205.8239 79  71510 30339 732      40 635        syn-C2H3C(O)NH2, v=0
   64770.6257  0.0225 -6.9967 3  854.0034159  71510 303791763      781860        syn-C2H3C(O)NH2, v=0
   64797.0442  0.0006 -7.6241 3    1.4267  7  71510 303 3 3 0       3 0 3        syn-C2H3C(O)NH2, v=0
   64955.3201  0.0013 -5.5309 3  368.5215 95  71510 303472028      462125        syn-C2H3C(O)NH2, v=0
   64955.3224  0.0013 -5.5309 3  368.5215 95  71510 303472027      462126        syn-C2H3C(O)NH2, v=0
   64969.9269  0.0004 -4.9800 3    2.3993  9  71510 303 4 3 1       3 2 2        syn-C2H3C(O)NH2, v=0
   65073.5553  0.0042 -6.5163 3   83.3162 51  71510 30325 521      26 224        syn-C2H3C(O)NH2, v=0
   65097.4142  0.0217 -7.3394 3  913.3524165  71510 303821666      831569        syn-C2H3C(O)NH2, v=0
   65139.4746  0.0217 -7.3389 3  913.3524165  71510 303821766      831469        syn-C2H3C(O)NH2, v=0
   65162.4565  0.0048 -6.3014 3  797.7739137  71510 303683137      673236        syn-C2H3C(O)NH2, v=0
   65162.4565  0.0048 -6.3014 3  797.7739137  71510 303683138      673235        syn-C2H3C(O)NH2, v=0
   65180.3175  0.0020 -5.9575 3  379.6382 83  71510 303412714      422617        syn-C2H3C(O)NH2, v=0
   65180.3175  0.0020 -5.9575 3  379.6382 83  71510 303412715      422616        syn-C2H3C(O)NH2, v=0
   65186.1457  0.0079 -6.5275 3  766.2719121  71510 303603723      613626        syn-C2H3C(O)NH2, v=0
   65186.1457  0.0079 -6.5275 3  766.2719121  71510 303603724      613625        syn-C2H3C(O)NH2, v=0
   65211.6724  0.0323 -7.3187 3 1327.6993175  71510 303874146      864245        syn-C2H3C(O)NH2, v=0
   65211.6724  0.0323 -7.3187 3 1327.6993175  71510 303874147      864244        syn-C2H3C(O)NH2, v=0
   65285.2735  0.0032 -6.5984 3  456.9584117  71510 303581147      591050        syn-C2H3C(O)NH2, v=0
   65313.2991  0.0022 -4.4397 3   50.0592 39  71510 30319 415      19 316        syn-C2H3C(O)NH2, v=0
   65325.3486  0.0018 -5.9935 3  109.4275 41  71510 3032016 4      2115 7        syn-C2H3C(O)NH2, v=0
   65325.3486  0.0018 -5.9935 3  109.4275 41  71510 3032016 5      2115 6        syn-C2H3C(O)NH2, v=0
   65440.4921  0.0034 -6.3565 3  205.8238 79  71510 30339 832      40 535        syn-C2H3C(O)NH2, v=0
   65507.6680  0.0032 -6.5954 3  456.9584117  71510 303581247      59 950        syn-C2H3C(O)NH2, v=0
   65516.2470  0.0013 -4.9888 3   16.9543 25  71510 30312 111      12 012        syn-C2H3C(O)NH2, v=0
   65588.7059  0.0016 -4.7051 3   25.2187 29  71510 30314 212      14 113        syn-C2H3C(O)NH2, v=0
   65594.2008  0.0395 -7.3432 3 1226.9337155  71510 303774631      784534        syn-C2H3C(O)NH2, v=0
   65594.2008  0.0395 -7.3432 3 1226.9337155  71510 303774632      784533        syn-C2H3C(O)NH2, v=0
   65687.8203  0.0014 -5.5762 3  401.8600 99  71510 303492129      482226        syn-C2H3C(O)NH2, v=0
   65687.8210  0.0014 -5.5762 3  401.8600 99  71510 303492128      482227        syn-C2H3C(O)NH2, v=0
   65749.2397  0.0005 -7.3309 3   23.8854 19  71510 303 9 8 2       8 8 1        syn-C2H3C(O)NH2, v=0
   65749.2398  0.0005 -7.3309 3   23.8854 19  71510 303 9 8 1       8 8 0        syn-C2H3C(O)NH2, v=0
   65811.8546  0.0005 -6.6782 3   10.9244 19  71510 303 9 3 7       8 3 6        syn-C2H3C(O)NH2, v=0
   65840.5900  0.0005 -7.0476 3   20.3440 19  71510 303 9 7 3       8 7 2        syn-C2H3C(O)NH2, v=0
   65840.6036  0.0005 -7.0476 3   20.3440 19  71510 303 9 7 2       8 7 1        syn-C2H3C(O)NH2, v=0
   65865.8139  0.0763 -7.6023 3 1182.5110187  71510 303932074      922171        syn-C2H3C(O)NH2, v=0
   65868.5821  0.0015 -5.1281 3   86.9180 49  71510 30324 817      23 914        syn-C2H3C(O)NH2, v=0
   65868.8719  0.0040 -5.5445 3   99.6353 55  71510 30327 622      26 719        syn-C2H3C(O)NH2, v=0
   65920.1611  0.0020 -5.9173 3  347.3833 79  71510 303392613      402516        syn-C2H3C(O)NH2, v=0
   65920.1611  0.0020 -5.9173 3  347.3833 79  71510 303392614      402515        syn-C2H3C(O)NH2, v=0
   65933.0235  0.0016 -7.6493 3   12.4921 17  71510 303 8 5 4       9 2 7        syn-C2H3C(O)NH2, v=0
   65959.8845  0.0060 -6.3813 3  846.4554141  71510 303703238      693337        syn-C2H3C(O)NH2, v=0
   65959.8845  0.0060 -6.3813 3  846.4554141  71510 303703239      693336        syn-C2H3C(O)NH2, v=0
   65972.8419  0.0018 -6.0824 3   92.5852 37  71510 3031815 3      1914 6        syn-C2H3C(O)NH2, v=0
   65972.8419  0.0018 -6.0824 3   92.5852 37  71510 3031815 4      1914 5        syn-C2H3C(O)NH2, v=0
   65976.4031  0.0063 -6.4426 3  720.1092117  71510 303583622      593525        syn-C2H3C(O)NH2, v=0
   65976.4031  0.0063 -6.4426 3  720.1092117  71510 303583623      593524        syn-C2H3C(O)NH2, v=0
   65982.5686  0.0005 -6.8913 3   17.2784 19  71510 303 9 6 4       8 6 3        syn-C2H3C(O)NH2, v=0
   65983.4488  0.0005 -6.8913 3   17.2784 19  71510 303 9 6 3       8 6 2        syn-C2H3C(O)NH2, v=0
   65983.5506  0.0006 -4.4884 3   33.2563 31  71510 30315 511      15 412        syn-C2H3C(O)NH2, v=0
   66049.4538  0.0379 -7.4288 3 1390.1939179  71510 303894247      884346        syn-C2H3C(O)NH2, v=0
   66049.4538  0.0379 -7.4288 3 1390.1939179  71510 303894248      884345        syn-C2H3C(O)NH2, v=0
   66096.1106  0.0050 -5.8956 3  240.9746 85  71510 30342 934      411031        syn-C2H3C(O)NH2, v=0
   66107.5953  0.0027 -6.9024 3   42.7001 33  71510 30316 710      17 413        syn-C2H3C(O)NH2, v=0
   66211.6456  0.0005 -6.7880 3   14.6914 19  71510 303 9 5 5       8 5 4        syn-C2H3C(O)NH2, v=0
   66225.0949  0.0013 -4.9802 3   16.9551 25  71510 30312 211      12 112        syn-C2H3C(O)NH2, v=0
   66242.1688  0.0005 -6.7876 3   14.6918 19  71510 303 9 5 4       8 5 3        syn-C2H3C(O)NH2, v=0
   66301.3999  0.0020 -5.1259 3   41.9407 35  71510 30317 512      16 611        syn-C2H3C(O)NH2, v=0
   66328.0587  0.0040 -6.5892 3  187.0210 71  71510 303351224      36 927        syn-C2H3C(O)NH2, v=0
   66330.9337  0.0351 -7.5298 3 1027.4635175  71510 303871770      881673        syn-C2H3C(O)NH2, v=0
   66357.7977  0.0351 -7.5295 3 1027.4635175  71510 303871870      881573        syn-C2H3C(O)NH2, v=0
   66367.0919  0.0011 -4.5470 3   31.0426 31  71510 30315 412      15 313        syn-C2H3C(O)NH2, v=0
   66426.3786  0.0340 -7.2261 3 1168.3730151  71510 303754530      764433        syn-C2H3C(O)NH2, v=0
   66426.3786  0.0340 -7.2261 3 1168.3730151  71510 303754531      764432        syn-C2H3C(O)NH2, v=0
   66427.7115  0.0015 -5.6250 3  436.6413103  71510 303512230      502327        syn-C2H3C(O)NH2, v=0
   66427.7117  0.0015 -5.6250 3  436.6413103  71510 303512229      502328        syn-C2H3C(O)NH2, v=0
   66449.4484  0.0005 -6.7161 3   12.5851 19  71510 303 9 4 6       8 4 5        syn-C2H3C(O)NH2, v=0
   66490.9800  0.0006 -6.9617 3    2.3485  9  71510 303 4 3 1       4 0 4        syn-C2H3C(O)NH2, v=0
   66604.0760  0.0017 -6.2154 3   77.1906 33  71510 3031614 2      1713 5        syn-C2H3C(O)NH2, v=0
   66604.0760  0.0017 -6.2154 3   77.1906 33  71510 3031614 3      1713 4        syn-C2H3C(O)NH2, v=0
   66653.1566  0.0020 -5.8832 3  316.5716 75  71510 303372512      382415        syn-C2H3C(O)NH2, v=0
   66653.1566  0.0020 -5.8832 3  316.5716 75  71510 303372513      382414        syn-C2H3C(O)NH2, v=0
   66704.7645  0.0015 -5.1261 3  103.3874 53  71510 30326 918      251015        syn-C2H3C(O)NH2, v=0
   66760.9204  0.0075 -6.4645 3  896.5712145  71510 303723339      713438        syn-C2H3C(O)NH2, v=0
   66760.9204  0.0075 -6.4645 3  896.5712145  71510 303723340      713437        syn-C2H3C(O)NH2, v=0
   66761.3083  0.0050 -6.3619 3  675.3828113  71510 303563521      573424        syn-C2H3C(O)NH2, v=0
   66761.3083  0.0050 -6.3619 3  675.3828113  71510 303563522      573423        syn-C2H3C(O)NH2, v=0
   66842.4722  0.0048 -6.7585 3  372.9666101  71510 303501635      511338        syn-C2H3C(O)NH2, v=0
   66856.3944  0.0010 -4.4408 3   39.7531 33  71510 30316 610      16 511        syn-C2H3C(O)NH2, v=0
   66864.3106  0.0042 -6.4051 3  120.5514 61  71510 30330 525      31 428        syn-C2H3C(O)NH2, v=0
   66864.7191  0.0022 -7.1676 3   25.3520 25  71510 30312 6 7      13 310        syn-C2H3C(O)NH2, v=0
   66890.9323  0.0442 -7.5420 3 1454.1124183  71510 303914348      904447        syn-C2H3C(O)NH2, v=0
   66890.9323  0.0442 -7.5420 3 1454.1124183  71510 303914349      904446        syn-C2H3C(O)NH2, v=0
   66941.7494  0.0005 -4.2250 3  121.6633 59  71510 30329 821      29 722        syn-C2H3C(O)NH2, v=0
   66955.4863  0.0037 -6.6990 3  538.8278127  71510 303631251      641154        syn-C2H3C(O)NH2, v=0
   66959.9833  0.0087 -6.6761 3  713.8788145  71510 303721557      711854        syn-C2H3C(O)NH2, v=0
   66970.0262  0.0029 -6.3708 3  262.0429 89  71510 30344 836      45 739        syn-C2H3C(O)NH2, v=0
   66982.3273  0.0006 -6.7091 3   12.5969 19  71510 303 9 4 5       8 4 4        syn-C2H3C(O)NH2, v=0
   66986.8153  0.0006 -4.6032 3   11.6160 21  71510 30310 1 9       9 2 8        syn-C2H3C(O)NH2, v=0
   67026.9436  0.0023 -4.3425 3   68.0122 45  71510 30322 517      22 418        syn-C2H3C(O)NH2, v=0
   67034.0357  0.0067 -6.4644 3  578.4194131  71510 303651452      641549        syn-C2H3C(O)NH2, v=0
   67100.3029  0.0037 -6.6972 3  538.8278127  71510 303631351      641054        syn-C2H3C(O)NH2, v=0
   67131.1015  0.0037 -6.3803 3  537.8347125  71510 303621448      611745        syn-C2H3C(O)NH2, v=0
   67174.2529  0.0017 -5.6773 3  472.8647107  71510 303532330      522429        syn-C2H3C(O)NH2, v=0
   67174.2529  0.0017 -5.6773 3  472.8647107  71510 303532331      522428        syn-C2H3C(O)NH2, v=0
   67216.7413  0.0016 -6.4250 3   63.2439 29  71510 3031413 1      1512 4        syn-C2H3C(O)NH2, v=0
   67216.7413  0.0016 -6.4250 3   63.2439 29  71510 3031413 2      1512 3        syn-C2H3C(O)NH2, v=0
   67253.3544  0.0290 -7.1128 3 1111.2400147  71510 303734429      744332        syn-C2H3C(O)NH2, v=0
   67253.3544  0.0290 -7.1128 3 1111.2400147  71510 303734430      744331        syn-C2H3C(O)NH2, v=0
   67266.6524  0.0015 -5.1336 3  121.3074 57  71510 303281019      271116        syn-C2H3C(O)NH2, v=0
   67331.0228  0.0034 -7.5688 3  119.4174 59  71510 30329 722      29 723        syn-C2H3C(O)NH2, v=0
   67378.9123  0.0020 -5.8560 3  287.2039 71  71510 303352411      362314        syn-C2H3C(O)NH2, v=0
   67378.9123  0.0020 -5.8560 3  287.2039 71  71510 303352412      362313        syn-C2H3C(O)NH2, v=0
   67397.6464  0.0042 -6.6946 3   57.5759 43  71510 30321 318      22 221        syn-C2H3C(O)NH2, v=0
   67426.0424  0.0029 -6.3650 3  262.0428 89  71510 30344 936      45 639        syn-C2H3C(O)NH2, v=0
   67465.5583  0.0013 -4.3007 3   71.9980 45  71510 30322 715      22 616        syn-C2H3C(O)NH2, v=0
   67486.4214  0.0539 -7.7374 3 1148.2443185  71510 303921874      931777        syn-C2H3C(O)NH2, v=0
   67503.5373  0.0539 -7.7372 3 1148.2443185  71510 303921974      931677        syn-C2H3C(O)NH2, v=0
   67540.7658  0.0040 -6.2856 3  632.0934109  71510 303543420      553323        syn-C2H3C(O)NH2, v=0
   67540.7658  0.0040 -6.2856 3  632.0934109  71510 303543421      553322        syn-C2H3C(O)NH2, v=0
   67565.5527  0.0093 -6.5510 3  948.1204149  71510 303743440      733539        syn-C2H3C(O)NH2, v=0
   67565.5527  0.0093 -6.5510 3  948.1204149  71510 303743441      733538        syn-C2H3C(O)NH2, v=0
   67648.4130  0.0091 -7.1268 3  622.2220131  71510 303652046      661749        syn-C2H3C(O)NH2, v=0
   67659.2053  0.0015 -5.1284 3  121.3069 57  71510 303281018      271117        syn-C2H3C(O)NH2, v=0
   67696.0214  0.0012 -5.1198 3   63.3606 43  71510 30321 616      20 713        syn-C2H3C(O)NH2, v=0
   67698.0663  0.0041 -6.3947 3  120.5513 61  71510 30330 625      31 328        syn-C2H3C(O)NH2, v=0
   67736.1647  0.0512 -7.6585 3 1519.4536187  71510 303934449      924548        syn-C2H3C(O)NH2, v=0
   67736.1647  0.0512 -7.6585 3 1519.4536187  71510 303934450      924547        syn-C2H3C(O)NH2, v=0
   67759.9908  0.0015 -5.1468 3  140.6766 61  71510 303301120      291217        syn-C2H3C(O)NH2, v=0
   67763.1252  0.0016 -5.1118 3  103.3860 53  71510 30326 917      251016        syn-C2H3C(O)NH2, v=0
   67808.0593  0.0015 -6.8063 3   50.7454 25  71510 3031212 0      1311 3        syn-C2H3C(O)NH2, v=0
   67808.0593  0.0015 -6.8063 3   50.7454 25  71510 3031212 1      1311 2        syn-C2H3C(O)NH2, v=0
   67900.0126  0.0015 -5.1450 3  140.6764 61  71510 303301119      291218        syn-C2H3C(O)NH2, v=0
   67926.8555  0.0018 -5.7329 3  510.5296111  71510 303552431      542530        syn-C2H3C(O)NH2, v=0
   67926.8555  0.0018 -5.7329 3  510.5296111  71510 303552432      542529        syn-C2H3C(O)NH2, v=0
   67949.1760  0.0006 -5.4129 3    2.4454 11  71510 303 5 2 3       4 1 4        syn-C2H3C(O)NH2, v=0
   68042.3072  0.0008 -4.2224 3  114.0699 57  71510 30328 820      28 721        syn-C2H3C(O)NH2, v=0
   68075.1121  0.0246 -7.0033 3 1055.5356143  71510 303714328      724231        syn-C2H3C(O)NH2, v=0
   68075.1121  0.0246 -7.0033 3 1055.5356143  71510 303714329      724230        syn-C2H3C(O)NH2, v=0
   68096.9698  0.0020 -5.8363 3  259.2806 67  71510 303332310      342213        syn-C2H3C(O)NH2, v=0
   68096.9698  0.0020 -5.8363 3  259.2806 67  71510 303332311      342212        syn-C2H3C(O)NH2, v=0
   68209.1748  0.0006 -4.6494 3    9.3408 19  71510 303 9 2 8       8 1 7        syn-C2H3C(O)NH2, v=0
   68218.1452  0.0063 -6.6293 3  650.3377137  71510 303681652      671949        syn-C2H3C(O)NH2, v=0
   68251.8099  0.0008 -4.2105 3  129.4776 61  71510 30330 822      30 723        syn-C2H3C(O)NH2, v=0
   68255.0679  0.0008 -4.4438 3   37.1529 33  71510 30316 512      16 413        syn-C2H3C(O)NH2, v=0
   68264.0692  0.0014 -5.1642 3  161.4941 65  71510 303321221      311318        syn-C2H3C(O)NH2, v=0
   68276.8027  0.0022 -4.2735 3   88.5795 51  71510 30325 619      25 520        syn-C2H3C(O)NH2, v=0
   68306.8547  0.0041 -6.6836 3   57.5759 43  71510 30321 418      22 121        syn-C2H3C(O)NH2, v=0
   68312.5322  0.0014 -5.1635 3  161.4941 65  71510 303321220      311319        syn-C2H3C(O)NH2, v=0
   68314.6625  0.0032 -6.2138 3  590.2419105  71510 303523319      533222        syn-C2H3C(O)NH2, v=0
   68314.6625  0.0032 -6.2138 3  590.2419105  71510 303523320      533221        syn-C2H3C(O)NH2, v=0
   68318.3673  0.0009 -7.7424 3   30.9775 31  71510 30315 412      15 213        syn-C2H3C(O)NH2, v=0
   68373.7803  0.0114 -6.6408 3 1001.1020153  71510 303763541      753640        syn-C2H3C(O)NH2, v=0
   68373.7803  0.0114 -6.6408 3 1001.1020153  71510 303763542      753639        syn-C2H3C(O)NH2, v=0
   68394.9215  0.0032 -7.6738 3  264.0289 87  71510 303431132      431133        syn-C2H3C(O)NH2, v=0
   68531.6956  0.0049 -6.8199 3  627.4003137  71510 303681355      691258        syn-C2H3C(O)NH2, v=0
   68574.0422  0.0017 -5.0908 3   86.9138 49  71510 30324 816      23 915        syn-C2H3C(O)NH2, v=0
   68585.2092  0.0590 -7.7783 3 1586.2163191  71510 303954550      944649        syn-C2H3C(O)NH2, v=0
   68585.2092  0.0590 -7.7783 3 1586.2163191  71510 303954551      944648        syn-C2H3C(O)NH2, v=0
   68589.4273  0.0013 -4.6703 3   25.2260 29  71510 30314 312      14 213        syn-C2H3C(O)NH2, v=0
   68625.4646  0.0048 -6.8187 3  627.4003137  71510 303681455      691158        syn-C2H3C(O)NH2, v=0
   68685.0488  0.0020 -5.7920 3  549.6352115  71510 303572532      562631        syn-C2H3C(O)NH2, v=0
   68685.0488  0.0020 -5.7920 3  549.6352115  71510 303572533      562630        syn-C2H3C(O)NH2, v=0
   68694.8798  0.0929 -7.7582 3 1287.6771195  71510 303972077      962374        syn-C2H3C(O)NH2, v=0
   68711.0856  0.0051 -6.4411 3  602.4670133  71510 303661452      651749        syn-C2H3C(O)NH2, v=0
   68755.3494  0.0010 -4.8061 3   15.5495 23  71510 30311 2 9      10 3 8        syn-C2H3C(O)NH2, v=0
   68769.6914  0.0149 -6.8424 3  815.2464155  71510 303771661      761958        syn-C2H3C(O)NH2, v=0
   68802.0593  0.0013 -5.1852 3  183.7594 69  71510 303341322      331419        syn-C2H3C(O)NH2, v=0
   68806.7922  0.0020 -5.8249 3  232.8023 63  71510 3033122 9      322112        syn-C2H3C(O)NH2, v=0
   68806.7922  0.0020 -5.8249 3  232.8023 63  71510 303312210      322111        syn-C2H3C(O)NH2, v=0
   68818.4345  0.0014 -5.1850 3  183.7594 69  71510 303341321      331420        syn-C2H3C(O)NH2, v=0
   68891.6289  0.0208 -6.8975 3 1001.2610139  71510 303694227      704130        syn-C2H3C(O)NH2, v=0
   68891.6289  0.0208 -6.8975 3 1001.2610139  71510 303694228      704129        syn-C2H3C(O)NH2, v=0
   69016.1863  0.0027 -6.4052 3  324.9852 99  71510 30349 940      50 843        syn-C2H3C(O)NH2, v=0
   69082.8653  0.0027 -6.1466 3  549.8291101  71510 303503218      513121        syn-C2H3C(O)NH2, v=0
   69082.8653  0.0027 -6.1466 3  549.8291101  71510 303503219      513120        syn-C2H3C(O)NH2, v=0
   69169.8958  0.0006 -6.5620 3   11.6160 21  71510 30310 2 9       9 2 8        syn-C2H3C(O)NH2, v=0
   69185.6115  0.0139 -6.7339 3 1055.5151157  71510 303783642      773741        syn-C2H3C(O)NH2, v=0
   69185.6115  0.0139 -6.7339 3 1055.5151157  71510 303783643      773740        syn-C2H3C(O)NH2, v=0
   69318.9192  0.0034 -7.5823 3  184.7088 73  71510 30336 927      36 928        syn-C2H3C(O)NH2, v=0
   69319.9872  0.0027 -6.4014 3  324.9852 99  71510 303491040      50 743        syn-C2H3C(O)NH2, v=0
   69321.4276  0.0006 -6.6305 3   11.0726 19  71510 303 9 3 6       8 3 5        syn-C2H3C(O)NH2, v=0
   69358.5654  0.0051 -5.7320 3  187.0210 75  71510 30337 830      36 927        syn-C2H3C(O)NH2, v=0
   69376.0023  0.0013 -5.2096 3  207.4720 73  71510 303361423      351520        syn-C2H3C(O)NH2, v=0
   69381.4276  0.0013 -5.2095 3  207.4720 73  71510 303361422      351521        syn-C2H3C(O)NH2, v=0
   69395.7205  0.0631 -7.4983 3 1159.5540185  71510 303921973      912270        syn-C2H3C(O)NH2, v=0
   69447.9718  0.0525 -7.3167 3 1059.7430177  71510 303881970      872067        syn-C2H3C(O)NH2, v=0
   69448.4557  0.0022 -5.8545 3  590.1809119  71510 303592633      582732        syn-C2H3C(O)NH2, v=0
   69448.4557  0.0022 -5.8545 3  590.1809119  71510 303592634      582731        syn-C2H3C(O)NH2, v=0
   69493.2807  0.0045 -6.4713 3  592.7563131  71510 303651550      641847        syn-C2H3C(O)NH2, v=0
   69507.7496  0.0020 -5.8229 3  207.7693 59  71510 3032921 8      302011        syn-C2H3C(O)NH2, v=0
   69507.7496  0.0020 -5.8229 3  207.7693 59  71510 3032921 9      302010        syn-C2H3C(O)NH2, v=0
   69521.0989  0.0039 -6.3373 3  164.5243 71  71510 30335 629      36 532        syn-C2H3C(O)NH2, v=0
   69560.3054  0.0048 -5.6095 3  139.8973 65  71510 30332 726      31 823        syn-C2H3C(O)NH2, v=0
   69577.5909  0.0007 -6.5652 3    3.4758 11  71510 303 5 3 2       5 0 5        syn-C2H3C(O)NH2, v=0
   69621.5961  0.0254 -7.0375 3  923.3246165  71510 303821765      812062        syn-C2H3C(O)NH2, v=0
   69643.2944  0.0006 -4.3408 3   12.1035 23  71510 30311 011      10 110        syn-C2H3C(O)NH2, v=0
   69689.1574  0.0006 -6.4989 3   12.1035 23  71510 30311 111      10 110        syn-C2H3C(O)NH2, v=0
   69702.8744  0.0174 -6.7957 3  948.4172135  71510 303674126      684029        syn-C2H3C(O)NH2, v=0
   69702.8744  0.0174 -6.7957 3  948.4172135  71510 303674127      684028        syn-C2H3C(O)NH2, v=0
   69703.0868  0.0503 -7.6478 3  934.6008161  71510 303802457      812160        syn-C2H3C(O)NH2, v=0
   69733.8372  0.0006 -6.4983 3   12.1005 23  71510 30311 011      10 010        syn-C2H3C(O)NH2, v=0
   69745.3460  0.0019 -4.2216 3  111.7434 57  71510 30328 721      28 622        syn-C2H3C(O)NH2, v=0
   69760.9181  0.0410 -7.2572 3 1038.0986175  71510 303871869      862166        syn-C2H3C(O)NH2, v=0
   69779.7002  0.0006 -4.3390 3   12.1005 23  71510 30311 111      10 010        syn-C2H3C(O)NH2, v=0
   69813.6983  0.0005 -6.5960 3   10.1633 19  71510 303 9 2 7       8 2 6        syn-C2H3C(O)NH2, v=0
   69845.2185  0.0023 -6.0842 3  510.8557 97  71510 303483117      493020        syn-C2H3C(O)NH2, v=0
   69845.2185  0.0023 -6.0842 3  510.8557 97  71510 303483118      493019        syn-C2H3C(O)NH2, v=0
   69868.5507  0.0020 -7.6568 3   38.7210 35  71510 30317 314      17 315        syn-C2H3C(O)NH2, v=0
   69965.4243  0.0684 -7.7218 3 1454.4629169  71510 303845034      854937        syn-C2H3C(O)NH2, v=0
   69965.4243  0.0684 -7.7218 3 1454.4629169  71510 303845035      854936        syn-C2H3C(O)NH2, v=0
   69981.5781  0.0012 -5.2375 3  232.6312 77  71510 303381524      371621        syn-C2H3C(O)NH2, v=0
   69983.3463  0.0012 -5.2375 3  232.6312 77  71510 303381523      371622        syn-C2H3C(O)NH2, v=0
   70001.0622  0.0169 -6.8303 3 1111.3585161  71510 303803743      793842        syn-C2H3C(O)NH2, v=0
   70001.0622  0.0169 -6.8303 3 1111.3585161  71510 303803744      793841        syn-C2H3C(O)NH2, v=0
   70014.3535  0.0039 -7.0520 3   36.3637 35  71510 30317 215      18 118        syn-C2H3C(O)NH2, v=0
   70020.7762  0.0080 -6.9599 3  722.6698147  71510 303731459      741362        syn-C2H3C(O)NH2, v=0
   70079.6164  0.0009 -4.4400 3   35.6495 31  71510 30315 6 9      15 510        syn-C2H3C(O)NH2, v=0
   70081.2072  0.0080 -6.9592 3  722.6698147  71510 303731559      741262        syn-C2H3C(O)NH2, v=0
   70091.8788  0.0137 -6.7292 3  749.9830149  71510 303741659      731756        syn-C2H3C(O)NH2, v=0
   70102.7647  0.0038 -6.3303 3  164.5243 71  71510 30335 729      36 432        syn-C2H3C(O)NH2, v=0
   70199.1015  0.0020 -5.8320 3  184.1822 55  71510 3032720 7      281910        syn-C2H3C(O)NH2, v=0
   70199.1015  0.0020 -5.8320 3  184.1822 55  71510 3032720 8      2819 9        syn-C2H3C(O)NH2, v=0
   70216.7733  0.0025 -5.9204 3  632.1658123  71510 303612734      602833        syn-C2H3C(O)NH2, v=0
   70216.7733  0.0025 -5.9204 3  632.1658123  71510 303612735      602832        syn-C2H3C(O)NH2, v=0
   70508.8097  0.0144 -6.6978 3  897.0052131  71510 303654025      663928        syn-C2H3C(O)NH2, v=0
   70508.8097  0.0144 -6.6978 3  897.0052131  71510 303654026      663927        syn-C2H3C(O)NH2, v=0
   70522.5136  0.0019 -4.4910 3   38.6991 35  71510 30317 314      17 215        syn-C2H3C(O)NH2, v=0
   70527.4644  0.0006 -6.5418 3   11.4979 21  71510 30310 1 9       9 1 8        syn-C2H3C(O)NH2, v=0
   70566.4909  0.0004 -4.8957 3    3.4322 11  71510 303 5 3 3       4 2 2        syn-C2H3C(O)NH2, v=0
   70575.5855  0.0019 -5.0245 3   31.7329 31  71510 30315 411      14 510        syn-C2H3C(O)NH2, v=0
   70601.5403  0.0021 -6.0268 3  473.3226 93  71510 303463016      472919        syn-C2H3C(O)NH2, v=0
   70601.5403  0.0021 -6.0268 3  473.3226 93  71510 303463017      472918        syn-C2H3C(O)NH2, v=0
   70613.4873  0.0012 -5.2688 3  259.2367 81  71510 303401625      391722        syn-C2H3C(O)NH2, v=0
   70614.0557  0.0012 -5.2688 3  259.2367 81  71510 303401624      391723        syn-C2H3C(O)NH2, v=0
   70668.6112  0.0038 -7.0445 3   36.3637 35  71510 30317 315      18 018        syn-C2H3C(O)NH2, v=0
   70715.4816  0.0019 -5.0573 3   71.8896 45  71510 30322 715      21 814        syn-C2H3C(O)NH2, v=0
   70786.7935  0.0044 -6.4797 3   89.2809 53  71510 30326 422      27 325        syn-C2H3C(O)NH2, v=0
   70814.7892  0.0599 -7.5929 3 1390.6872165  71510 303824933      834836        syn-C2H3C(O)NH2, v=0
   70814.7892  0.0599 -7.5929 3 1390.6872165  71510 303824934      834835        syn-C2H3C(O)NH2, v=0
   70820.1552  0.0203 -6.9300 3 1168.6312165  71510 303823844      813943        syn-C2H3C(O)NH2, v=0
   70820.1552  0.0203 -6.9300 3 1168.6312165  71510 303823845      813942        syn-C2H3C(O)NH2, v=0
   70879.9760  0.0020 -5.8543 3  162.0414 51  71510 3032519 6      2618 9        syn-C2H3C(O)NH2, v=0
   70879.9760  0.0020 -5.8543 3  162.0414 51  71510 3032519 7      2618 8        syn-C2H3C(O)NH2, v=0
   70928.6133  0.0029 -6.4650 3  394.6461109  71510 303541044      55 947        syn-C2H3C(O)NH2, v=0
   70980.5572  0.0053 -6.0204 3  355.9693103  71510 303511141      501238        syn-C2H3C(O)NH2, v=0
   70989.7586  0.0029 -5.9896 3  675.5891127  71510 303632835      622934        syn-C2H3C(O)NH2, v=0
   70989.7586  0.0029 -5.9896 3  675.5891127  71510 303632836      622933        syn-C2H3C(O)NH2, v=0
   70990.4228  0.0041 -6.5621 3  148.3047 63  71510 303311121      32 824        syn-C2H3C(O)NH2, v=0
   70996.8436  0.0032 -7.5326 3   95.2521 53  71510 30326 620      26 621        syn-C2H3C(O)NH2, v=0
   71101.8698  0.0847 -7.5969 3 1117.9446179  71510 303892267      882564        syn-C2H3C(O)NH2, v=0
   71129.0237  0.0028 -6.4626 3  394.6461109  71510 303541144      55 847        syn-C2H3C(O)NH2, v=0
   71155.3598  0.0012 -4.2060 3  106.7200 55  71510 30327 819      27 720        syn-C2H3C(O)NH2, v=0
   71166.1817  0.0013 -4.4874 3   34.7790 33  71510 30316 413      16 314        syn-C2H3C(O)NH2, v=0
   71220.2291  0.0009 -4.3981 3   41.2697 35  71510 30317 513      17 414        syn-C2H3C(O)NH2, v=0
   71267.0684  0.0012 -5.3035 3  287.2878 85  71510 303421726      411823        syn-C2H3C(O)NH2, v=0
   71267.2490  0.0012 -5.3035 3  287.2878 85  71510 303421725      411824        syn-C2H3C(O)NH2, v=0
   71309.3865  0.0119 -6.6040 3  847.0259127  71510 303633924      643827        syn-C2H3C(O)NH2, v=0
   71309.3865  0.0119 -6.6040 3  847.0259127  71510 303633925      643826        syn-C2H3C(O)NH2, v=0
   71351.6192  0.0020 -5.9747 3  437.2303 89  71510 303442915      452818        syn-C2H3C(O)NH2, v=0
   71351.6192  0.0020 -5.9747 3  437.2303 89  71510 303442916      452817        syn-C2H3C(O)NH2, v=0
   71426.9433  0.0140 -7.1185 3  824.6299157  71510 303781563      791466        syn-C2H3C(O)NH2, v=0
   71464.5790  0.0043 -6.4717 3   89.2808 53  71510 30326 522      27 225        syn-C2H3C(O)NH2, v=0
   71465.7363  0.0140 -7.1180 3  824.6299157  71510 303781663      791366        syn-C2H3C(O)NH2, v=0
   71492.5637  0.0039 -6.3281 3  553.6103127  71510 303631449      621746        syn-C2H3C(O)NH2, v=0
   71549.3434  0.0019 -5.8931 3  141.3472 47  71510 3032318 5      2417 8        syn-C2H3C(O)NH2, v=0
   71549.3434  0.0019 -5.8931 3  141.3472 47  71510 3032318 6      2417 7        syn-C2H3C(O)NH2, v=0
   71642.9189  0.0243 -7.0329 3 1227.3321169  71510 303843945      834044        syn-C2H3C(O)NH2, v=0
   71642.9189  0.0243 -7.0329 3 1227.3321169  71510 303843946      834043        syn-C2H3C(O)NH2, v=0
   71658.8011  0.0523 -7.4677 3 1328.3347161  71510 303804832      814735        syn-C2H3C(O)NH2, v=0
   71658.8011  0.0523 -7.4677 3 1328.3347161  71510 303804833      814734        syn-C2H3C(O)NH2, v=0
   71767.2169  0.0034 -6.0622 3  720.4501131  71510 303652936      643035        syn-C2H3C(O)NH2, v=0
   71767.2169  0.0034 -6.0622 3  720.4501131  71510 303652937      643034        syn-C2H3C(O)NH2, v=0
   71818.5395  0.0014 -4.9144 3   19.6840 27  71510 30313 112      13 013        syn-C2H3C(O)NH2, v=0
   71844.0715  0.0047 -6.3673 3  585.9338131  71510 303651451      641748        syn-C2H3C(O)NH2, v=0
   71938.5893  0.0012 -5.3417 3  316.7839 89  71510 303441827      431924        syn-C2H3C(O)NH2, v=0
   71938.6461  0.0012 -5.3417 3  316.7839 89  71510 303441826      431925        syn-C2H3C(O)NH2, v=0
   71944.6680  0.0033 -6.3122 3  215.2299 81  71510 30340 733      41 636        syn-C2H3C(O)NH2, v=0
   72095.2093  0.0020 -5.9280 3  402.5797 85  71510 303422814      432717        syn-C2H3C(O)NH2, v=0
   72095.2093  0.0020 -5.9280 3  402.5797 85  71510 303422815      432716        syn-C2H3C(O)NH2, v=0
   72104.5458  0.0097 -6.5141 3  798.4805123  71510 303613823      623726        syn-C2H3C(O)NH2, v=0
   72104.5458  0.0097 -6.5141 3  798.4805123  71510 303613824      623725        syn-C2H3C(O)NH2, v=0
   72115.8043  0.0014 -4.2782 3   66.2536 43  71510 30321 714      21 615        syn-C2H3C(O)NH2, v=0
   72121.8114  0.0014 -4.1790 3  137.4916 63  71510 30331 823      31 724        syn-C2H3C(O)NH2, v=0
   72193.0859  0.0015 -4.9038 3   22.9439 27  71510 30313 310      12 4 9        syn-C2H3C(O)NH2, v=0
   72205.9857  0.0019 -5.9533 3  122.0999 43  71510 3032117 4      2216 7        syn-C2H3C(O)NH2, v=0
   72205.9857  0.0019 -5.9533 3  122.0999 43  71510 3032117 5      2216 6        syn-C2H3C(O)NH2, v=0
   72212.1298  0.0014 -4.9100 3   19.6844 27  71510 30313 212      13 113        syn-C2H3C(O)NH2, v=0
   72270.3001  0.0013 -5.0350 3   77.3939 47  71510 30323 717      22 814        syn-C2H3C(O)NH2, v=0
   72310.7165  0.0011 -7.6621 3   34.7408 33  71510 30316 413      16 214        syn-C2H3C(O)NH2, v=0
   72342.3048  0.0033 -6.3075 3  215.2299 81  71510 30340 833      41 536        syn-C2H3C(O)NH2, v=0
   72356.0474  0.0024 -7.5670 3   54.8972 41  71510 30320 416      20 417        syn-C2H3C(O)NH2, v=0
   72464.7296  0.0034 -5.3511 3   92.8349 53  71510 30326 621      25 718        syn-C2H3C(O)NH2, v=0
   72469.3864  0.0288 -7.1390 3 1287.4601173  71510 303864046      854145        syn-C2H3C(O)NH2, v=0
   72469.3864  0.0288 -7.1390 3 1287.4601173  71510 303864047      854144        syn-C2H3C(O)NH2, v=0
   72497.4566  0.0454 -7.3462 3 1267.4067157  71510 303784731      794634        syn-C2H3C(O)NH2, v=0
   72497.4566  0.0454 -7.3462 3 1267.4067157  71510 303784732      794633        syn-C2H3C(O)NH2, v=0
   72534.0794  0.0016 -4.6252 3   28.5580 31  71510 30315 213      15 114        syn-C2H3C(O)NH2, v=0
   72544.4334  0.0008 -4.4506 3   31.8388 29  71510 30314 6 8      14 5 9        syn-C2H3C(O)NH2, v=0
   72548.9934  0.0042 -6.1381 3  766.7478135  71510 303673037      663136        syn-C2H3C(O)NH2, v=0
   72548.9934  0.0042 -6.1381 3  766.7478135  71510 303673038      663135        syn-C2H3C(O)NH2, v=0
   72625.1471  0.0012 -5.3832 3  347.7246 93  71510 303461928      452025        syn-C2H3C(O)NH2, v=0
   72625.1648  0.0012 -5.3832 3  347.7246 93  71510 303461927      452026        syn-C2H3C(O)NH2, v=0
   72710.5448  0.0006 -4.5195 3   11.4979 21  71510 30310 2 9       9 1 8        syn-C2H3C(O)NH2, v=0
   72725.5467  0.0029 -7.5297 3   73.7436 47  71510 30323 518      23 519        syn-C2H3C(O)NH2, v=0
   72725.6587  0.0033 -6.5479 3  471.0205119  71510 303591148      601051        syn-C2H3C(O)NH2, v=0
   72752.4932  0.0237 -7.2950 3  933.2736167  71510 303831667      841570        syn-C2H3C(O)NH2, v=0
   72777.3139  0.0237 -7.2947 3  933.2736167  71510 303831767      841470        syn-C2H3C(O)NH2, v=0
   72832.0253  0.0020 -5.8872 3  369.3712 81  71510 303402713      412616        syn-C2H3C(O)NH2, v=0
   72832.0253  0.0020 -5.8872 3  369.3712 81  71510 303402714      412615        syn-C2H3C(O)NH2, v=0
   72846.1075  0.0006 -6.5397 3   13.1196 21  71510 30310 3 8       9 3 7        syn-C2H3C(O)NH2, v=0
   72848.4591  0.0018 -6.0431 3  104.3000 39  71510 3031916 3      2015 6        syn-C2H3C(O)NH2, v=0
   72848.4591  0.0018 -6.0431 3  104.3000 39  71510 3031916 4      2015 5        syn-C2H3C(O)NH2, v=0
   72856.8166  0.0032 -6.5463 3  471.0205119  71510 303591248      60 951        syn-C2H3C(O)NH2, v=0
   72894.2166  0.0079 -6.4285 3  751.3697119  71510 303593722      603625        syn-C2H3C(O)NH2, v=0
   72894.2166  0.0079 -6.4285 3  751.3697119  71510 303593723      603624        syn-C2H3C(O)NH2, v=0
   72911.3503  0.0013 -5.0705 3   68.6592 45  71510 30322 617      21 714        syn-C2H3C(O)NH2, v=0
   72915.0921  0.0043 -6.3273 3  569.6457129  71510 303641450      631747        syn-C2H3C(O)NH2, v=0
   72969.8627  0.0004 -4.8884 3    3.3627 11  71510 303 5 3 2       4 2 3        syn-C2H3C(O)NH2, v=0
   72982.4038  0.0042 -6.6418 3  317.4019 93  71510 303461532      471235        syn-C2H3C(O)NH2, v=0
   73043.7628  0.0006 -7.2501 3   30.0924 21  71510 30310 9 1       9 9 0        syn-C2H3C(O)NH2, v=0
   73043.7628  0.0006 -7.2501 3   30.0924 21  71510 30310 9 2       9 9 1        syn-C2H3C(O)NH2, v=0
   73129.3242  0.0006 -6.9632 3   26.0786 21  71510 30310 8 3       9 8 2        syn-C2H3C(O)NH2, v=0
   73129.3251  0.0006 -6.9632 3   26.0786 21  71510 30310 8 2       9 8 1        syn-C2H3C(O)NH2, v=0
   73254.6494  0.0006 -6.8031 3   22.5402 21  71510 30310 7 4       9 7 3        syn-C2H3C(O)NH2, v=0
   73254.7213  0.0006 -6.8031 3   22.5402 21  71510 30310 7 3       9 7 2        syn-C2H3C(O)NH2, v=0
   73262.5716  0.0078 -6.5513 3  695.8515143  71510 303711556      701853        syn-C2H3C(O)NH2, v=0
   73299.5953  0.0339 -7.2484 3 1349.0141177  71510 303884147      874246        syn-C2H3C(O)NH2, v=0
   73299.5953  0.0339 -7.2484 3 1349.0141177  71510 303884148      874245        syn-C2H3C(O)NH2, v=0
   73324.4938  0.0013 -5.4282 3  380.1092 97  71510 303482029      472126        syn-C2H3C(O)NH2, v=0
   73324.4992  0.0013 -5.4282 3  380.1092 97  71510 303482028      472127        syn-C2H3C(O)NH2, v=0
   73330.7472  0.0392 -7.2283 3 1207.9043153  71510 303764630      774533        syn-C2H3C(O)NH2, v=0
   73330.7472  0.0392 -7.2283 3 1207.9043153  71510 303764631      774532        syn-C2H3C(O)NH2, v=0
   73334.9657  0.0052 -6.2174 3  814.4815139  71510 303693138      683237        syn-C2H3C(O)NH2, v=0
   73334.9657  0.0052 -6.2174 3  814.4815139  71510 303693139      683236        syn-C2H3C(O)NH2, v=0
   73428.4907  0.0149 -6.8594 3  792.2940151  71510 303751857      742154        syn-C2H3C(O)NH2, v=0
   73449.3967  0.0006 -6.6959 3   19.4794 21  71510 30310 6 5       9 6 4        syn-C2H3C(O)NH2, v=0
   73452.6535  0.0006 -6.6958 3   19.4794 21  71510 30310 6 4       9 6 3        syn-C2H3C(O)NH2, v=0
   73475.0503  0.0018 -6.1776 3   87.9475 35  71510 3031715 2      1814 5        syn-C2H3C(O)NH2, v=0
   73475.0503  0.0018 -6.1776 3   87.9475 35  71510 3031715 3      1814 4        syn-C2H3C(O)NH2, v=0
   73561.7361  0.0021 -5.8527 3  337.6056 77  71510 303382612      392515        syn-C2H3C(O)NH2, v=0
   73561.7361  0.0021 -5.8527 3  337.6056 77  71510 303382613      392514        syn-C2H3C(O)NH2, v=0
   73678.3147  0.0063 -6.3471 3  705.6945115  71510 303573621      583524        syn-C2H3C(O)NH2, v=0
   73678.3147  0.0063 -6.3471 3  705.6945115  71510 303573622      583523        syn-C2H3C(O)NH2, v=0
   73749.4139  0.0006 -6.6182 3   16.9000 21  71510 30310 5 6       9 5 5        syn-C2H3C(O)NH2, v=0
   73787.1772  0.0042 -6.3564 3  127.7300 63  71510 30331 526      32 429        syn-C2H3C(O)NH2, v=0
   73832.5837  0.0006 -6.6172 3   16.9014 21  71510 30310 5 5       9 5 4        syn-C2H3C(O)NH2, v=0
   73902.7515  0.0347 -7.0373 3  943.6105167  71510 303831866      821963        syn-C2H3C(O)NH2, v=0
   73909.4465  0.0022 -4.3522 3   54.8454 41  71510 30320 416      20 317        syn-C2H3C(O)NH2, v=0
   73945.5750  0.0006 -6.5627 3   14.8016 21  71510 30310 4 7       9 4 6        syn-C2H3C(O)NH2, v=0
   73979.3508  0.0062 -6.2167 3  493.2085121  71510 303601348      591445        syn-C2H3C(O)NH2, v=0
   73998.3423  0.0379 -7.4889 3 1048.5936177  71510 303881771      891674        syn-C2H3C(O)NH2, v=0
   74014.1793  0.0379 -7.4887 3 1048.5936177  71510 303881871      891574        syn-C2H3C(O)NH2, v=0
   74019.7019  0.0043 -6.6503 3   62.5290 45  71510 30322 319      23 222        syn-C2H3C(O)NH2, v=0
   74034.8790  0.0014 -5.4766 3  413.9371101  71510 303502130      492227        syn-C2H3C(O)NH2, v=0
   74034.8807  0.0014 -5.4766 3  413.9371101  71510 303502129      492228        syn-C2H3C(O)NH2, v=0
   74083.7275  0.0017 -6.3892 3   73.0427 31  71510 3031514 1      1613 4        syn-C2H3C(O)NH2, v=0
   74083.7275  0.0017 -6.3892 3   73.0427 31  71510 3031514 2      1613 3        syn-C2H3C(O)NH2, v=0
   74125.0388  0.0064 -6.2999 3  863.6501143  71510 303713239      703338        syn-C2H3C(O)NH2, v=0
   74125.0388  0.0064 -6.2999 3  863.6501143  71510 303713240      703337        syn-C2H3C(O)NH2, v=0
   74133.5866  0.0397 -7.3610 3 1411.9929181  71510 303904248      894347        syn-C2H3C(O)NH2, v=0
   74133.5866  0.0397 -7.3610 3 1411.9929181  71510 303904249      894346        syn-C2H3C(O)NH2, v=0
   74158.6590  0.0337 -7.1142 3 1149.8287149  71510 303744529      754432        syn-C2H3C(O)NH2, v=0
   74158.6590  0.0337 -7.1142 3 1149.8287149  71510 303744530      754431        syn-C2H3C(O)NH2, v=0
   74169.0536  0.0006 -4.4426 3   13.9233 23  71510 30311 110      10 2 9        syn-C2H3C(O)NH2, v=0
   74180.3330  0.0028 -6.3211 3  272.6634 91  71510 30345 837      46 740        syn-C2H3C(O)NH2, v=0
   74272.6736  0.0041 -6.3509 3  127.7300 63  71510 30331 626      32 329        syn-C2H3C(O)NH2, v=0
   74283.9577  0.0021 -5.8251 3  307.2835 73  71510 303362511      372414        syn-C2H3C(O)NH2, v=0
   74283.9577  0.0021 -5.8251 3  307.2835 73  71510 303362512      372413        syn-C2H3C(O)NH2, v=0
   74309.3739  0.0007 -4.4731 3   28.3135 27  71510 30313 6 7      13 5 8        syn-C2H3C(O)NH2, v=0
   74368.8613  0.0014 -4.6052 3   28.5619 31  71510 30315 313      15 214        syn-C2H3C(O)NH2, v=0
   74420.1253  0.0038 -6.6521 3  554.1030129  71510 303641252      651155        syn-C2H3C(O)NH2, v=0
   74427.8076  0.0009 -6.3255 3    4.8028 13  71510 303 6 3 3       6 0 6        syn-C2H3C(O)NH2, v=0
   74448.0202  0.0028 -6.3180 3  272.6634 91  71510 30345 937      46 640        syn-C2H3C(O)NH2, v=0
   74456.7402  0.0050 -6.2700 3  661.4557111  71510 303553520      563423        syn-C2H3C(O)NH2, v=0
   74456.7402  0.0050 -6.2700 3  661.4557111  71510 303553521      563422        syn-C2H3C(O)NH2, v=0
   74468.6576  0.0005 -4.1505 3  156.9529 67  71510 30333 924      33 825        syn-C2H3C(O)NH2, v=0
   74504.0363  0.0374 -7.1825 3  948.1710165  71510 303822062      812359        syn-C2H3C(O)NH2, v=0
   74505.4034  0.0038 -6.6511 3  554.1030129  71510 303641352      651055        syn-C2H3C(O)NH2, v=0
   74540.3622  0.0042 -6.6445 3   62.5290 45  71510 30322 419      23 122        syn-C2H3C(O)NH2, v=0
   74547.9206  0.0015 -5.0049 3   92.8929 51  71510 30325 818      24 915        syn-C2H3C(O)NH2, v=0
   74672.0890  0.0016 -6.7734 3   59.5857 27  71510 3031313 0      1412 3        syn-C2H3C(O)NH2, v=0
   74672.0890  0.0016 -6.7734 3   59.5857 27  71510 3031313 1      1412 2        syn-C2H3C(O)NH2, v=0
   74741.4329  0.0072 -6.9460 3  549.8527123  71510 303611943      621646        syn-C2H3C(O)NH2, v=0
   74754.9285  0.0016 -5.5284 3  449.2076105  71510 303522231      512328        syn-C2H3C(O)NH2, v=0
   74754.9290  0.0016 -5.5284 3  449.2076105  71510 303522230      512329        syn-C2H3C(O)NH2, v=0
   74756.3410  0.0022 -5.0000 3   58.3110 41  71510 30320 614      19 713        syn-C2H3C(O)NH2, v=0
   74854.1229  0.0041 -6.5765 3  114.0699 55  71510 303271018      28 721        syn-C2H3C(O)NH2, v=0
   74869.4828  0.0011 -4.3514 3   45.6020 37  71510 30318 514      18 415        syn-C2H3C(O)NH2, v=0
   74914.1218  0.1049 -7.6818 3 1287.4727195  71510 303972177      962274        syn-C2H3C(O)NH2, v=0
   74919.1402  0.0080 -6.3857 3  914.2529147  71510 303733340      723439        syn-C2H3C(O)NH2, v=0
   74919.1402  0.0080 -6.3857 3  914.2529147  71510 303733341      723438        syn-C2H3C(O)NH2, v=0
   74971.4045  0.0462 -7.4767 3 1476.3952185  71510 303924349      914448        syn-C2H3C(O)NH2, v=0
   74971.4045  0.0462 -7.4767 3 1476.3952185  71510 303924350      914447        syn-C2H3C(O)NH2, v=0
   74981.1720  0.0288 -7.0038 3 1093.1809145  71510 303724428      734331        syn-C2H3C(O)NH2, v=0
   74981.1720  0.0288 -7.0038 3 1093.1809145  71510 303724429      734330        syn-C2H3C(O)NH2, v=0
   74998.2440  0.0021 -5.8049 3  278.4053 69  71510 303342410      352313        syn-C2H3C(O)NH2, v=0
   74998.2440  0.0021 -5.8049 3  278.4053 69  71510 303342411      352312        syn-C2H3C(O)NH2, v=0
   75017.9082  0.0007 -6.5500 3   14.8312 21  71510 30310 4 6       9 4 5        syn-C2H3C(O)NH2, v=0
   75035.5434  0.0035 -7.6742 3  314.8990 95  71510 303471235      471236        syn-C2H3C(O)NH2, v=0
   75164.4136  0.0576 -7.7000 3 1170.5822187  71510 303931875      941778        syn-C2H3C(O)NH2, v=0
   75174.4950  0.0576 -7.6998 3 1170.5822187  71510 303931975      941678        syn-C2H3C(O)NH2, v=0
   75229.3767  0.0040 -6.1974 3  618.6542107  71510 303533419      543322        syn-C2H3C(O)NH2, v=0
   75229.3767  0.0040 -6.1974 3  618.6542107  71510 303533420      543321        syn-C2H3C(O)NH2, v=0
   75229.8723  0.0006 -4.3886 3   35.4573 31  71510 30315 610      15 511        syn-C2H3C(O)NH2, v=0
   75282.0516  0.0006 -4.3581 3   39.4296 33  71510 30316 611      16 512        syn-C2H3C(O)NH2, v=0
   75446.1914  0.0006 -4.4213 3   31.7329 29  71510 30314 6 9      14 510        syn-C2H3C(O)NH2, v=0
   75455.4806  0.0006 -6.4476 3   13.9233 23  71510 30311 210      10 2 9        syn-C2H3C(O)NH2, v=0
   75483.5535  0.0017 -5.5836 3  485.9201109  71510 303542332      532429        syn-C2H3C(O)NH2, v=0
   75483.5537  0.0017 -5.5836 3  485.9201109  71510 303542331      532430        syn-C2H3C(O)NH2, v=0
   75509.9731  0.0035 -7.4991 3  154.4342 67  71510 30333 825      33 826        syn-C2H3C(O)NH2, v=0
   75513.6879  0.0200 -4.1442 3  148.3047 65 -71510 30332 923      32 824        syn-C2H3C(O)NH2, v=0
   75525.0979  0.0007 -4.5075 3   25.0646 25  71510 30312 6 6      12 5 7        syn-C2H3C(O)NH2, v=0
   75652.7247  0.0015 -5.0012 3  109.8486 55  71510 30327 919      261016        syn-C2H3C(O)NH2, v=0
   75668.4610  0.0015 -4.1805 3   99.6353 53  71510 30326 818      26 719        syn-C2H3C(O)NH2, v=0
   75704.0773  0.0021 -5.7932 3  250.9717 65  71510 3033223 9      332212        syn-C2H3C(O)NH2, v=0
   75704.0773  0.0021 -5.7932 3  250.9717 65  71510 303322310      332211        syn-C2H3C(O)NH2, v=0
   75717.2163  0.0099 -6.4749 3  966.2887151  71510 303753441      743540        syn-C2H3C(O)NH2, v=0
   75717.2163  0.0099 -6.4749 3  966.2887151  71510 303753442      743539        syn-C2H3C(O)NH2, v=0
   75728.4614  0.0006 -4.3285 3   43.6454 35  71510 30317 612      17 513        syn-C2H3C(O)NH2, v=0
   75735.5543  0.0200 -4.2297 3   14.4281 25 -71510 30312 012      11 111        syn-C2H3C(O)NH2, v=0
   75758.4698  0.0007 -6.3931 3   14.4281 25  71510 30312 112      11 111        syn-C2H3C(O)NH2, v=0
   75781.4208  0.0007 -6.3928 3   14.4265 25  71510 30312 012      11 011        syn-C2H3C(O)NH2, v=0
   75798.2595  0.0245 -6.8972 3 1037.9622141  71510 303704327      714230        syn-C2H3C(O)NH2, v=0
   75798.2595  0.0245 -6.8972 3 1037.9622141  71510 303704328      714229        syn-C2H3C(O)NH2, v=0
   75804.3382  0.0200 -4.2289 3   14.4265 25 -71510 30312 112      11 011        syn-C2H3C(O)NH2, v=0
   75813.0958  0.0534 -7.5957 3 1542.2198189  71510 303944450      934549        syn-C2H3C(O)NH2, v=0
   75813.0958  0.0534 -7.5957 3 1542.2198189  71510 303944451      934548        syn-C2H3C(O)NH2, v=0
   75815.3158  0.0006 -4.4579 3   28.2595 27  71510 30313 6 8      13 5 9        syn-C2H3C(O)NH2, v=0
   75926.2551  0.0025 -4.2604 3   73.6368 47  71510 30323 518      23 419        syn-C2H3C(O)NH2, v=0
   75996.0879  0.0032 -6.1295 3  577.2908103  71510 303513318      523221        syn-C2H3C(O)NH2, v=0
   75996.0879  0.0032 -6.1295 3  577.2908103  71510 303513319      523220        syn-C2H3C(O)NH2, v=0
   76016.7068  0.0200 -4.1401 3  165.8181 69 -71510 30334 925      34 826        syn-C2H3C(O)NH2, v=0
   76020.7070  0.0053 -6.7764 3  643.8879139  71510 303691356      701259        syn-C2H3C(O)NH2, v=0
   76075.8559  0.0053 -6.7757 3  643.8879139  71510 303691456      701159        syn-C2H3C(O)NH2, v=0
   76219.8855  0.0200 -5.6421 3  524.0739113 -71510 303562433      552530        syn-C2H3C(O)NH2, v=0
   76219.8855  0.0200 -5.6421 3  524.0739113 -71510 303562432      552531        syn-C2H3C(O)NH2, v=0
   76228.8016  0.0004 -4.8186 3    4.7119 13  71510 303 6 3 4       5 2 3        syn-C2H3C(O)NH2, v=0
   76242.7828  0.0006 -4.5003 3   25.0392 25  71510 30312 6 7      12 5 8        syn-C2H3C(O)NH2, v=0
   76255.3950  0.0200 -5.0105 3  128.2565 59 -71510 303291020      281117        syn-C2H3C(O)NH2, v=0
   76260.6920  0.0026 -6.3588 3  336.8200101  71510 30350 941      51 844        syn-C2H3C(O)NH2, v=0
   76264.9242  0.0133 -6.7015 3  795.9718153  71510 303761660      751957        syn-C2H3C(O)NH2, v=0
   76349.2890  0.0006 -4.5539 3   22.0836 23  71510 30311 6 5      11 5 6        syn-C2H3C(O)NH2, v=0
   76352.1341  0.0006 -6.4358 3   13.8505 23  71510 30311 110      10 1 9        syn-C2H3C(O)NH2, v=0
   76398.8753  0.0015 -5.0654 3   74.2485 47  71510 30323 618      22 715        syn-C2H3C(O)NH2, v=0
   76400.8548  0.0021 -5.7910 3  224.9830 61  71510 3033022 8      312111        syn-C2H3C(O)NH2, v=0
   76400.8548  0.0021 -5.7910 3  224.9830 61  71510 3033022 9      312110        syn-C2H3C(O)NH2, v=0
   76408.6135  0.0040 -7.0137 3   40.3060 37  71510 30318 216      19 119        syn-C2H3C(O)NH2, v=0
   76409.8304  0.0014 -4.4299 3   38.7210 35  71510 30317 414      17 315        syn-C2H3C(O)NH2, v=0
   76438.0969  0.0027 -5.2048 3   86.3332 51  71510 30325 620      24 717        syn-C2H3C(O)NH2, v=0
   76438.7541  0.0026 -6.3568 3  336.8199101  71510 303501041      51 744        syn-C2H3C(O)NH2, v=0
   76484.8734  0.0088 -6.4672 3  652.6132139  71510 303691555      681652        syn-C2H3C(O)NH2, v=0
   76492.3330  0.0038 -6.2914 3  172.9172 73  71510 30336 630      37 533        syn-C2H3C(O)NH2, v=0
   76519.2299  0.0122 -6.5672 3 1019.7566155  71510 303773542      763641        syn-C2H3C(O)NH2, v=0
   76519.2299  0.0122 -6.5672 3 1019.7566155  71510 303773543      763640        syn-C2H3C(O)NH2, v=0
   76609.8872  0.0207 -6.7945 3  984.1735137  71510 303684226      694129        syn-C2H3C(O)NH2, v=0
   76609.8872  0.0207 -6.7945 3  984.1735137  71510 303684227      694128        syn-C2H3C(O)NH2, v=0
   76626.4120  0.0013 -4.2581 3   60.8046 41  71510 30320 713      20 614        syn-C2H3C(O)NH2, v=0
   76661.0539  0.0006 -4.5507 3   22.0728 23  71510 30311 6 6      11 5 7        syn-C2H3C(O)NH2, v=0
   76690.2611  0.0006 -4.2985 3   48.0994 37  71510 30318 613      18 514        syn-C2H3C(O)NH2, v=0
   76695.7938  0.0015 -5.0268 3  148.1144 63  71510 303311121      301218        syn-C2H3C(O)NH2, v=0
   76702.7521  0.0033 -7.5515 3  227.6586 81  71510 303401030      401031        syn-C2H3C(O)NH2, v=0
   76756.7158  0.0027 -6.0663 3  537.3663 99  71510 303493217      503120        syn-C2H3C(O)NH2, v=0
   76756.7158  0.0027 -6.0663 3  537.3663 99  71510 303493218      503119        syn-C2H3C(O)NH2, v=0
   76774.4876  0.0040 -7.0098 3   40.3060 37  71510 30318 316      19 019        syn-C2H3C(O)NH2, v=0
   76830.6662  0.0037 -6.2877 3  172.9171 73  71510 30336 730      37 433        syn-C2H3C(O)NH2, v=0
   76889.0396  0.0006 -6.4702 3   12.4921 21  71510 30310 2 8       9 2 7        syn-C2H3C(O)NH2, v=0
   76907.5806  0.0006 -4.6137 3   19.3642 21  71510 30310 6 4      10 5 5        syn-C2H3C(O)NH2, v=0
   76952.8166  0.0025 -4.1999 3   95.0534 53  71510 30326 620      26 521        syn-C2H3C(O)NH2, v=0
   76963.2220  0.0020 -5.7040 3  563.6682117  71510 303582533      572632        syn-C2H3C(O)NH2, v=0
   76963.2220  0.0020 -5.7040 3  563.6682117  71510 303582534      572631        syn-C2H3C(O)NH2, v=0
   76965.5858  0.0050 -5.8129 3  289.7024 93  71510 303461037      451134        syn-C2H3C(O)NH2, v=0
   76975.4394  0.0200 -5.0236 3  148.1140 63 -71510 303311120      301219        syn-C2H3C(O)NH2, v=0
   77016.3023  0.0200 -5.0015 3  128.2554 59 -71510 303291019      281118        syn-C2H3C(O)NH2, v=0
   77029.4007  0.0006 -4.6124 3   19.3600 21  71510 30310 6 5      10 5 6        syn-C2H3C(O)NH2, v=0
   77063.7933  0.0013 -7.5885 3   38.6991 35  71510 30317 414      17 215        syn-C2H3C(O)NH2, v=0
   77087.8750  0.0021 -5.7999 3  200.4399 57  71510 3032821 7      292010        syn-C2H3C(O)NH2, v=0
   77087.8750  0.0021 -5.7999 3  200.4399 57  71510 3032821 8      2920 9        syn-C2H3C(O)NH2, v=0
   77119.5154  0.0200 -5.0478 3  169.4211 67 -71510 303331222      321319        syn-C2H3C(O)NH2, v=0
   77218.7670  0.0200 -5.0466 3  169.4210 67 -71510 303331221      321320        syn-C2H3C(O)NH2, v=0
   77220.1097  0.0047 -6.3699 3  609.2973133  71510 303661551      651848        syn-C2H3C(O)NH2, v=0
   77287.5108  0.0006 -4.6910 3   16.9014 19  71510 303 9 6 3       9 5 4        syn-C2H3C(O)NH2, v=0
   77325.1570  0.0148 -6.6628 3 1074.6557159  71510 303793643      783742        syn-C2H3C(O)NH2, v=0
   77325.1570  0.0148 -6.6628 3 1074.6557159  71510 303793644      783741        syn-C2H3C(O)NH2, v=0
   77329.4179  0.0006 -4.6905 3   16.9000 19  71510 303 9 6 4       9 5 5        syn-C2H3C(O)NH2, v=0
   77413.6154  0.0318 -7.4161 3  845.4827153  71510 303762354      772057        syn-C2H3C(O)NH2, v=0
   77416.0124  0.0173 -6.6958 3  931.8158133  71510 303664125      674028        syn-C2H3C(O)NH2, v=0
   77416.0124  0.0173 -6.6958 3  931.8158133  71510 303664126      674027        syn-C2H3C(O)NH2, v=0
   77482.9834  0.0044 -6.4374 3   95.4474 55  71510 30327 423      28 326        syn-C2H3C(O)NH2, v=0
   77511.0770  0.0024 -6.0082 3  498.8815 95  71510 303473116      483019        syn-C2H3C(O)NH2, v=0
   77511.0770  0.0024 -6.0082 3  498.8815 95  71510 303473117      483018        syn-C2H3C(O)NH2, v=0
   77533.0881  0.0088 -6.9198 3  740.3690149  71510 303741460      751363        syn-C2H3C(O)NH2, v=0
   77546.2308  0.0007 -4.7947 3   14.6918 17  71510 303 8 6 2       8 5 3        syn-C2H3C(O)NH2, v=0
   77558.4949  0.0007 -4.7946 3   14.6914 17  71510 303 8 6 3       8 5 4        syn-C2H3C(O)NH2, v=0
   77558.8508  0.0023 -4.1602 3  119.0762 59  71510 30329 722      29 623        syn-C2H3C(O)NH2, v=0
   77568.5926  0.0088 -6.9194 3  740.3690149  71510 303741560      751263        syn-C2H3C(O)NH2, v=0
   77576.9814  0.0200 -5.0724 3  192.1759 71 -71510 303351323      341420        syn-C2H3C(O)NH2, v=0
   77611.2678  0.0200 -5.0720 3  192.1758 71 -71510 303351322      341421        syn-C2H3C(O)NH2, v=0
   77630.3848  0.0200 -4.9775 3  109.8455 55 -71510 30327 918      261017        syn-C2H3C(O)NH2, v=0
   77638.5610  0.0006 -4.3976 3   13.8505 23  71510 30311 210      10 1 9        syn-C2H3C(O)NH2, v=0
   77695.7461  0.0020 -5.1093 3   80.1377 49  71510 30324 619      23 716        syn-C2H3C(O)NH2, v=0
   77703.2573  0.0679 -7.6073 3 1433.7444167  71510 303835033      844936        syn-C2H3C(O)NH2, v=0
   77703.2573  0.0679 -7.6073 3 1433.7444167  71510 303835034      844935        syn-C2H3C(O)NH2, v=0
   77713.0002  0.0023 -5.7692 3  604.7024121  71510 303602634      592733        syn-C2H3C(O)NH2, v=0
   77713.0002  0.0023 -5.7692 3  604.7024121  71510 303602635      592732        syn-C2H3C(O)NH2, v=0
   77720.5091  0.0007 -4.9466 3   12.7328 15  71510 303 7 6 1       7 5 2        syn-C2H3C(O)NH2, v=0
   77723.3908  0.0007 -4.9466 3   12.7327 15  71510 303 7 6 2       7 5 3        syn-C2H3C(O)NH2, v=0
   77724.2257  0.0007 -6.4793 3   13.3849 21  71510 30310 3 7       9 3 6        syn-C2H3C(O)NH2, v=0
   77764.3192  0.0020 -5.8222 3  177.3426 53  71510 3032620 6      2719 9        syn-C2H3C(O)NH2, v=0
   77764.3192  0.0020 -5.8222 3  177.3426 53  71510 3032620 7      2719 8        syn-C2H3C(O)NH2, v=0
   77801.5575  0.0020 -7.5622 3   42.8669 37  71510 30318 315      18 316        syn-C2H3C(O)NH2, v=0
   77812.8877  0.0038 -6.6392 3   84.3183 47  71510 30323 915      24 618        syn-C2H3C(O)NH2, v=0
   77834.7069  0.0007 -5.2188 3   11.0225 13  71510 303 6 6 0       6 5 1        syn-C2H3C(O)NH2, v=0
   77835.1936  0.0007 -5.2188 3   11.0224 13  71510 303 6 6 1       6 5 2        syn-C2H3C(O)NH2, v=0
   77871.6933  0.0043 -6.4333 3   95.4473 55  71510 30327 523      28 226        syn-C2H3C(O)NH2, v=0
   78023.3506  0.0228 -6.8842 3  902.8123163  71510 303811764      802061        syn-C2H3C(O)NH2, v=0
   78033.7801  0.0015 -4.8482 3   22.6158 29  71510 30314 113      14 014        syn-C2H3C(O)NH2, v=0
   78079.0338  0.0200 -5.1004 3  216.3780 75 -71510 303371424      361521        syn-C2H3C(O)NH2, v=0
   78090.5805  0.0200 -5.1002 3  216.3779 75 -71510 303371423      361522        syn-C2H3C(O)NH2, v=0
   78134.9855  0.0180 -6.7617 3 1130.9848163  71510 303813744      803843        syn-C2H3C(O)NH2, v=0
   78134.9855  0.0180 -6.7617 3 1130.9848163  71510 303813745      803842        syn-C2H3C(O)NH2, v=0
   78167.2921  0.0019 -4.4126 3   42.8547 37  71510 30318 315      18 216        syn-C2H3C(O)NH2, v=0
   78209.0335  0.0029 -6.4218 3  407.6947111  71510 303551045      56 948        syn-C2H3C(O)NH2, v=0
   78216.5830  0.0144 -6.6010 3  880.8903129  71510 303644024      653927        syn-C2H3C(O)NH2, v=0
   78216.5830  0.0144 -6.6010 3  880.8903129  71510 303644025      653926        syn-C2H3C(O)NH2, v=0
   78247.4008  0.0015 -4.8459 3   22.6160 29  71510 30314 213      14 114        syn-C2H3C(O)NH2, v=0
   78258.9601  0.0022 -5.9553 3  461.8370 91  71510 303453015      462918        syn-C2H3C(O)NH2, v=0
   78258.9601  0.0022 -5.9553 3  461.8370 91  71510 303453016      462917        syn-C2H3C(O)NH2, v=0
   78259.1628  0.0071 -6.4511 3  678.0521141  71510 303701555      691852        syn-C2H3C(O)NH2, v=0
   78269.0270  0.0007 -4.2673 3   52.7859 39  71510 30319 614      19 515        syn-C2H3C(O)NH2, v=0
   78326.3545  0.0029 -6.4205 3  407.6947111  71510 303551145      56 848        syn-C2H3C(O)NH2, v=0
   78429.2310  0.0020 -5.8611 3  155.6916 49  71510 3032419 5      2518 8        syn-C2H3C(O)NH2, v=0
   78429.2310  0.0020 -5.8611 3  155.6916 49  71510 3032419 6      2518 7        syn-C2H3C(O)NH2, v=0
   78431.7348  0.0019 -4.1334 3  145.6885 65  71510 30332 824      32 725        syn-C2H3C(O)NH2, v=0
   78468.7593  0.0026 -5.8377 3  647.1755125  71510 303622735      612834        syn-C2H3C(O)NH2, v=0
   78468.7593  0.0026 -5.8377 3  647.1755125  71510 303622736      612833        syn-C2H3C(O)NH2, v=0
   78500.7878  0.0870 -7.5807 3 1263.4987193  71510 303962076      952373        syn-C2H3C(O)NH2, v=0
   78538.1188  0.0039 -6.5551 3  266.3103 85  71510 303421429      431132        syn-C2H3C(O)NH2, v=0
   78548.8171  0.0595 -7.4811 3 1370.4524163  71510 303814932      824835        syn-C2H3C(O)NH2, v=0
   78548.8171  0.0595 -7.4811 3 1370.4524163  71510 303814933      824834        syn-C2H3C(O)NH2, v=0
   78588.4555  0.0748 -7.3882 3 1159.2520185  71510 303922073      912170        syn-C2H3C(O)NH2, v=0
   78622.6897  0.0200 -5.1317 3  242.0268 79 -71510 303391525      381622        syn-C2H3C(O)NH2, v=0
   78626.5210  0.0200 -5.1316 3  242.0268 79 -71510 303391524      381623        syn-C2H3C(O)NH2, v=0
   78706.7615  0.0093 -6.6307 3  728.6373145  71510 303721755      712052        syn-C2H3C(O)NH2, v=0
   78762.0195  0.0009 -4.5791 3   18.2090 25  71510 30312 210      11 3 9        syn-C2H3C(O)NH2, v=0
   78764.8450  0.0200 -4.1238 3  139.8973 63 -71510 30331 922      31 823        syn-C2H3C(O)NH2, v=0
   78769.0773  0.0200 -4.6629 3    3.5881  9 -71510 303 4 4 1       3 3 0        syn-C2H3C(O)NH2, v=0
   78781.4476  0.0004 -4.6628 3    3.5877  9  71510 303 4 4 0       3 3 1        syn-C2H3C(O)NH2, v=0
   78821.6467  0.0375 -7.0941 3 1016.3571173  71510 303861868      852165        syn-C2H3C(O)NH2, v=0
   78910.4074  0.0584 -7.3272 3 1136.5908183  71510 303911972      902269        syn-C2H3C(O)NH2, v=0
   78948.7130  0.0215 -6.8638 3 1188.7429167  71510 303833845      823944        syn-C2H3C(O)NH2, v=0
   78948.7130  0.0215 -6.8638 3 1188.7429167  71510 303833846      823943        syn-C2H3C(O)NH2, v=0
   78960.7601  0.0154 -7.0817 3  843.5397159  71510 303791564      801467        syn-C2H3C(O)NH2, v=0
   78965.7193  0.0032 -6.2691 3  224.8370 83  71510 30341 734      42 637        syn-C2H3C(O)NH2, v=0
   78983.5318  0.0154 -7.0815 3  843.5397159  71510 303791664      801367        syn-C2H3C(O)NH2, v=0
   79000.1207  0.0021 -5.9079 3  426.2336 87  71510 303432914      442817        syn-C2H3C(O)NH2, v=0
   79000.1207  0.0021 -5.9079 3  426.2336 87  71510 303432915      442816        syn-C2H3C(O)NH2, v=0
   79011.5364  0.0119 -6.5103 3  831.3978125  71510 303623923      633826        syn-C2H3C(O)NH2, v=0
   79011.5364  0.0119 -6.5103 3  831.3978125  71510 303623924      633825        syn-C2H3C(O)NH2, v=0
   79064.4913  0.0007 -7.5942 3   45.4621 37  71510 30318 514      18 315        syn-C2H3C(O)NH2, v=0
   79081.4911  0.0020 -5.9216 3  135.4872 45  71510 3032218 4      2317 7        syn-C2H3C(O)NH2, v=0
   79081.4911  0.0020 -5.9216 3  135.4872 45  71510 3032218 5      2317 6        syn-C2H3C(O)NH2, v=0
   79154.2388  0.0013 -4.3044 3   50.1456 39  71510 30319 515      19 416        syn-C2H3C(O)NH2, v=0
   79196.8269  0.0032 -6.2666 3  224.8370 83  71510 30341 834      42 537        syn-C2H3C(O)NH2, v=0
   79201.7321  0.0012 -5.1662 3  269.1219 83  71510 303411626      401723        syn-C2H3C(O)NH2, v=0
   79202.9846  0.0012 -5.1662 3  269.1219 83  71510 303411625      401724        syn-C2H3C(O)NH2, v=0
   79220.9771  0.0017 -4.5560 3   32.0983 33  71510 30316 214      16 115        syn-C2H3C(O)NH2, v=0
   79230.1249  0.0030 -5.9096 3  691.0869129  71510 303642836      632935        syn-C2H3C(O)NH2, v=0
   79230.1249  0.0030 -5.9096 3  691.0869129  71510 303642837      632934        syn-C2H3C(O)NH2, v=0
   79369.5868  0.0019 -4.9455 3   92.8842 51  71510 30325 817      24 916        syn-C2H3C(O)NH2, v=0
   79388.8578  0.0519 -7.3586 3 1308.5840159  71510 303794831      804734        syn-C2H3C(O)NH2, v=0
   79388.8578  0.0519 -7.3586 3 1308.5840159  71510 303794832      804733        syn-C2H3C(O)NH2, v=0
   79408.1671  0.0219 -6.7630 3  834.1156157  71510 303781762      771859        syn-C2H3C(O)NH2, v=0
   79591.2941  0.0013 -4.9482 3   83.1581 49  71510 30324 718      23 815        syn-C2H3C(O)NH2, v=0
   79592.7452  0.0043 -5.3830 3  131.7542 63  71510 30331 725      30 822        syn-C2H3C(O)NH2, v=0
   79644.6629  0.0022 -7.3224 3   21.9732 23  71510 30311 6 6      12 3 9        syn-C2H3C(O)NH2, v=0
   79719.7890  0.0019 -6.0121 3  116.7298 41  71510 3032017 3      2116 6        syn-C2H3C(O)NH2, v=0
   79719.7890  0.0019 -6.0121 3  116.7298 41  71510 3032017 4      2116 5        syn-C2H3C(O)NH2, v=0
   79729.8502  0.0006 -6.4187 3   15.5495 23  71510 30311 3 9      10 3 8        syn-C2H3C(O)NH2, v=0
   79730.1697  0.0034 -6.7630 3   59.0510 39  71510 30319 812      20 515        syn-C2H3C(O)NH2, v=0
   79734.2771  0.0021 -5.8664 3  392.0719 83  71510 303412813      422716        syn-C2H3C(O)NH2, v=0
   79734.2771  0.0021 -5.8664 3  392.0719 83  71510 303412814      422715        syn-C2H3C(O)NH2, v=0
   79766.3457  0.0257 -6.9691 3 1247.9289171  71510 303853946      844045        syn-C2H3C(O)NH2, v=0
   79766.3457  0.0257 -6.9691 3 1247.9289171  71510 303853947      844044        syn-C2H3C(O)NH2, v=0
   79800.7983  0.0097 -6.4237 3  783.3393121  71510 303603822      613725        syn-C2H3C(O)NH2, v=0
   79800.7983  0.0097 -6.4237 3  783.3393121  71510 303603823      613724        syn-C2H3C(O)NH2, v=0
   79809.9625  0.0012 -5.2041 3  297.6625 87  71510 303431727      421824        syn-C2H3C(O)NH2, v=0
   79810.3658  0.0012 -5.2041 3  297.6625 87  71510 303431726      421825        syn-C2H3C(O)NH2, v=0
   79813.5439  0.0063 -6.4698 3  667.6390139  71510 303691653      681950        syn-C2H3C(O)NH2, v=0
   79996.7914  0.0036 -5.9847 3  736.4357133  71510 303662937      653036        syn-C2H3C(O)NH2, v=0
   79996.7914  0.0036 -5.9847 3  736.4357133  71510 303662938      653035        syn-C2H3C(O)NH2, v=0
   80036.7319  0.0034 -7.4426 3  126.8078 61  71510 30330 723      30 724        syn-C2H3C(O)NH2, v=0
   80041.8324  0.0033 -6.5078 3  485.2825121  71510 303601149      611052        syn-C2H3C(O)NH2, v=0
   80088.3273  0.0023 -4.9095 3   46.1714 37  71510 30318 513      17 612        syn-C2H3C(O)NH2, v=0
   80118.5378  0.0033 -6.5070 3  485.2825121  71510 303601249      61 952        syn-C2H3C(O)NH2, v=0
   80223.3678  0.0451 -7.2398 3 1248.1404155  71510 303774730      784633        syn-C2H3C(O)NH2, v=0
   80223.3678  0.0451 -7.2398 3 1248.1404155  71510 303774731      784632        syn-C2H3C(O)NH2, v=0
   80276.3282  0.0014 -4.1131 3  174.8782 71  71510 30335 926      35 827        syn-C2H3C(O)NH2, v=0
   80304.5185  0.0015 -4.5450 3   32.1003 33  71510 30316 314      16 215        syn-C2H3C(O)NH2, v=0
   80305.6167  0.0258 -7.2615 3  953.3931169  71510 303841668      851571        syn-C2H3C(O)NH2, v=0
   80320.1757  0.0258 -7.2613 3  953.3931169  71510 303841768      851471        syn-C2H3C(O)NH2, v=0
   80338.0136  0.0006 -7.1800 3   37.0151 23  71510 3031110 1      1010 0        syn-C2H3C(O)NH2, v=0
   80338.0136  0.0006 -7.1800 3   37.0151 23  71510 3031110 2      1010 1        syn-C2H3C(O)NH2, v=0
   80342.5895  0.0018 -6.1475 3   99.4195 37  71510 3031816 2      1915 5        syn-C2H3C(O)NH2, v=0
   80342.5895  0.0018 -6.1475 3   99.4195 37  71510 3031816 3      1915 4        syn-C2H3C(O)NH2, v=0
   80419.4118  0.0006 -6.8900 3   32.5289 23  71510 30311 9 3      10 9 2        syn-C2H3C(O)NH2, v=0
   80419.4119  0.0006 -6.8900 3   32.5289 23  71510 30311 9 2      10 9 1        syn-C2H3C(O)NH2, v=0
   80424.4627  0.0028 -6.9726 3   38.2692 31  71510 30315 7 9      16 412        syn-C2H3C(O)NH2, v=0
   80442.2637  0.0012 -5.2453 3  327.6482 91  71510 303451828      441925        syn-C2H3C(O)NH2, v=0
   80442.3921  0.0012 -5.2453 3  327.6482 91  71510 303451827      441926        syn-C2H3C(O)NH2, v=0
   80461.1049  0.0021 -5.8313 3  359.3526 79  71510 303392712      402615        syn-C2H3C(O)NH2, v=0
   80461.1049  0.0021 -5.8313 3  359.3526 79  71510 303392713      402614        syn-C2H3C(O)NH2, v=0
   80503.5317  0.0043 -6.6134 3   67.6842 47  71510 30323 320      24 223        syn-C2H3C(O)NH2, v=0
   80533.1793  0.0006 -6.7266 3   28.5179 23  71510 30311 8 4      10 8 3        syn-C2H3C(O)NH2, v=0
   80533.1847  0.0006 -6.7266 3   28.5179 23  71510 30311 8 3      10 8 2        syn-C2H3C(O)NH2, v=0
   80534.2392  0.0008 -4.2345 3   57.6990 41  71510 30320 615      20 516        syn-C2H3C(O)NH2, v=0
   80538.6743  0.0011 -4.2449 3   55.6569 39  71510 30319 712      19 613        syn-C2H3C(O)NH2, v=0
   80553.7653  0.0041 -6.3164 3  135.1103 65  71510 30332 527      33 430        syn-C2H3C(O)NH2, v=0
   80584.2810  0.0079 -6.3414 3  736.7158117  71510 303583721      593624        syn-C2H3C(O)NH2, v=0
   80584.2810  0.0079 -6.3414 3  736.7158117  71510 303583722      593623        syn-C2H3C(O)NH2, v=0
   80587.8971  0.0303 -7.0776 3 1308.5416175  71510 303874047      864146        syn-C2H3C(O)NH2, v=0
   80587.8971  0.0303 -7.0776 3 1308.5416175  71510 303874048      864145        syn-C2H3C(O)NH2, v=0
   80700.2908  0.0006 -6.6160 3   24.9837 23  71510 30311 7 5      10 7 4        syn-C2H3C(O)NH2, v=0
   80700.5931  0.0006 -6.6160 3   24.9837 23  71510 30311 7 4      10 7 3        syn-C2H3C(O)NH2, v=0
   80768.5096  0.0045 -6.0632 3  783.2210137  71510 303683038      673137        syn-C2H3C(O)NH2, v=0
   80768.5096  0.0045 -6.0632 3  783.2210137  71510 303683039      673136        syn-C2H3C(O)NH2, v=0
   80796.5498  0.0043 -6.6104 3   67.6842 47  71510 30323 420      24 123        syn-C2H3C(O)NH2, v=0
   80832.4936  0.0041 -6.3135 3  135.1102 65  71510 30332 627      33 330        syn-C2H3C(O)NH2, v=0
   80845.7700  0.0016 -4.1513 3   92.8349 51  71510 30325 817      25 718        syn-C2H3C(O)NH2, v=0
   80929.6704  0.0200 -4.3083 3   16.4402 25 -71510 30312 111      11 210        syn-C2H3C(O)NH2, v=0
   80948.0969  0.0018 -6.3606 3   83.5566 33  71510 3031615 1      1714 4        syn-C2H3C(O)NH2, v=0
   80948.0969  0.0018 -6.3606 3   83.5566 33  71510 3031615 2      1714 3        syn-C2H3C(O)NH2, v=0
   80958.8562  0.0007 -6.5348 3   21.9294 23  71510 30311 6 6      10 6 5        syn-C2H3C(O)NH2, v=0
   80969.0886  0.0007 -6.5347 3   21.9295 23  71510 30311 6 5      10 6 4        syn-C2H3C(O)NH2, v=0
   81052.3297  0.0390 -7.1246 3 1189.1227151  71510 303754629      764532        syn-C2H3C(O)NH2, v=0
   81052.3297  0.0390 -7.1246 3 1189.1227151  71510 303754630      764531        syn-C2H3C(O)NH2, v=0
   81075.3994  0.0005 -4.7477 3    6.2638 15  71510 303 7 3 5       6 2 4        syn-C2H3C(O)NH2, v=0
   81094.6089  0.0200 -5.2899 3  359.0783 95 -71510 303471929      462026        syn-C2H3C(O)NH2, v=0
   81094.6089  0.0200 -5.2899 3  359.0783 95 -71510 303471928      462027        syn-C2H3C(O)NH2, v=0
   81106.4945  0.0050 -5.6312 3  230.2171 83  71510 30341 933      401030        syn-C2H3C(O)NH2, v=0
   81180.2303  0.0021 -5.8030 3  328.0763 75  71510 303372611      382514        syn-C2H3C(O)NH2, v=0
   81180.2303  0.0021 -5.8030 3  328.0763 75  71510 303372612      382513        syn-C2H3C(O)NH2, v=0
   81238.8588  0.0058 -5.9809 3  414.6919111  71510 303551244      541341        syn-C2H3C(O)NH2, v=0
   81251.5740  0.0027 -6.2809 3  283.4847 93  71510 30346 838      47 741        syn-C2H3C(O)NH2, v=0
   81327.2030  0.0007 -6.4728 3   19.3600 23  71510 30311 5 7      10 5 6        syn-C2H3C(O)NH2, v=0
   81342.1598  0.0012 -6.1963 3    6.3279 15  71510 303 7 3 4       7 0 7        syn-C2H3C(O)NH2, v=0
   81361.8823  0.0063 -6.2634 3  691.5280113  71510 303563620      573523        syn-C2H3C(O)NH2, v=0
   81361.8823  0.0063 -6.2634 3  691.5280113  71510 303563621      573522        syn-C2H3C(O)NH2, v=0
   81367.3146  0.0063 -6.7918 3  481.9447115  71510 303571840      581543        syn-C2H3C(O)NH2, v=0
   81394.7210  0.0006 -6.4295 3   17.2682 23  71510 30311 4 8      10 4 7        syn-C2H3C(O)NH2, v=0
   81407.0640  0.0027 -6.2792 3  283.4847 93  71510 30346 938      47 641        syn-C2H3C(O)NH2, v=0
   81413.3869  0.0356 -7.1893 3 1370.5800179  71510 303894148      884247        syn-C2H3C(O)NH2, v=0
   81413.3869  0.0356 -7.1893 3 1370.5800179  71510 303894149      884246        syn-C2H3C(O)NH2, v=0
   81424.7308  0.0023 -7.4656 3   59.8544 43  71510 30321 417      21 418        syn-C2H3C(O)NH2, v=0
   81511.7908  0.0052 -6.3292 3  626.1040135  71510 303671552      661849        syn-C2H3C(O)NH2, v=0
   81527.3802  0.0007 -6.4707 3   19.3642 23  71510 30311 5 6      10 5 5        syn-C2H3C(O)NH2, v=0
   81534.2203  0.0017 -6.7471 3   69.1413 29  71510 3031414 0      1513 3        syn-C2H3C(O)NH2, v=0
   81534.2203  0.0017 -6.7471 3   69.1413 29  71510 3031414 1      1513 2        syn-C2H3C(O)NH2, v=0
   81545.0763  0.0056 -6.1449 3  831.4419141  71510 303703139      693238        syn-C2H3C(O)NH2, v=0
   81545.0763  0.0056 -6.1449 3  831.4419141  71510 303703140      693237        syn-C2H3C(O)NH2, v=0
   81568.3831  0.0408 -7.4586 3 1069.9218179  71510 303891772      901675        syn-C2H3C(O)NH2, v=0
   81577.6667  0.0408 -7.4585 3 1069.9218179  71510 303891872      901575        syn-C2H3C(O)NH2, v=0
   81579.0373  0.0064 -6.3777 3  660.4890139  71510 303691554      681851        syn-C2H3C(O)NH2, v=0
   81661.4292  0.0007 -6.3448 3   16.4402 25  71510 30312 211      11 210        syn-C2H3C(O)NH2, v=0
   81683.0331  0.0005 -4.8149 3    4.5608 13  71510 303 6 3 3       5 2 4        syn-C2H3C(O)NH2, v=0
   81735.0982  0.0009 -5.3904 3    3.5374 13  71510 303 6 2 4       5 1 5        syn-C2H3C(O)NH2, v=0
   81746.0816  0.0010 -7.5216 3   50.0592 39  71510 30319 515      19 316        syn-C2H3C(O)NH2, v=0
   81763.7952  0.0200 -5.3377 3  391.9522 99 -71510 303492030      482127        syn-C2H3C(O)NH2, v=0
   81763.7952  0.0200 -5.3377 3  391.9522 99 -71510 303492029      482128        syn-C2H3C(O)NH2, v=0
   81770.5882  0.0040 -6.6151 3  569.5779131  71510 303651253      661156        syn-C2H3C(O)NH2, v=0
   81811.8620  0.0200 -4.1289 3   16.9551 27 -71510 30313 013      12 112        syn-C2H3C(O)NH2, v=0
   81820.4219  0.0040 -6.6146 3  569.5778131  71510 303651353      661056        syn-C2H3C(O)NH2, v=0
   81823.1778  0.0007 -6.2964 3   16.9551 27  71510 30313 113      12 112        syn-C2H3C(O)NH2, v=0
   81834.7739  0.0007 -6.2962 3   16.9543 27  71510 30313 013      12 012        syn-C2H3C(O)NH2, v=0
   81846.0687  0.0200 -4.1285 3   16.9543 27 -71510 30313 113      12 012        syn-C2H3C(O)NH2, v=0
   81875.7201  0.0336 -7.0133 3 1131.5322147  71510 303734528      744431        syn-C2H3C(O)NH2, v=0
   81875.7201  0.0336 -7.0133 3 1131.5322147  71510 303734529      744430        syn-C2H3C(O)NH2, v=0
   81891.2221  0.0022 -5.7822 3  298.2435 71  71510 303352510      362413        syn-C2H3C(O)NH2, v=0
   81891.2221  0.0022 -5.7822 3  298.2435 71  71510 303352511      362412        syn-C2H3C(O)NH2, v=0
   81901.6316  0.0200 -4.1017 3  196.7240 75 -71510 303371027      37 928        syn-C2H3C(O)NH2, v=0
   81996.5660  0.0015 -4.3751 3   42.8669 37  71510 30318 415      18 316        syn-C2H3C(O)NH2, v=0
   82133.4831  0.0051 -6.1899 3  647.7769109  71510 303543519      553422        syn-C2H3C(O)NH2, v=0
   82133.4831  0.0051 -6.1899 3  647.7769109  71510 303543520      553421        syn-C2H3C(O)NH2, v=0
   82216.0962  0.0007 -6.3382 3   16.3973 25  71510 30312 111      11 110        syn-C2H3C(O)NH2, v=0
   82242.8405  0.0416 -7.3041 3 1434.0427183  71510 303914249      904348        syn-C2H3C(O)NH2, v=0
   82242.8405  0.0416 -7.3041 3 1434.0427183  71510 303914250      904347        syn-C2H3C(O)NH2, v=0
   82286.6117  0.0048 -5.4835 3  177.5560 73  71510 30336 829      35 926        syn-C2H3C(O)NH2, v=0
   82326.3271  0.0069 -6.2298 3  881.0976145  71510 303723240      713339        syn-C2H3C(O)NH2, v=0
   82326.3271  0.0069 -6.2298 3  881.0976145  71510 303723241      713338        syn-C2H3C(O)NH2, v=0
   82332.9301  0.0022 -4.2742 3   59.8241 43  71510 30321 417      21 318        syn-C2H3C(O)NH2, v=0
   82362.3005  0.0015 -7.5207 3   42.8547 37  71510 30318 415      18 216        syn-C2H3C(O)NH2, v=0
   82447.4149  0.0200 -5.3889 3  426.2692103 -71510 303512131      502228        syn-C2H3C(O)NH2, v=0
   82447.4149  0.0200 -5.3889 3  426.2692103 -71510 303512130      502229        syn-C2H3C(O)NH2, v=0
   82593.5837  0.0022 -5.7699 3  269.8548 67  71510 3033324 9      342312        syn-C2H3C(O)NH2, v=0
   82593.5837  0.0022 -5.7699 3  269.8548 67  71510 303332410      342311        syn-C2H3C(O)NH2, v=0
   82608.5776  0.0031 -7.4149 3  101.8325 55  71510 30327 621      27 622        syn-C2H3C(O)NH2, v=0
   82693.5091  0.0287 -6.9057 3 1075.3698143  71510 303714427      724330        syn-C2H3C(O)NH2, v=0
   82693.5091  0.0287 -6.9057 3 1075.3698143  71510 303714428      724329        syn-C2H3C(O)NH2, v=0
   82706.2139  0.0041 -6.9810 3   44.4504 39  71510 30319 217      20 120        syn-C2H3C(O)NH2, v=0
   82779.2236  0.0119 -6.5818 3  776.9164151  71510 303751659      741956        syn-C2H3C(O)NH2, v=0
   82811.2068  0.0057 -6.3349 3  643.1703137  71510 303681553      671850        syn-C2H3C(O)NH2, v=0
   82847.6826  0.0200 -4.0923 3  187.0210 73 -71510 303361026      36 927        syn-C2H3C(O)NH2, v=0
   82898.9458  0.0041 -6.1210 3  605.4634105  71510 303523418      533321        syn-C2H3C(O)NH2, v=0
   82898.9458  0.0041 -6.1210 3  605.4634105  71510 303523419      533320        syn-C2H3C(O)NH2, v=0
   82907.1887  0.0041 -6.9791 3   44.4504 39  71510 30319 317      20 020        syn-C2H3C(O)NH2, v=0
   82947.8374  0.0200 -4.2846 3   16.3973 25 -71510 30312 211      11 110        syn-C2H3C(O)NH2, v=0
   82979.7808  0.0022 -4.8960 3   77.3698 47  71510 30323 716      22 815        syn-C2H3C(O)NH2, v=0
   83006.0499  0.0014 -4.9017 3   99.1343 53  71510 30326 819      25 916        syn-C2H3C(O)NH2, v=0
   83071.7896  0.0027 -7.4202 3   79.5125 49  71510 30324 519      24 520        syn-C2H3C(O)NH2, v=0
   83076.2877  0.0483 -7.4222 3 1498.9286187  71510 303934350      924449        syn-C2H3C(O)NH2, v=0
   83076.2877  0.0483 -7.4222 3 1498.9286187  71510 303934351      924448        syn-C2H3C(O)NH2, v=0
   83112.1294  0.0086 -6.3181 3  932.1871149  71510 303743341      733440        syn-C2H3C(O)NH2, v=0
   83112.1294  0.0086 -6.3181 3  932.1871149  71510 303743342      733439        syn-C2H3C(O)NH2, v=0
   83143.5288  0.0200 -5.4434 3  462.0288107 -71510 303532232      522329        syn-C2H3C(O)NH2, v=0
   83143.5288  0.0200 -5.4434 3  462.0288107 -71510 303532231      522330        syn-C2H3C(O)NH2, v=0
   83170.8503  0.0515 -7.1009 3 1037.6586175  71510 303871969      862066        syn-C2H3C(O)NH2, v=0
   83286.7413  0.0022 -5.7673 3  242.9107 63  71510 3033123 8      322211        syn-C2H3C(O)NH2, v=0
   83286.7413  0.0022 -5.7673 3  242.9107 63  71510 3033123 9      322210        syn-C2H3C(O)NH2, v=0
   83320.0256  0.0007 -6.4087 3   17.3335 23  71510 30311 4 7      10 4 6        syn-C2H3C(O)NH2, v=0
   83326.7628  0.0037 -6.2538 3  181.5114 75  71510 30337 631      38 534        syn-C2H3C(O)NH2, v=0
   83381.1173  0.0026 -6.3214 3  348.8553103  71510 30351 942      52 845        syn-C2H3C(O)NH2, v=0
   83403.1712  0.0058 -6.7425 3  660.5748141  71510 303701357      711260        syn-C2H3C(O)NH2, v=0
   83435.3775  0.0058 -6.7422 3  660.5748141  71510 303701457      711160        syn-C2H3C(O)NH2, v=0
   83456.6295  0.0040 -6.4988 3  219.6943 77  71510 303381326      391029        syn-C2H3C(O)NH2, v=0
   83484.5022  0.0026 -6.3203 3  348.8552103  71510 303511042      52 745        syn-C2H3C(O)NH2, v=0
   83505.6591  0.0244 -6.8020 3 1020.6367139  71510 303694326      704229        syn-C2H3C(O)NH2, v=0
   83505.6591  0.0244 -6.8020 3 1020.6367139  71510 303694327      704228        syn-C2H3C(O)NH2, v=0
   83515.3330  0.0010 -4.1999 3   62.8329 43  71510 30321 616      21 517        syn-C2H3C(O)NH2, v=0
   83521.1633  0.0036 -6.2518 3  181.5114 75  71510 30337 731      38 434        syn-C2H3C(O)NH2, v=0
   83525.7879  0.0006 -6.3629 3   15.0568 23  71510 30311 2 9      10 2 8        syn-C2H3C(O)NH2, v=0
   83601.3667  0.0016 -4.0939 3  131.7542 61  71510 30330 921      30 822        syn-C2H3C(O)NH2, v=0
   83654.1321  0.0200 -4.2410 3   50.8090 37 -71510 30318 711      18 612        syn-C2H3C(O)NH2, v=0
   83658.1113  0.0033 -6.0569 3  564.5881101  71510 303503317      513220        syn-C2H3C(O)NH2, v=0
   83658.1113  0.0033 -6.0569 3  564.5881101  71510 303503318      513219        syn-C2H3C(O)NH2, v=0
   83722.4005  0.0200 -4.0946 3  206.6398 77 -71510 303381028      38 929        syn-C2H3C(O)NH2, v=0
   83728.3789  0.0034 -7.4536 3  193.9311 75  71510 30337 928      37 929        syn-C2H3C(O)NH2, v=0
   83812.1479  0.0070 -6.2124 3  561.9055129  71510 303641451      631548        syn-C2H3C(O)NH2, v=0
   83850.6266  0.0017 -5.5012 3  499.2302111  71510 303552333      542430        syn-C2H3C(O)NH2, v=0
   83850.6270  0.0017 -5.5012 3  499.2302111  71510 303552332      542431        syn-C2H3C(O)NH2, v=0
   83902.3774  0.0106 -6.4095 3  984.7094153  71510 303763442      753541        syn-C2H3C(O)NH2, v=0
   83902.3774  0.0106 -6.4095 3  984.7094153  71510 303763443      753540        syn-C2H3C(O)NH2, v=0
   83913.7627  0.0558 -7.5434 3 1565.2365191  71510 303954451      944550        syn-C2H3C(O)NH2, v=0
   83913.7627  0.0558 -7.5434 3 1565.2365191  71510 303954452      944549        syn-C2H3C(O)NH2, v=0
   83970.0325  0.0021 -5.7758 3  217.4117 59  71510 3032922 7      302110        syn-C2H3C(O)NH2, v=0
   83970.0325  0.0021 -5.7758 3  217.4117 59  71510 3032922 8      3021 9        syn-C2H3C(O)NH2, v=0
   83995.2575  0.0014 -4.2576 3   54.8972 41  71510 30320 516      20 417        syn-C2H3C(O)NH2, v=0
   84053.4609  0.0044 -6.4022 3  101.8157 57  71510 30328 424      29 327        syn-C2H3C(O)NH2, v=0
   84168.8430  0.0034 -7.5402 3  275.0832 89  71510 303441133      441134        syn-C2H3C(O)NH2, v=0
   84194.3303  0.0016 -4.7885 3   25.7496 31  71510 30315 114      15 015        syn-C2H3C(O)NH2, v=0
   84239.8198  0.0230 -6.8837 3  878.4480159  71510 303791960      782257        syn-C2H3C(O)NH2, v=0
   84273.1551  0.0043 -6.4001 3  101.8157 57  71510 30328 524      29 227        syn-C2H3C(O)NH2, v=0
   84296.6636  0.0020 -4.7879 3   35.4573 33  71510 30316 412      15 511        syn-C2H3C(O)NH2, v=0
   84308.1386  0.0016 -4.7874 3   25.7497 31  71510 30315 214      15 115        syn-C2H3C(O)NH2, v=0
   84312.1243  0.0206 -6.7021 3  967.3339135  71510 303674225      684128        syn-C2H3C(O)NH2, v=0
   84312.1243  0.0206 -6.7021 3  967.3339135  71510 303674226      684127        syn-C2H3C(O)NH2, v=0
   84410.7967  0.0028 -5.9979 3  525.1519 97  71510 303483216      493119        syn-C2H3C(O)NH2, v=0
   84410.7967  0.0028 -5.9979 3  525.1519 97  71510 303483217      493118        syn-C2H3C(O)NH2, v=0
   84492.9258  0.0015 -4.6606 3   26.1464 29  71510 30314 311      13 410        syn-C2H3C(O)NH2, v=0
   84567.4411  0.0200 -5.5624 3  537.8726115 -71510 303572434      562531        syn-C2H3C(O)NH2, v=0
   84567.4411  0.0200 -5.5624 3  537.8726115 -71510 303572433      562532        syn-C2H3C(O)NH2, v=0
   84610.9695  0.0200 -4.8926 3  116.5731 57 -71510 30328 920      271017        syn-C2H3C(O)NH2, v=0
   84642.6909  0.0021 -5.7979 3  193.3581 55  71510 3032721 6      2820 9        syn-C2H3C(O)NH2, v=0
   84642.6909  0.0021 -5.7979 3  193.3581 55  71510 3032721 7      2820 8        syn-C2H3C(O)NH2, v=0
   84696.9881  0.0130 -6.5042 3 1038.6635157  71510 303783543      773642        syn-C2H3C(O)NH2, v=0
   84696.9881  0.0130 -6.5042 3 1038.6635157  71510 303783544      773641        syn-C2H3C(O)NH2, v=0
   84734.8686  0.0195 -7.2091 3  760.8106145  71510 303722251      731954        syn-C2H3C(O)NH2, v=0
   84944.8004  0.0098 -6.8891 3  758.2672151  71510 303751461      761364        syn-C2H3C(O)NH2, v=0
   84965.5235  0.0098 -6.8888 3  758.2672151  71510 303751561      761264        syn-C2H3C(O)NH2, v=0
   85021.4683  0.0025 -4.1837 3   79.4475 49  71510 30324 519      24 420        syn-C2H3C(O)NH2, v=0
   85112.8496  0.0173 -6.6063 3  915.4625131  71510 303654124      664027        syn-C2H3C(O)NH2, v=0
   85112.8496  0.0173 -6.6063 3  915.4625131  71510 303654125      664026        syn-C2H3C(O)NH2, v=0
   85156.7921  0.0024 -5.9441 3  487.1555 93  71510 303463115      473018        syn-C2H3C(O)NH2, v=0
   85156.7921  0.0024 -5.9441 3  487.1555 93  71510 303463116      473017        syn-C2H3C(O)NH2, v=0
   85162.3953  0.0005 -4.6770 3    8.0837 17  71510 303 8 3 6       7 2 5        syn-C2H3C(O)NH2, v=0
   85239.4028  0.0019 -7.4825 3   47.2159 39  71510 30319 316      19 317        syn-C2H3C(O)NH2, v=0
   85293.0201  0.0021 -5.6268 3  577.9555119  71510 303592534      582633        syn-C2H3C(O)NH2, v=0
   85293.0201  0.0021 -5.6268 3  577.9555119  71510 303592535      582632        syn-C2H3C(O)NH2, v=0
   85303.8296  0.0021 -5.8367 3  170.7505 51  71510 3032520 5      2619 8        syn-C2H3C(O)NH2, v=0
   85303.8296  0.0021 -5.8367 3  170.7505 51  71510 3032520 6      2619 7        syn-C2H3C(O)NH2, v=0
   85359.9917  0.0200 -4.9017 3  135.4671 61 -71510 303301021      291118        syn-C2H3C(O)NH2, v=0
   85376.4771  0.0029 -6.3873 3  420.9436113  71510 303561046      57 949        syn-C2H3C(O)NH2, v=0
   85427.3826  0.0675 -7.5027 3 1413.2732165  71510 303825032      834935        syn-C2H3C(O)NH2, v=0
   85427.3826  0.0675 -7.5027 3 1413.2732165  71510 303825033      834934        syn-C2H3C(O)NH2, v=0
   85440.3118  0.0019 -4.3454 3   47.2092 39  71510 30319 316      19 217        syn-C2H3C(O)NH2, v=0
   85444.5728  0.0029 -6.3866 3  420.9436113  71510 303561146      57 849        syn-C2H3C(O)NH2, v=0
   85495.8977  0.0158 -6.6021 3 1094.0484161  71510 303803644      793743        syn-C2H3C(O)NH2, v=0
   85495.8977  0.0158 -6.6021 3 1094.0484161  71510 303803645      793742        syn-C2H3C(O)NH2, v=0
   85548.6566  0.0012 -7.4548 3   54.8454 41  71510 30320 516      20 317        syn-C2H3C(O)NH2, v=0
   85549.6331  0.0549 -7.2236 3 1042.1650173  71510 303862165      852462        syn-C2H3C(O)NH2, v=0
   85714.9725  0.0017 -4.4953 3   35.8400 35  71510 30317 215      17 116        syn-C2H3C(O)NH2, v=0
   85730.6607  0.0204 -6.7496 3  882.5109161  71510 303801763      792060        syn-C2H3C(O)NH2, v=0
   85782.1637  0.0014 -4.9200 3  155.8126 65  71510 303321122      311219        syn-C2H3C(O)NH2, v=0
   85865.2537  0.0031 -6.2339 3  234.6453 85  71510 30342 735      43 638        syn-C2H3C(O)NH2, v=0
   85895.8564  0.0023 -5.8958 3  450.5997 89  71510 303443014      452917        syn-C2H3C(O)NH2, v=0
   85895.8564  0.0023 -5.8958 3  450.5997 89  71510 303443015      452916        syn-C2H3C(O)NH2, v=0
   85907.7696  0.0144 -6.5145 3  865.0235127  71510 303634023      643926        syn-C2H3C(O)NH2, v=0
   85907.7696  0.0144 -6.5145 3  865.0235127  71510 303634024      643925        syn-C2H3C(O)NH2, v=0
   85917.9389  0.0013 -4.8908 3   89.2012 51  71510 30325 719      24 816        syn-C2H3C(O)NH2, v=0
   85931.1841  0.0007 -6.3487 3   15.9775 23  71510 30311 3 8      10 3 7        syn-C2H3C(O)NH2, v=0
   85952.4206  0.0020 -5.8973 3  149.5892 47  71510 3032319 4      2418 7        syn-C2H3C(O)NH2, v=0
   85952.4206  0.0020 -5.8973 3  149.5892 47  71510 3032319 5      2418 6        syn-C2H3C(O)NH2, v=0
   85955.8326  0.0006 -7.5808 3    0.7205  7  71510 303 3 3 1       2 0 2        syn-C2H3C(O)NH2, v=0
   85980.3622  0.0015 -4.1234 3   86.3332 49  71510 30324 816      24 717        syn-C2H3C(O)NH2, v=0
   85993.3518  0.0200 -4.2470 3   46.2542 35 -71510 30317 710      17 611        syn-C2H3C(O)NH2, v=0
   85998.1331  0.0031 -6.2326 3  234.6453 85  71510 30342 835      43 538        syn-C2H3C(O)NH2, v=0
   86012.9701  0.0200 -4.5898 3    4.5664 11 -71510 303 5 4 2       4 3 1        syn-C2H3C(O)NH2, v=0
   86026.5414  0.0023 -5.6945 3  619.4779123  71510 303612635      602734        syn-C2H3C(O)NH2, v=0
   86026.5414  0.0023 -5.6945 3  619.4779123  71510 303612636      602733        syn-C2H3C(O)NH2, v=0
   86060.9864  0.0134 -6.4940 3  731.2627147  71510 303731658      721755        syn-C2H3C(O)NH2, v=0
   86100.6074  0.0005 -4.5892 3    4.5637 11  71510 303 5 4 1       4 3 2        syn-C2H3C(O)NH2, v=0
   86127.2725  0.0200 -4.9439 3  177.6076 69 -71510 303341223      331320        syn-C2H3C(O)NH2, v=0
   86188.8972  0.0200 -4.0687 3  177.5560 71 -71510 303351025      35 926        syn-C2H3C(O)NH2, v=0
   86268.9159  0.0592 -7.3791 3 1350.4650161  71510 303804931      814834        syn-C2H3C(O)NH2, v=0
   86268.9159  0.0592 -7.3791 3 1350.4650161  71510 303804932      814833        syn-C2H3C(O)NH2, v=0
   86299.0586  0.0191 -6.7032 3 1150.8631165  71510 303823745      813844        syn-C2H3C(O)NH2, v=0
   86299.0586  0.0191 -6.7032 3 1150.8631165  71510 303823746      813843        syn-C2H3C(O)NH2, v=0
   86323.1642  0.0200 -4.9144 3  155.8118 65 -71510 303321121      311220        syn-C2H3C(O)NH2, v=0
   86324.6444  0.0200 -4.9418 3  177.6074 69 -71510 303341222      331321        syn-C2H3C(O)NH2, v=0
   86337.4092  0.0016 -4.4893 3   35.8411 35  71510 30317 315      17 216        syn-C2H3C(O)NH2, v=0
   86383.5946  0.0026 -4.1270 3  101.7066 55  71510 30327 621      27 522        syn-C2H3C(O)NH2, v=0
   86398.7497  0.0170 -7.0540 3  862.6483161  71510 303801565      811468        syn-C2H3C(O)NH2, v=0
   86412.0351  0.0170 -7.0538 3  862.6483161  71510 303801665      811368        syn-C2H3C(O)NH2, v=0
   86456.4995  0.0006 -6.3118 3   18.2090 25  71510 30312 310      11 3 9        syn-C2H3C(O)NH2, v=0
   86493.7901  0.0200 -4.9717 3  200.8511 73 -71510 303361324      351421        syn-C2H3C(O)NH2, v=0
   86563.5039  0.0200 -4.9709 3  200.8510 73 -71510 303361323      351422        syn-C2H3C(O)NH2, v=0
   86587.2731  0.0020 -5.9881 3  129.8744 43  71510 3032118 3      2217 6        syn-C2H3C(O)NH2, v=0
   86587.2731  0.0020 -5.9881 3  129.8744 43  71510 3032118 4      2217 5        syn-C2H3C(O)NH2, v=0
   86627.7137  0.0022 -5.8535 3  415.4851 85  71510 303422913      432816        syn-C2H3C(O)NH2, v=0
   86627.7137  0.0022 -5.8535 3  415.4851 85  71510 303422914      432815        syn-C2H3C(O)NH2, v=0
   86696.8075  0.0119 -6.4269 3  816.0178123  71510 303613922      623825        syn-C2H3C(O)NH2, v=0
   86696.8075  0.0119 -6.4269 3  816.0178123  71510 303613923      623824        syn-C2H3C(O)NH2, v=0
   86767.3563  0.0027 -5.7654 3  662.4391127  71510 303632736      622835        syn-C2H3C(O)NH2, v=0
   86767.3563  0.0027 -5.7654 3  662.4391127  71510 303632737      622834        syn-C2H3C(O)NH2, v=0
   86781.8572  0.0024 -4.0784 3  154.0582 67  71510 30333 825      33 726        syn-C2H3C(O)NH2, v=0
   86782.1629  0.0026 -4.0944 3  126.5828 61  71510 30330 723      30 624        syn-C2H3C(O)NH2, v=0
   86784.7561  0.0016 -4.8865 3  135.4649 61  71510 303301020      291119        syn-C2H3C(O)NH2, v=0
   86892.9848  0.0044 -6.5821 3   73.0413 49  71510 30324 321      25 224        syn-C2H3C(O)NH2, v=0
   86910.5093  0.0200 -5.0028 3  225.5422 77 -71510 303381425      371522        syn-C2H3C(O)NH2, v=0
   86934.5282  0.0200 -5.0026 3  225.5421 77 -71510 303381424      371523        syn-C2H3C(O)NH2, v=0
   87055.4361  0.0044 -6.5805 3   73.0413 49  71510 30324 421      25 124        syn-C2H3C(O)NH2, v=0
   87078.2365  0.0020 -4.0725 3  184.1164 73  71510 30336 927      36 828        syn-C2H3C(O)NH2, v=0
   87104.7595  0.0517 -7.2592 3 1289.0808157  71510 303784830      794733        syn-C2H3C(O)NH2, v=0
   87104.7595  0.0517 -7.2592 3 1289.0808157  71510 303784831      794732        syn-C2H3C(O)NH2, v=0
   87106.4374  0.0228 -6.8075 3 1209.1064169  71510 303843846      833945        syn-C2H3C(O)NH2, v=0
   87106.4374  0.0228 -6.8075 3 1209.1064169  71510 303843847      833944        syn-C2H3C(O)NH2, v=0
   87199.3982  0.0012 -4.1638 3   68.1826 45  71510 30322 617      22 518        syn-C2H3C(O)NH2, v=0
   87206.8518  0.0041 -6.2831 3  142.6922 67  71510 30333 528      34 431        syn-C2H3C(O)NH2, v=0
   87207.0077  0.0019 -6.1242 3  111.6066 39  71510 3031917 2      2016 5        syn-C2H3C(O)NH2, v=0
   87207.0077  0.0019 -6.1242 3  111.6066 39  71510 3031917 3      2016 4        syn-C2H3C(O)NH2, v=0
   87253.3198  0.0034 -6.4761 3  499.7446123  71510 303611150      621053        syn-C2H3C(O)NH2, v=0
   87288.2905  0.0037 -5.1935 3  123.8962 61  71510 30330 724      29 821        syn-C2H3C(O)NH2, v=0
   87297.8305  0.0034 -6.4757 3  499.7445123  71510 303611250      62 953        syn-C2H3C(O)NH2, v=0
   87313.6783  0.0200 -4.1656 3   60.3853 41 -71510 30320 714      20 615        syn-C2H3C(O)NH2, v=0
   87352.0479  0.0022 -5.8175 3  381.8124 81  71510 303402812      412715        syn-C2H3C(O)NH2, v=0
   87352.0479  0.0022 -5.8175 3  381.8124 81  71510 303402813      412714        syn-C2H3C(O)NH2, v=0
   87364.8730  0.0041 -6.2816 3  142.6922 67  71510 30333 628      34 331        syn-C2H3C(O)NH2, v=0
   87369.1184  0.0200 -4.1849 3   55.3967 39 -71510 30319 713      19 614        syn-C2H3C(O)NH2, v=0
   87379.5109  0.0012 -5.0372 3  251.6801 81  71510 303401526      391623        syn-C2H3C(O)NH2, v=0
   87387.6414  0.0200 -5.0371 3  251.6801 81 -71510 303401525      391624        syn-C2H3C(O)NH2, v=0
   87405.3019  0.0200 -4.1926 3   19.1641 27 -71510 30313 112      12 211        syn-C2H3C(O)NH2, v=0
   87430.4556  0.0338 -6.9480 3  994.8195171  71510 303851867      842164        syn-C2H3C(O)NH2, v=0
   87479.8735  0.0097 -6.3435 3  768.4463119  71510 303593821      603724        syn-C2H3C(O)NH2, v=0
   87479.8735  0.0097 -6.3435 3  768.4463119  71510 303593822      603723        syn-C2H3C(O)NH2, v=0
   87492.8173  0.0054 -6.6628 3  418.5013107  71510 303531737      541440        syn-C2H3C(O)NH2, v=0
   87514.9267  0.0032 -5.8397 3  706.8384131  71510 303652837      642936        syn-C2H3C(O)NH2, v=0
   87514.9267  0.0032 -5.8397 3  706.8384131  71510 303652838      642935        syn-C2H3C(O)NH2, v=0
   87522.0620  0.0067 -6.3841 3  685.2110141  71510 303701654      691951        syn-C2H3C(O)NH2, v=0
   87524.7375  0.0021 -7.3293 3   19.1641 23  71510 30311 5 6      12 211        syn-C2H3C(O)NH2, v=0
   87631.8018  0.0007 -7.1190 3   44.6534 25  71510 3031211 1      1111 0        syn-C2H3C(O)NH2, v=0
   87631.8018  0.0007 -7.1190 3   44.6534 25  71510 3031211 2      1111 1        syn-C2H3C(O)NH2, v=0
   87658.7864  0.0018 -7.4347 3   16.4402 21  71510 30310 5 5      11 210        syn-C2H3C(O)NH2, v=0
   87675.6707  0.0042 -6.4744 3  177.5560 69  71510 303341223      35 926        syn-C2H3C(O)NH2, v=0
   87684.9552  0.0200 -4.1461 3   65.6187 43 -71510 30321 715      21 616        syn-C2H3C(O)NH2, v=0
   87693.6224  0.0200 -4.2624 3   41.9832 33 -71510 30316 7 9      16 610        syn-C2H3C(O)NH2, v=0
   87710.1174  0.0007 -6.8262 3   39.6949 25  71510 3031210 2      1110 1        syn-C2H3C(O)NH2, v=0
   87710.1174  0.0007 -6.8262 3   39.6949 25  71510 3031210 3      1110 2        syn-C2H3C(O)NH2, v=0
   87724.1801  0.0200 -4.2049 3   50.6575 37 -71510 30318 712      18 613        syn-C2H3C(O)NH2, v=0
   87766.8581  0.0280 -7.2367 3  973.7111171  71510 303851669      861572        syn-C2H3C(O)NH2, v=0
   87775.3490  0.0280 -7.2367 3  973.7111171  71510 303851769      861472        syn-C2H3C(O)NH2, v=0
   87810.0304  0.0019 -6.3384 3   94.7858 35  71510 3031716 1      1815 4        syn-C2H3C(O)NH2, v=0
   87810.0304  0.0019 -6.3384 3   94.7858 35  71510 3031716 2      1815 3        syn-C2H3C(O)NH2, v=0
   87810.2126  0.0007 -6.2514 3   19.1641 27  71510 30313 212      12 211        syn-C2H3C(O)NH2, v=0
   87815.5770  0.0007 -6.6599 3   35.2114 25  71510 30312 9 4      11 9 3        syn-C2H3C(O)NH2, v=0
   87815.5774  0.0007 -6.6599 3   35.2114 25  71510 30312 9 3      11 9 2        syn-C2H3C(O)NH2, v=0
   87831.2457  0.0016 -4.3233 3   47.2159 39  71510 30319 416      19 317        syn-C2H3C(O)NH2, v=0
   87864.0950  0.1034 -7.4809 3 1263.1913193  71510 303962176      952273        syn-C2H3C(O)NH2, v=0
   87879.9201  0.0200 -4.0367 3   19.6844 29 -71510 30314 014      13 113        syn-C2H3C(O)NH2, v=0
   87885.4655  0.0008 -6.2076 3   19.6844 29  71510 30314 114      13 113        syn-C2H3C(O)NH2, v=0
   87891.2463  0.0008 -6.2075 3   19.6840 29  71510 30314 014      13 013        syn-C2H3C(O)NH2, v=0
   87894.4974  0.0200 -5.0748 3  279.2643 85 -71510 303421627      411724        syn-C2H3C(O)NH2, v=0
   87896.7751  0.0200 -4.0365 3   19.6840 29 -71510 30314 114      13 013        syn-C2H3C(O)NH2, v=0
   87897.2113  0.0011 -5.0748 3  279.2643 85  71510 303421626      411725        syn-C2H3C(O)NH2, v=0
   87918.0126  0.0271 -6.9150 3 1268.7773173  71510 303863947      854046        syn-C2H3C(O)NH2, v=0
   87918.0126  0.0271 -6.9150 3 1268.7773173  71510 303863948      854045        syn-C2H3C(O)NH2, v=0
   87929.0841  0.0200 -4.3916 3   21.0929 27 -71510 30313 211      12 310        syn-C2H3C(O)NH2, v=0
   87934.8931  0.0449 -7.1429 3 1229.1216153  71510 303764729      774632        syn-C2H3C(O)NH2, v=0
   87934.8931  0.0449 -7.1429 3 1229.1216153  71510 303764730      774631        syn-C2H3C(O)NH2, v=0
   87937.3211  0.0054 -5.7615 3  342.9048101  71510 303501140      491237        syn-C2H3C(O)NH2, v=0
   87963.3768  0.0007 -6.5464 3   31.2042 25  71510 30312 8 5      11 8 4        syn-C2H3C(O)NH2, v=0
   87963.4021  0.0007 -6.5464 3   31.2042 25  71510 30312 8 4      11 8 3        syn-C2H3C(O)NH2, v=0
   87980.9347  0.0105 -6.4840 3  758.0880149  71510 303741658      731955        syn-C2H3C(O)NH2, v=0
   88032.1546  0.0016 -7.4582 3   47.2092 39  71510 30319 416      19 217        syn-C2H3C(O)NH2, v=0
   88068.4971  0.0022 -5.7884 3  349.5821 77  71510 303382711      392614        syn-C2H3C(O)NH2, v=0
   88068.4971  0.0022 -5.7884 3  349.5821 77  71510 303382712      392613        syn-C2H3C(O)NH2, v=0
   88137.0663  0.0007 -6.2479 3   19.1397 27  71510 30313 112      12 111        syn-C2H3C(O)NH2, v=0
   88165.5757  0.0018 -4.8541 3  116.5668 57  71510 30328 919      271018        syn-C2H3C(O)NH2, v=0
   88170.0739  0.0536 -7.1720 3 1113.8257181  71510 303901971      892268        syn-C2H3C(O)NH2, v=0
   88181.0194  0.0007 -6.4623 3   27.6756 25  71510 30312 7 6      11 7 5        syn-C2H3C(O)NH2, v=0
   88182.0926  0.0007 -6.4623 3   27.6756 25  71510 30312 7 5      11 7 4        syn-C2H3C(O)NH2, v=0
   88204.7768  0.0808 -7.4183 3 1239.5136191  71510 303952075      942372        syn-C2H3C(O)NH2, v=0
   88212.8603  0.0026 -6.2482 3  294.5069 95  71510 30347 839      48 742        syn-C2H3C(O)NH2, v=0
   88256.8636  0.0079 -6.2645 3  722.3100115  71510 303573720      583623        syn-C2H3C(O)NH2, v=0
   88256.8636  0.0079 -6.2645 3  722.3100115  71510 303573721      583622        syn-C2H3C(O)NH2, v=0
   88259.2146  0.0200 -4.2269 3   46.1714 35 -71510 30317 711      17 612        syn-C2H3C(O)NH2, v=0
   88268.8094  0.0039 -5.9172 3  752.6748135  71510 303672938      663037        syn-C2H3C(O)NH2, v=0
   88268.8094  0.0039 -5.9172 3  752.6748135  71510 303672939      663036        syn-C2H3C(O)NH2, v=0
   88302.3125  0.0026 -6.2473 3  294.5069 95  71510 30347 939      48 642        syn-C2H3C(O)NH2, v=0
   88394.5083  0.0018 -6.7266 3   79.4122 31  71510 3031515 0      1614 3        syn-C2H3C(O)NH2, v=0
   88394.5083  0.0018 -6.7266 3   79.4122 31  71510 3031515 1      1614 2        syn-C2H3C(O)NH2, v=0
   88394.6392  0.0015 -4.0714 3  216.7457 79  71510 303391029      39 930        syn-C2H3C(O)NH2, v=0
   88447.9302  0.0200 -5.1156 3  308.2942 89 -71510 303441728      431825        syn-C2H3C(O)NH2, v=0
   88448.7872  0.0012 -5.1156 3  308.2942 89  71510 303441727      431826        syn-C2H3C(O)NH2, v=0
   88513.8523  0.0007 -6.3970 3   24.6299 25  71510 30312 6 7      11 6 6        syn-C2H3C(O)NH2, v=0
   88541.9842  0.0200 -4.1803 3   19.1397 27 -71510 30313 212      12 111        syn-C2H3C(O)NH2, v=0
   88542.1442  0.0007 -6.3967 3   24.6304 25  71510 30312 6 6      11 6 5        syn-C2H3C(O)NH2, v=0
   88603.3643  0.0200 -4.1256 3   71.0912 45 -71510 30322 716      22 617        syn-C2H3C(O)NH2, v=0
   88614.0086  0.0025 -4.8178 3   63.2978 43  71510 30321 615      20 714        syn-C2H3C(O)NH2, v=0
   88627.0689  0.0006 -4.6025 3   10.1633 19  71510 303 9 3 7       8 2 6        syn-C2H3C(O)NH2, v=0
   88733.7731  0.0320 -7.0256 3 1329.8745177  71510 303884048      874147        syn-C2H3C(O)NH2, v=0
   88733.7731  0.0320 -7.0256 3 1329.8745177  71510 303884049      874146        syn-C2H3C(O)NH2, v=0
   88759.2905  0.0389 -7.0304 3 1170.5888149  71510 303744628      754531        syn-C2H3C(O)NH2, v=0
   88759.2905  0.0389 -7.0304 3 1170.5888149  71510 303744629      754530        syn-C2H3C(O)NH2, v=0
   88759.7558  0.0007 -6.3124 3   19.9832 25  71510 30312 4 9      11 4 8        syn-C2H3C(O)NH2, v=0
   88776.6467  0.0022 -5.7669 3  318.7950 73  71510 303362610      372513        syn-C2H3C(O)NH2, v=0
   88776.6467  0.0022 -5.7669 3  318.7950 73  71510 303362611      372512        syn-C2H3C(O)NH2, v=0
   88853.6194  0.0340 -6.8189 3  922.6944165  71510 303821865      811962        syn-C2H3C(O)NH2, v=0
   88873.5076  0.0200 -4.2520 3   41.9407 33 -71510 30316 710      16 611        syn-C2H3C(O)NH2, v=0
   88917.3284  0.0200 -4.2863 3   37.9871 31 -71510 30315 7 8      15 6 9        syn-C2H3C(O)NH2, v=0
   88932.1234  0.0007 -6.3457 3   22.0728 25  71510 30312 5 8      11 5 7        syn-C2H3C(O)NH2, v=0
   88940.3763  0.0043 -6.9529 3   48.7969 41  71510 30320 218      21 121        syn-C2H3C(O)NH2, v=0
   89022.6659  0.0043 -6.5863 3  585.2524133  71510 303661254      671157        syn-C2H3C(O)NH2, v=0
   89027.6577  0.0063 -6.1899 3  677.6097111  71510 303553619      563522        syn-C2H3C(O)NH2, v=0
   89027.6577  0.0063 -6.1899 3  677.6097111  71510 303553620      563521        syn-C2H3C(O)NH2, v=0
   89028.6385  0.0048 -5.9979 3  799.9475139  71510 303693039      683138        syn-C2H3C(O)NH2, v=0
   89028.6385  0.0048 -5.9979 3  799.9475139  71510 303693040      683137        syn-C2H3C(O)NH2, v=0
   89032.9396  0.0012 -5.1596 3  338.7690 93  71510 303461829      451926        syn-C2H3C(O)NH2, v=0
   89033.2234  0.0012 -5.1596 3  338.7690 93  71510 303461828      451927        syn-C2H3C(O)NH2, v=0
   89049.1011  0.0042 -6.9519 3   48.7969 41  71510 30320 318      21 021        syn-C2H3C(O)NH2, v=0
   89049.8971  0.0439 -7.4369 3 1091.4481181  71510 303901773      911676        syn-C2H3C(O)NH2, v=0
   89051.5783  0.0043 -6.5860 3  585.2524133  71510 303661354      671057        syn-C2H3C(O)NH2, v=0
   89055.3098  0.0439 -7.4368 3 1091.4481181  71510 303901873      911576        syn-C2H3C(O)NH2, v=0
   89062.0263  0.0033 -7.3800 3  162.8473 69  71510 30334 826      34 827        syn-C2H3C(O)NH2, v=0
   89080.8601  0.0024 -7.2591 3   22.0932 25  71510 30312 5 7      13 212        syn-C2H3C(O)NH2, v=0
   89257.8367  0.0017 -4.0594 3  123.8962 59  71510 30329 920      29 821        syn-C2H3C(O)NH2, v=0
   89258.4779  0.0200 -4.0752 3  240.9746 83 -71510 303411130      411031        syn-C2H3C(O)NH2, v=0
   89294.6332  0.0015 -4.2118 3   59.8544 43  71510 30321 517      21 418        syn-C2H3C(O)NH2, v=0
   89366.3352  0.0007 -6.3414 3   22.0836 25  71510 30312 5 7      11 5 6        syn-C2H3C(O)NH2, v=0
   89418.0266  0.0142 -6.6570 3  811.3811153  71510 303761858      752155        syn-C2H3C(O)NH2, v=0
   89476.0222  0.0022 -5.7539 3  289.4514 69  71510 3033425 9      352412        syn-C2H3C(O)NH2, v=0
   89476.0222  0.0022 -5.7539 3  289.4514 69  71510 303342510      352411        syn-C2H3C(O)NH2, v=0
   89491.2540  0.0007 -4.2812 3   37.9667 31  71510 30315 7 9      15 610        syn-C2H3C(O)NH2, v=0
   89553.7166  0.0375 -7.1394 3 1392.3971181  71510 303904149      894248        syn-C2H3C(O)NH2, v=0
   89553.7166  0.0375 -7.1394 3 1392.3971181  71510 303904150      894247        syn-C2H3C(O)NH2, v=0
   89577.9189  0.0335 -6.9217 3 1113.4833145  71510 303724527      734430        syn-C2H3C(O)NH2, v=0
   89577.9189  0.0335 -6.9217 3 1113.4833145  71510 303724528      734429        syn-C2H3C(O)NH2, v=0
   89644.1716  0.0013 -5.2068 3  370.6882 97  71510 303481930      472027        syn-C2H3C(O)NH2, v=0
   89644.2621  0.0013 -5.2068 3  370.6882 97  71510 303481929      472028        syn-C2H3C(O)NH2, v=0
   89736.5203  0.0006 -6.2698 3   17.8429 25  71510 30312 210      11 2 9        syn-C2H3C(O)NH2, v=0
   89792.1174  0.0051 -6.1200 3  634.3463107  71510 303533518      543421        syn-C2H3C(O)NH2, v=0
   89792.1174  0.0051 -6.1200 3  634.3463107  71510 303533519      543420        syn-C2H3C(O)NH2, v=0
   89794.1112  0.0060 -6.0819 3  848.6555143  71510 303713140      703239        syn-C2H3C(O)NH2, v=0
   89794.1112  0.0060 -6.0819 3  848.6555143  71510 303713141      703238        syn-C2H3C(O)NH2, v=0
   89802.9830  0.0200 -4.3180 3   34.2586 29 -71510 30314 7 7      14 6 8        syn-C2H3C(O)NH2, v=0
   89842.2396  0.0022 -7.3803 3   65.0154 45  71510 30322 418      22 419        syn-C2H3C(O)NH2, v=0
   90057.9068  0.0036 -6.2226 3  190.3071 77  71510 30338 632      39 535        syn-C2H3C(O)NH2, v=0
   90062.7075  0.0200 -4.3157 3   34.2495 29 -71510 30314 7 8      14 6 9        syn-C2H3C(O)NH2, v=0
   90065.8661  0.0200 -4.0631 3  230.2171 81 -71510 303401129      401030        syn-C2H3C(O)NH2, v=0
   90166.0793  0.0022 -5.7507 3  261.5521 65  71510 3033224 8      332311        syn-C2H3C(O)NH2, v=0
   90166.0793  0.0022 -5.7507 3  261.5521 65  71510 3033224 9      332310        syn-C2H3C(O)NH2, v=0
   90168.0803  0.0200 -4.1034 3   76.7969 47 -71510 30323 717      23 618        syn-C2H3C(O)NH2, v=0
   90168.3793  0.0036 -6.2216 3  190.3071 77  71510 30338 732      39 435        syn-C2H3C(O)NH2, v=0
   90202.8325  0.0014 -7.3930 3   59.8241 43  71510 30321 517      21 318        syn-C2H3C(O)NH2, v=0
   90277.3457  0.0200 -5.2573 3  404.0511101 -71510 303502031      492128        syn-C2H3C(O)NH2, v=0
   90277.3457  0.0200 -5.2573 3  404.0511101 -71510 303502030      492129        syn-C2H3C(O)NH2, v=0
   90321.0774  0.0017 -4.7343 3   29.0855 33  71510 30316 115      16 016        syn-C2H3C(O)NH2, v=0
   90349.8385  0.0093 -6.4924 3  746.9693147  71510 303731756      722053        syn-C2H3C(O)NH2, v=0
   90362.4038  0.0022 -4.2068 3   64.9981 45  71510 30322 418      22 319        syn-C2H3C(O)NH2, v=0
   90377.8488  0.0437 -7.2564 3 1456.3437185  71510 303924250      914349        syn-C2H3C(O)NH2, v=0
   90377.8488  0.0437 -7.2564 3 1456.3437185  71510 303924251      914348        syn-C2H3C(O)NH2, v=0
   90380.7774  0.0016 -4.7338 3   29.0856 33  71510 30316 215      16 116        syn-C2H3C(O)NH2, v=0
   90390.7381  0.0286 -6.8168 3 1057.8064141  71510 303704426      714329        syn-C2H3C(O)NH2, v=0
   90390.7381  0.0286 -6.8168 3 1057.8064141  71510 303704427      714328        syn-C2H3C(O)NH2, v=0
   90400.2146  0.0026 -6.2912 3  361.0912105  71510 30352 943      53 846        syn-C2H3C(O)NH2, v=0
   90452.2310  0.0200 -4.3580 3   30.7922 27 -71510 30313 7 6      13 6 7        syn-C2H3C(O)NH2, v=0
   90459.7203  0.0026 -6.2907 3  361.0912105  71510 303521043      53 746        syn-C2H3C(O)NH2, v=0
   90534.4214  0.0044 -6.3726 3  108.3860 59  71510 30329 425      30 328        syn-C2H3C(O)NH2, v=0
   90549.6548  0.0013 -4.1012 3   80.1377 47  71510 30323 815      23 716        syn-C2H3C(O)NH2, v=0
   90550.0843  0.0041 -6.0549 3  592.5206103  71510 303513417      523320        syn-C2H3C(O)NH2, v=0
   90550.0843  0.0041 -6.0549 3  592.5206103  71510 303513418      523319        syn-C2H3C(O)NH2, v=0
   90558.8026  0.0016 -6.1493 3    8.0519 17  71510 303 8 3 5       8 0 8        syn-C2H3C(O)NH2, v=0
   90560.7782  0.0200 -4.3571 3   30.7884 27 -71510 30313 7 7      13 6 8        syn-C2H3C(O)NH2, v=0
   90564.9776  0.0075 -6.1691 3  898.7981147  71510 303733241      723340        syn-C2H3C(O)NH2, v=0
   90564.9776  0.0075 -6.1691 3  898.7981147  71510 303733242      723339        syn-C2H3C(O)NH2, v=0
   90657.0007  0.0044 -6.3715 3  108.3860 59  71510 30329 525      30 228        syn-C2H3C(O)NH2, v=0
   90692.1633  0.0063 -6.7165 3  677.4611143  71510 303711358      721261        syn-C2H3C(O)NH2, v=0
   90710.8464  0.0063 -6.7163 3  677.4611143  71510 303711458      721161        syn-C2H3C(O)NH2, v=0
   90815.0831  0.0014 -4.8670 3   95.5317 53  71510 30326 720      25 817        syn-C2H3C(O)NH2, v=0
   90846.1941  0.0022 -5.7587 3  235.0974 61  71510 3033023 7      312210        syn-C2H3C(O)NH2, v=0
   90846.1941  0.0022 -5.7587 3  235.0974 61  71510 3033023 8      3122 9        syn-C2H3C(O)NH2, v=0
   90929.0684  0.0015 -5.3111 3  438.8571105  71510 303522132      512229        syn-C2H3C(O)NH2, v=0
   90929.0774  0.0015 -5.3111 3  438.8571105  71510 303522131      512230        syn-C2H3C(O)NH2, v=0
   90934.1256  0.0007 -4.4075 3   27.5838 25  71510 30312 7 5      12 6 6        syn-C2H3C(O)NH2, v=0
   90975.5498  0.0200 -4.4071 3   27.5824 25 -71510 30312 7 6      12 6 7        syn-C2H3C(O)NH2, v=0
   91019.0815  0.0013 -4.8188 3  105.6464 55  71510 30327 820      26 917        syn-C2H3C(O)NH2, v=0
   91120.7368  0.0043 -6.4852 3  139.8973 61  71510 303301120      31 823        syn-C2H3C(O)NH2, v=0
   91197.6998  0.0244 -6.7158 3 1003.5590137  71510 303684325      694228        syn-C2H3C(O)NH2, v=0
   91197.6998  0.0244 -6.7158 3 1003.5590137  71510 303684326      694227        syn-C2H3C(O)NH2, v=0
   91206.1820  0.0507 -7.3766 3 1521.7131189  71510 303944351      934450        syn-C2H3C(O)NH2, v=0
   91206.1820  0.0507 -7.3766 3 1521.7131189  71510 303944352      934449        syn-C2H3C(O)NH2, v=0
   91216.7112  0.0021 -4.8096 3   99.1167 53  71510 30326 818      25 917        syn-C2H3C(O)NH2, v=0
   91294.1910  0.0200 -4.4689 3   24.6304 23 -71510 30311 7 4      11 6 5        syn-C2H3C(O)NH2, v=0
   91300.7190  0.0200 -4.0350 3  168.3537 69 -71510 303341024      34 925        syn-C2H3C(O)NH2, v=0
   91301.3771  0.0034 -5.9948 3  552.1334 99  71510 303493316      503219        syn-C2H3C(O)NH2, v=0
   91301.3771  0.0034 -5.9948 3  552.1334 99  71510 303493317      503218        syn-C2H3C(O)NH2, v=0
   91308.4018  0.0200 -4.4688 3   24.6299 23 -71510 30311 7 5      11 6 6        syn-C2H3C(O)NH2, v=0
   91341.0312  0.0093 -6.2595 3  950.3741151  71510 303753342      743441        syn-C2H3C(O)NH2, v=0
   91341.0312  0.0093 -6.2595 3  950.3741151  71510 303753343      743440        syn-C2H3C(O)NH2, v=0
   91383.4324  0.0200 -4.0709 3  251.9405 85 -71510 303421131      421032        syn-C2H3C(O)NH2, v=0
   91385.2354  0.0007 -7.4882 3   62.5704 43  71510 30321 616      21 417        syn-C2H3C(O)NH2, v=0
   91483.3734  0.0007 -4.7645 3    5.9896 15  71510 303 7 3 4       6 2 5        syn-C2H3C(O)NH2, v=0
   91492.3093  0.0092 -6.4104 3  739.4950147  71510 303731657      721954        syn-C2H3C(O)NH2, v=0
   91515.6507  0.0022 -5.7803 3  210.0878 57  71510 3032822 6      2921 9        syn-C2H3C(O)NH2, v=0
   91515.6507  0.0022 -5.7803 3  210.0878 57  71510 3032822 7      2921 8        syn-C2H3C(O)NH2, v=0
   91534.6978  0.0014 -4.1268 3   73.7436 47  71510 30323 618      23 519        syn-C2H3C(O)NH2, v=0
   91562.6727  0.0007 -4.5471 3   21.9295 21  71510 30310 7 3      10 6 4        syn-C2H3C(O)NH2, v=0
   91566.9448  0.0007 -4.5471 3   21.9294 21  71510 30310 7 4      10 6 5        syn-C2H3C(O)NH2, v=0
   91596.7657  0.0016 -5.3681 3  475.1054109  71510 303542233      532330        syn-C2H3C(O)NH2, v=0
   91596.7685  0.0016 -5.3681 3  475.1054109  71510 303542232      532331        syn-C2H3C(O)NH2, v=0
   91599.7470  0.0065 -5.9676 3  477.8825119  71510 303591347      581444        syn-C2H3C(O)NH2, v=0
   91642.9865  0.0121 -7.0249 3  680.5888137  71510 303682148      691851        syn-C2H3C(O)NH2, v=0
   91659.4780  0.0007 -4.5219 3   12.4921 21  71510 30310 3 8       9 2 7        syn-C2H3C(O)NH2, v=0
   91728.1891  0.0073 -6.3533 3  703.0488143  71510 303711655      701952        syn-C2H3C(O)NH2, v=0
   91760.6049  0.0007 -4.6517 3   19.4794 19  71510 303 9 7 2       9 6 3        syn-C2H3C(O)NH2, v=0
   91761.6920  0.0007 -4.6517 3   19.4794 19  71510 303 9 7 3       9 6 4        syn-C2H3C(O)NH2, v=0
   91862.8075  0.0008 -6.2812 3   20.1128 25  71510 30312 4 8      11 4 7        syn-C2H3C(O)NH2, v=0
   91903.4501  0.0007 -4.8049 3   17.2784 17  71510 303 8 7 1       8 6 2        syn-C2H3C(O)NH2, v=0
   91903.6706  0.0007 -4.8049 3   17.2784 17  71510 303 8 7 2       8 6 3        syn-C2H3C(O)NH2, v=0
   91992.6335  0.0033 -7.4292 3  237.9060 83  71510 303411031      411032        syn-C2H3C(O)NH2, v=0
   91998.7465  0.0206 -6.6188 3  950.7422133  71510 303664224      674127        syn-C2H3C(O)NH2, v=0
   91998.7465  0.0206 -6.6188 3  950.7422133  71510 303664225      674126        syn-C2H3C(O)NH2, v=0
   92003.3450  0.0008 -5.0793 3   15.3253 15  71510 303 7 7 0       7 6 1        syn-C2H3C(O)NH2, v=0
   92003.3768  0.0008 -5.0793 3   15.3253 15  71510 303 7 7 1       7 6 2        syn-C2H3C(O)NH2, v=0
   92038.7344  0.0584 -7.4998 3 1588.5040193  71510 303964452      954551        syn-C2H3C(O)NH2, v=0
   92038.7344  0.0584 -7.4998 3 1588.5040193  71510 303964453      954550        syn-C2H3C(O)NH2, v=0
   92045.7888  0.0028 -5.9400 3  513.1855 95  71510 303473215      483118        syn-C2H3C(O)NH2, v=0
   92045.7888  0.0028 -5.9400 3  513.1855 95  71510 303473216      483117        syn-C2H3C(O)NH2, v=0
   92076.2389  0.0017 -4.4412 3   39.7834 37  71510 30318 216      18 117        syn-C2H3C(O)NH2, v=0
   92122.1023  0.0114 -6.3531 3 1003.3827155  71510 303773443      763542        syn-C2H3C(O)NH2, v=0
   92122.1023  0.0114 -6.3531 3 1003.3827155  71510 303773444      763541        syn-C2H3C(O)NH2, v=0
   92173.6269  0.0022 -5.8188 3  186.5238 53  71510 3032621 5      2720 8        syn-C2H3C(O)NH2, v=0
   92173.6269  0.0022 -5.8188 3  186.5238 53  71510 3032621 6      2720 7        syn-C2H3C(O)NH2, v=0
   92266.9888  0.0109 -6.8659 3  776.3645153  71510 303761462      771365        syn-C2H3C(O)NH2, v=0
   92270.5847  0.0030 -5.0447 3  116.3395 59  71510 30329 723      28 820        syn-C2H3C(O)NH2, v=0
   92278.3387  0.0017 -5.4284 3  512.7954113  71510 303562334      552431        syn-C2H3C(O)NH2, v=0
   92278.3395  0.0017 -5.4284 3  512.7954113  71510 303562333      552432        syn-C2H3C(O)NH2, v=0
   92279.0094  0.0108 -6.8658 3  776.3645153  71510 303761562      771265        syn-C2H3C(O)NH2, v=0
   92279.6173  0.0019 -7.4145 3   51.7673 41  71510 30320 317      20 318        syn-C2H3C(O)NH2, v=0
   92306.0396  0.0008 -7.4219 3   68.0122 45  71510 30322 617      22 418        syn-C2H3C(O)NH2, v=0
   92388.3111  0.0019 -4.2874 3   51.7637 41  71510 30320 317      20 218        syn-C2H3C(O)NH2, v=0
   92409.7709  0.0032 -7.3323 3  134.4091 63  71510 30331 724      31 725        syn-C2H3C(O)NH2, v=0
   92425.8583  0.0017 -4.4381 3   39.7839 37  71510 30318 316      18 217        syn-C2H3C(O)NH2, v=0
   92445.2159  0.0200 -4.0791 3   82.7294 49 -71510 30324 718      24 619        syn-C2H3C(O)NH2, v=0
   92449.0488  0.0030 -6.3597 3  434.3929115  71510 303571047      58 950        syn-C2H3C(O)NH2, v=0
   92456.7665  0.0180 -6.6336 3  862.4277159  71510 303791762      782059        syn-C2H3C(O)NH2, v=0
   92488.2600  0.0030 -6.3593 3  434.3929115  71510 303571147      58 850        syn-C2H3C(O)NH2, v=0
   92561.4511  0.0028 -7.2196 3   25.2260 27  71510 30313 5 8      14 213        syn-C2H3C(O)NH2, v=0
   92569.8231  0.0739 -7.1851 3 1136.1429183  71510 303912072      902169        syn-C2H3C(O)NH2, v=0
   92669.4743  0.0030 -6.2050 3  244.6548 87  71510 30343 736      44 639        syn-C2H3C(O)NH2, v=0
   92716.6695  0.0026 -7.3274 3   85.4868 51  71510 30325 520      25 521        syn-C2H3C(O)NH2, v=0
   92745.1272  0.0030 -6.2043 3  244.6548 87  71510 30343 836      44 539        syn-C2H3C(O)NH2, v=0
   92783.0831  0.0025 -5.8907 3  475.6776 91  71510 303453114      463017        syn-C2H3C(O)NH2, v=0
   92783.0831  0.0025 -5.8907 3  475.6776 91  71510 303453115      463016        syn-C2H3C(O)NH2, v=0
   92793.8109  0.0173 -6.5259 3  899.3571129  71510 303644123      654026        syn-C2H3C(O)NH2, v=0
   92793.8109  0.0173 -6.5259 3  899.3571129  71510 303644124      654025        syn-C2H3C(O)NH2, v=0
   92819.1786  0.0021 -5.8793 3  164.4057 49  71510 3032420 4      2519 7        syn-C2H3C(O)NH2, v=0
   92819.1786  0.0021 -5.8793 3  164.4057 49  71510 3032420 5      2519 6        syn-C2H3C(O)NH2, v=0
   92893.2096  0.0082 -6.3648 3  721.1459145  71510 303721656      711953        syn-C2H3C(O)NH2, v=0
   92908.0518  0.0140 -6.4499 3 1057.8228159  71510 303793544      783643        syn-C2H3C(O)NH2, v=0
   92908.0518  0.0140 -6.4499 3 1057.8228159  71510 303793545      783642        syn-C2H3C(O)NH2, v=0
   92949.5117  0.0050 -5.5637 3  277.8908 91  71510 303451036      441133        syn-C2H3C(O)NH2, v=0
   92972.1217  0.0200 -5.4919 3  551.9263117 -71510 303582435      572532        syn-C2H3C(O)NH2, v=0
   92972.1217  0.0200 -5.4919 3  551.9263117 -71510 303582434      572533        syn-C2H3C(O)NH2, v=0
   93030.6424  0.0007 -6.2164 3   21.0929 27  71510 30313 311      12 310        syn-C2H3C(O)NH2, v=0
   93080.8303  0.0047 -6.5585 3  359.5256 99  71510 303491634      501337        syn-C2H3C(O)NH2, v=0
   93121.7215  0.0005 -4.5214 3    5.7967 13  71510 303 6 4 3       5 3 2        syn-C2H3C(O)NH2, v=0
   93138.0860  0.0672 -7.4067 3 1393.0493163  71510 303815031      824934        syn-C2H3C(O)NH2, v=0
   93138.0860  0.0672 -7.4067 3 1393.0493163  71510 303815032      824933        syn-C2H3C(O)NH2, v=0
   93217.0648  0.0045 -6.5553 3   78.6005 51  71510 30325 322      26 225        syn-C2H3C(O)NH2, v=0
   93305.9547  0.0045 -6.5545 3   78.6005 51  71510 30325 422      26 125        syn-C2H3C(O)NH2, v=0
   93445.3342  0.0044 -5.2655 3  168.3537 71  71510 30335 828      34 925        syn-C2H3C(O)NH2, v=0
   93451.2220  0.0021 -5.9702 3  143.7338 45  71510 3032219 3      2318 6        syn-C2H3C(O)NH2, v=0
   93451.2220  0.0021 -5.9702 3  143.7338 45  71510 3032219 4      2318 5        syn-C2H3C(O)NH2, v=0
   93452.8907  0.0200 -4.0368 3  219.6943 79 -71510 303391128      391029        syn-C2H3C(O)NH2, v=0
   93461.4226  0.0200 -4.7993 3  123.5638 59 -71510 30329 921      281018        syn-C2H3C(O)NH2, v=0
   93472.9595  0.0005 -4.5194 3    5.7861 13  71510 303 6 4 2       5 3 3        syn-C2H3C(O)NH2, v=0
   93512.9910  0.0024 -5.8474 3  439.6104 87  71510 303433013      442916        syn-C2H3C(O)NH2, v=0
   93512.9910  0.0024 -5.8474 3  439.6104 87  71510 303433014      442915        syn-C2H3C(O)NH2, v=0
   93582.8144  0.0144 -6.4371 3  849.4046125  71510 303624022      633925        syn-C2H3C(O)NH2, v=0
   93582.8144  0.0144 -6.4371 3  849.4046125  71510 303624023      633924        syn-C2H3C(O)NH2, v=0
   93623.7746  0.0029 -7.3134 3  108.6205 57  71510 30328 622      28 623        syn-C2H3C(O)NH2, v=0
   93676.7716  0.0021 -5.5586 3  592.4974121  71510 303602536      592633        syn-C2H3C(O)NH2, v=0
   93676.7717  0.0021 -5.5586 3  592.4974121  71510 303602535      592634        syn-C2H3C(O)NH2, v=0
   93698.7670  0.0169 -6.5499 3 1113.6934163  71510 303813645      803744        syn-C2H3C(O)NH2, v=0
   93698.7670  0.0169 -6.5499 3 1113.6934163  71510 303813646      803743        syn-C2H3C(O)NH2, v=0
   93700.8011  0.0042 -6.5369 3  106.7200 53  71510 303261017      27 720        syn-C2H3C(O)NH2, v=0
   93701.5850  0.0200 -4.0906 3   22.0932 29 -71510 30314 113      13 212        syn-C2H3C(O)NH2, v=0
   93750.4909  0.0186 -7.0337 3  881.9557163  71510 303811566      821469        syn-C2H3C(O)NH2, v=0
   93755.4970  0.0089 -6.2313 3  635.0629137  71510 303681554      671651        syn-C2H3C(O)NH2, v=0
   93758.1969  0.0186 -7.0336 3  881.9557163  71510 303811666      821369        syn-C2H3C(O)NH2, v=0
   93775.4406  0.0040 -6.2553 3  150.4759 69  71510 30334 529      35 432        syn-C2H3C(O)NH2, v=0
   93797.9148  0.0017 -4.8820 3  102.1594 55  71510 30327 721      26 818        syn-C2H3C(O)NH2, v=0
   93815.5942  0.0007 -6.2361 3   18.8439 25  71510 30312 3 9      11 3 8        syn-C2H3C(O)NH2, v=0
   93833.0164  0.0017 -4.2748 3   51.7673 41  71510 30320 417      20 318        syn-C2H3C(O)NH2, v=0
   93864.0229  0.0040 -6.2545 3  150.4759 69  71510 30334 629      35 332        syn-C2H3C(O)NH2, v=0
   93876.6682  0.0024 -4.1154 3   85.4481 51  71510 30325 520      25 421        syn-C2H3C(O)NH2, v=0
   93920.7365  0.0007 -6.1659 3   22.0932 29  71510 30314 213      13 212        syn-C2H3C(O)NH2, v=0
   93941.7102  0.0017 -7.4007 3   51.7637 41  71510 30320 417      20 218        syn-C2H3C(O)NH2, v=0
   93943.8394  0.0200 -3.9519 3   22.6160 31 -71510 30315 015      14 114        syn-C2H3C(O)NH2, v=0
   93946.5076  0.0008 -6.1256 3   22.6160 31  71510 30315 115      14 114        syn-C2H3C(O)NH2, v=0
   93949.3575  0.0008 -6.1256 3   22.6158 31  71510 30315 015      14 014        syn-C2H3C(O)NH2, v=0
   93952.0340  0.0200 -3.9518 3   22.6158 31 -71510 30315 115      14 014        syn-C2H3C(O)NH2, v=0
   93975.3832  0.0589 -7.2855 3 1330.7250159  71510 303794930      804833        syn-C2H3C(O)NH2, v=0
   93975.3832  0.0589 -7.2855 3 1330.7250159  71510 303794931      804832        syn-C2H3C(O)NH2, v=0
   94047.1380  0.0006 -6.8251 3    1.4267  9  71510 303 4 3 2       3 0 3        syn-C2H3C(O)NH2, v=0
   94068.5142  0.0020 -6.1067 3  124.5085 41  71510 3032018 2      2117 5        syn-C2H3C(O)NH2, v=0
   94068.5142  0.0020 -6.1067 3  124.5085 41  71510 3032018 3      2117 4        syn-C2H3C(O)NH2, v=0
   94106.4869  0.0007 -6.1640 3   22.0797 29  71510 30314 113      13 112        syn-C2H3C(O)NH2, v=0
   94235.2061  0.0023 -5.8105 3  404.9845 83  71510 303412912      422815        syn-C2H3C(O)NH2, v=0
   94235.2061  0.0023 -5.8105 3  404.9845 83  71510 303412913      422814        syn-C2H3C(O)NH2, v=0
   94296.6464  0.0200 -4.0871 3   74.2485 45 -71510 30322 814      22 715        syn-C2H3C(O)NH2, v=0
   94325.6374  0.0200 -4.0844 3   22.0797 29 -71510 30314 213      13 112        syn-C2H3C(O)NH2, v=0
   94365.6658  0.0119 -6.3525 3  800.8856121  71510 303603921      613824        syn-C2H3C(O)NH2, v=0
   94365.6658  0.0119 -6.3525 3  800.8856121  71510 303603922      613823        syn-C2H3C(O)NH2, v=0
   94374.8450  0.0036 -6.4512 3  514.4066125  71510 303621151      631054        syn-C2H3C(O)NH2, v=0
   94391.1936  0.0024 -5.6286 3  634.5079125  71510 303622636      612735        syn-C2H3C(O)NH2, v=0
   94391.1936  0.0024 -5.6286 3  634.5079125  71510 303622637      612734        syn-C2H3C(O)NH2, v=0
   94398.7808  0.0023 -4.9404 3  109.0935 57  71510 30328 722      27 819        syn-C2H3C(O)NH2, v=0
   94400.4854  0.0036 -6.4510 3  514.4066125  71510 303621251      63 954        syn-C2H3C(O)NH2, v=0
   94494.1575  0.0204 -6.6531 3 1170.9935167  71510 303833746      823845        syn-C2H3C(O)NH2, v=0
   94494.1575  0.0204 -6.6531 3 1170.9935167  71510 303833747      823844        syn-C2H3C(O)NH2, v=0
   94500.2887  0.0008 -4.4348 3   15.0568 23  71510 30311 3 9      10 2 8        syn-C2H3C(O)NH2, v=0
   94530.7389  0.0014 -4.8055 3  142.9413 63  71510 303311022      301119        syn-C2H3C(O)NH2, v=0
   94633.7577  0.0024 -4.7051 3   50.6575 39  71510 30319 514      18 613        syn-C2H3C(O)NH2, v=0
   94669.6339  0.0019 -6.3216 3  106.7299 37  71510 3031817 1      1916 4        syn-C2H3C(O)NH2, v=0
   94669.6339  0.0019 -6.3216 3  106.7299 37  71510 3031817 2      1916 3        syn-C2H3C(O)NH2, v=0
   94735.4062  0.0010 -7.3611 3   73.6368 47  71510 30323 618      23 419        syn-C2H3C(O)NH2, v=0
   94806.8157  0.0515 -7.1680 3 1269.8249155  71510 303774829      784732        syn-C2H3C(O)NH2, v=0
   94806.8157  0.0515 -7.1680 3 1269.8249155  71510 303774830      784731        syn-C2H3C(O)NH2, v=0
   94924.9807  0.0007 -7.0658 3   53.0072 27  71510 3031312 1      1212 0        syn-C2H3C(O)NH2, v=0
   94924.9807  0.0007 -7.0658 3   53.0072 27  71510 3031312 2      1212 1        syn-C2H3C(O)NH2, v=0
   94933.3103  0.0028 -7.0780 3   34.0870 29  71510 30314 7 8      15 411        syn-C2H3C(O)NH2, v=0
   94948.8810  0.0017 -4.1677 3   65.0154 45  71510 30322 518      22 419        syn-C2H3C(O)NH2, v=0
   94949.3795  0.0023 -5.7805 3  371.8006 79  71510 303392811      402714        syn-C2H3C(O)NH2, v=0
   94949.3795  0.0023 -5.7805 3  371.8006 79  71510 303392812      402713        syn-C2H3C(O)NH2, v=0
   94977.3914  0.0016 -4.0255 3  116.3395 57  71510 30328 919      28 820        syn-C2H3C(O)NH2, v=0
   95000.9707  0.0007 -6.7705 3   47.5765 27  71510 3031311 2      1211 1        syn-C2H3C(O)NH2, v=0
   95000.9707  0.0007 -6.7705 3   47.5765 27  71510 3031311 3      1211 2        syn-C2H3C(O)NH2, v=0
   95006.2013  0.0014 -4.8245 3  163.7727 67  71510 303331123      321220        syn-C2H3C(O)NH2, v=0
   95084.8670  0.0026 -6.2216 3  305.7302 97  71510 30348 840      49 743        syn-C2H3C(O)NH2, v=0
   95100.2457  0.0007 -6.6016 3   42.6206 27  71510 3031310 3      1210 2        syn-C2H3C(O)NH2, v=0
   95100.2457  0.0007 -6.6016 3   42.6206 27  71510 3031310 4      1210 3        syn-C2H3C(O)NH2, v=0
   95114.3161  0.0048 -5.3946 3  219.6943 81  71510 30340 932      391029        syn-C2H3C(O)NH2, v=0
   95114.4919  0.0028 -5.7018 3  677.9571129  71510 303642737      632836        syn-C2H3C(O)NH2, v=0
   95114.4919  0.0028 -5.7018 3  677.9571129  71510 303642738      632835        syn-C2H3C(O)NH2, v=0
   95132.3764  0.0044 -6.9284 3   53.3456 43  71510 30321 219      22 122        syn-C2H3C(O)NH2, v=0
   95135.8729  0.0026 -6.2211 3  305.7301 97  71510 30348 940      49 643        syn-C2H3C(O)NH2, v=0
   95142.2602  0.0097 -6.2723 3  753.8012117  71510 303583820      593723        syn-C2H3C(O)NH2, v=0
   95142.2602  0.0097 -6.2723 3  753.8012117  71510 303583821      593722        syn-C2H3C(O)NH2, v=0
   95144.6520  0.0304 -7.2192 3  994.2276173  71510 303861670      871573        syn-C2H3C(O)NH2, v=0
   95149.5770  0.0304 -7.2192 3  994.2276173  71510 303861770      871473        syn-C2H3C(O)NH2, v=0
   95190.4236  0.0044 -6.9279 3   53.3456 43  71510 30321 319      22 022        syn-C2H3C(O)NH2, v=0
   95234.2560  0.0007 -6.4855 3   38.1406 27  71510 30313 9 5      12 9 4        syn-C2H3C(O)NH2, v=0
   95234.2579  0.0007 -6.4855 3   38.1406 27  71510 30313 9 4      12 9 3        syn-C2H3C(O)NH2, v=0
   95252.9644  0.0019 -6.7111 3   90.3983 33  71510 3031616 0      1715 3        syn-C2H3C(O)NH2, v=0
   95252.9644  0.0019 -6.7111 3   90.3983 33  71510 3031616 1      1715 2        syn-C2H3C(O)NH2, v=0
   95267.0199  0.0342 -6.9317 3  969.0387167  71510 303832063      822360        syn-C2H3C(O)NH2, v=0
   95290.8730  0.0013 -4.8506 3  186.0549 71  71510 303351224      341321        syn-C2H3C(O)NH2, v=0
   95294.1517  0.0243 -6.7595 3 1229.7219171  71510 303853847      843946        syn-C2H3C(O)NH2, v=0
   95294.1517  0.0243 -6.7595 3 1229.7219171  71510 303853848      843945        syn-C2H3C(O)NH2, v=0
   95301.9535  0.0039 -6.6389 3   78.0253 45  71510 30322 914      23 617        syn-C2H3C(O)NH2, v=0
   95348.5024  0.0302 -6.8180 3  973.4918169  71510 303841866      832163        syn-C2H3C(O)NH2, v=0
   95422.5997  0.0007 -6.3987 3   34.1384 27  71510 30313 8 6      12 8 5        syn-C2H3C(O)NH2, v=0
   95422.6999  0.0007 -6.3987 3   34.1384 27  71510 30313 8 5      12 8 4        syn-C2H3C(O)NH2, v=0
   95460.1983  0.0200 -4.0529 3   88.8829 51 -71510 30325 719      25 620        syn-C2H3C(O)NH2, v=0
   95469.0452  0.0016 -7.3355 3   64.9981 45  71510 30322 518      22 319        syn-C2H3C(O)NH2, v=0
   95561.4546  0.0013 -4.8811 3  209.7863 75  71510 303371325      361422        syn-C2H3C(O)NH2, v=0
   95623.5783  0.0007 -6.1870 3   20.8362 27  71510 30313 211      12 210        syn-C2H3C(O)NH2, v=0
   95632.3549  0.0448 -7.0543 3 1210.3503151  71510 303754728      764631        syn-C2H3C(O)NH2, v=0
   95632.3549  0.0448 -7.0543 3 1210.3503151  71510 303754729      764630        syn-C2H3C(O)NH2, v=0
   95655.1140  0.0023 -5.7581 3  340.0594 75  71510 303372710      382613        syn-C2H3C(O)NH2, v=0
   95655.1140  0.0023 -5.7581 3  340.0594 75  71510 303372711      382612        syn-C2H3C(O)NH2, v=0
   95672.0171  0.0014 -4.8470 3  186.0544 71  71510 303351223      341322        syn-C2H3C(O)NH2, v=0
   95698.1379  0.0020 -4.0352 3  227.0250 81  71510 303401030      40 931        syn-C2H3C(O)NH2, v=0
   95699.6133  0.0013 -4.8798 3  209.7861 75  71510 303371324      361423        syn-C2H3C(O)NH2, v=0
   95700.3764  0.0007 -6.3309 3   30.6170 27  71510 30313 7 7      12 7 6        syn-C2H3C(O)NH2, v=0
   95703.7152  0.0007 -6.3309 3   30.6171 27  71510 30313 7 6      12 7 5        syn-C2H3C(O)NH2, v=0
   95755.6414  0.0213 -6.5421 3  814.3638155  71510 303771761      761858        syn-C2H3C(O)NH2, v=0
   95777.6517  0.0034 -6.8083 3   53.8142 37  71510 30318 811      19 514        syn-C2H3C(O)NH2, v=0
   95845.9285  0.0034 -5.7783 3  722.8440133  71510 303662838      652937        syn-C2H3C(O)NH2, v=0
   95845.9285  0.0034 -5.7783 3  722.8440133  71510 303662839      652936        syn-C2H3C(O)NH2, v=0
   95880.4207  0.0012 -4.9151 3  234.9656 79  71510 303391426      381523        syn-C2H3C(O)NH2, v=0
   95912.4773  0.0079 -6.1966 3  708.1521113  71510 303563719      573622        syn-C2H3C(O)NH2, v=0
   95912.4773  0.0079 -6.1966 3  708.1521113  71510 303563720      573621        syn-C2H3C(O)NH2, v=0
   95929.0716  0.0200 -4.9146 3  234.9656 79 -71510 303391425      381524        syn-C2H3C(O)NH2, v=0
   95952.8161  0.0026 -4.0590 3  108.5428 57  71510 30328 622      28 523        syn-C2H3C(O)NH2, v=0
   95963.0851  0.0023 -4.0230 3  193.5230 75  71510 30337 928      37 829        syn-C2H3C(O)NH2, v=0
   96006.3376  0.0007 -6.2085 3   22.9439 27  71510 30313 410      12 4 9        syn-C2H3C(O)NH2, v=0
   96020.7445  0.0200 -4.8149 3  163.7711 67 -71510 303331122      321221        syn-C2H3C(O)NH2, v=0
   96098.6945  0.0288 -6.8690 3 1289.8775175  71510 303873948      864047        syn-C2H3C(O)NH2, v=0
   96098.6945  0.0288 -6.8690 3 1289.8775175  71510 303873949      864046        syn-C2H3C(O)NH2, v=0
   96115.1488  0.0007 -6.2762 3   27.5824 27  71510 30313 6 8      12 6 7        syn-C2H3C(O)NH2, v=0
   96177.1514  0.0024 -6.9383 3   34.7790 31  71510 30315 6 9      16 314        syn-C2H3C(O)NH2, v=0
   96185.6035  0.0008 -6.2756 3   27.5838 27  71510 30313 6 7      12 6 6        syn-C2H3C(O)NH2, v=0
   96188.6131  0.0046 -6.5640 3  601.1267135  71510 303671255      681158        syn-C2H3C(O)NH2, v=0
   96205.2743  0.0046 -6.5639 3  601.1267135  71510 303671355      681058        syn-C2H3C(O)NH2, v=0
   96211.5217  0.0014 -4.4466 3   29.5856 31  71510 30315 312      14 411        syn-C2H3C(O)NH2, v=0
   96246.9486  0.0200 -4.2380 3   24.1961 29 -71510 30314 212      13 311        syn-C2H3C(O)NH2, v=0
   96261.2582  0.0200 -4.9523 3  261.5921 83 -71510 303411527      401624        syn-C2H3C(O)NH2, v=0
   96277.9623  0.0200 -4.9521 3  261.5921 83 -71510 303411526      401625        syn-C2H3C(O)NH2, v=0
   96351.9577  0.0023 -5.7443 3  309.7613 71  71510 3033526 9      362512        syn-C2H3C(O)NH2, v=0
   96351.9577  0.0023 -5.7443 3  309.7613 71  71510 303352610      362511        syn-C2H3C(O)NH2, v=0
   96415.0307  0.0022 -6.9987 3   31.0426 29  71510 30314 6 8      15 313        syn-C2H3C(O)NH2, v=0
   96426.8161  0.0017 -4.6848 3   32.6235 35  71510 30317 116      17 017        syn-C2H3C(O)NH2, v=0
   96439.2593  0.0015 -4.0895 3   79.5125 49  71510 30324 619      24 520        syn-C2H3C(O)NH2, v=0
   96450.4228  0.0472 -7.4222 3 1113.1726183  71510 303911774      921677        syn-C2H3C(O)NH2, v=0
   96451.9655  0.0388 -6.9443 3 1152.3023147  71510 303734627      744530        syn-C2H3C(O)NH2, v=0
   96451.9655  0.0388 -6.9443 3 1152.3023147  71510 303734628      744529        syn-C2H3C(O)NH2, v=0
   96453.5623  0.0472 -7.4222 3 1113.1726183  71510 303911874      921577        syn-C2H3C(O)NH2, v=0
   96457.7233  0.0017 -4.6845 3   32.6236 35  71510 30317 216      17 117        syn-C2H3C(O)NH2, v=0
   96488.4555  0.0016 -4.0511 3  263.0918 87  71510 303431132      431033        syn-C2H3C(O)NH2, v=0
   96539.9911  0.0026 -4.0192 3  162.5978 69  71510 30334 826      34 727        syn-C2H3C(O)NH2, v=0
   96542.6158  0.0007 -6.2329 3   25.0392 27  71510 30313 5 9      12 5 8        syn-C2H3C(O)NH2, v=0
   96553.6827  0.0200 -4.0686 3  289.7024 91 -71510 303451233      451134        syn-C2H3C(O)NH2, v=0
   96581.1255  0.0025 -4.7422 3   83.1116 49  71510 30324 717      23 816        syn-C2H3C(O)NH2, v=0
   96584.8919  0.0042 -5.8580 3  769.1678137  71510 303682939      673038        syn-C2H3C(O)NH2, v=0
   96584.8919  0.0042 -5.8580 3  769.1678137  71510 303682940      673037        syn-C2H3C(O)NH2, v=0
   96676.1794  0.0064 -6.1255 3  663.9393109  71510 303543618      553521        syn-C2H3C(O)NH2, v=0
   96676.1794  0.0064 -6.1255 3  663.9393109  71510 303543619      553520        syn-C2H3C(O)NH2, v=0
   96699.9320  0.0200 -4.9926 3  289.6650 87 -71510 303431628      421725        syn-C2H3C(O)NH2, v=0
   96705.5270  0.0200 -4.9926 3  289.6650 87 -71510 303431627      421726        syn-C2H3C(O)NH2, v=0
   96708.8264  0.0035 -6.1968 3  199.3043 79  71510 30339 633      40 536        syn-C2H3C(O)NH2, v=0
   96723.8368  0.0027 -4.0291 3  134.2652 63  71510 30331 724      31 625        syn-C2H3C(O)NH2, v=0
   96770.9775  0.0035 -6.1963 3  199.3043 79  71510 30339 733      40 436        syn-C2H3C(O)NH2, v=0
   96807.3916  0.0780 -7.2885 3 1140.5872181  71510 303902268      892565        syn-C2H3C(O)NH2, v=0
   96907.7450  0.0338 -6.9816 3 1351.4591179  71510 303894049      884148        syn-C2H3C(O)NH2, v=0
   96907.7450  0.0338 -6.9816 3 1351.4591179  71510 303894050      884147        syn-C2H3C(O)NH2, v=0
   96949.9740  0.0044 -6.3474 3  115.1582 61  71510 30330 426      31 329        syn-C2H3C(O)NH2, v=0
   96983.7222  0.0486 -7.0314 3 1091.2633179  71510 303891970      882267        syn-C2H3C(O)NH2, v=0
   97017.5858  0.0044 -6.3468 3  115.1582 61  71510 30330 526      31 229        syn-C2H3C(O)NH2, v=0
   97039.3955  0.0023 -5.7403 3  280.9070 67  71510 3033325 8      342411        syn-C2H3C(O)NH2, v=0
   97039.3955  0.0023 -5.7403 3  280.9070 67  71510 3033325 9      342410        syn-C2H3C(O)NH2, v=0
   97080.3817  0.0009 -6.3020 3    7.3848 15  71510 303 7 4 3       7 1 6        syn-C2H3C(O)NH2, v=0
   97108.3425  0.0200 -4.7806 3  142.9368 63 -71510 303311021      301120        syn-C2H3C(O)NH2, v=0
   97185.8495  0.0200 -4.0542 3  277.8908 89 -71510 303441232      441133        syn-C2H3C(O)NH2, v=0
   97187.7952  0.0012 -5.0361 3  319.1835 91  71510 303451729      441826        syn-C2H3C(O)NH2, v=0
   97189.6963  0.0200 -5.0361 3  319.1835 91 -71510 303451728      441827        syn-C2H3C(O)NH2, v=0
   97202.4588  0.0200 -4.0819 3   68.6592 43 -71510 30321 813      21 714        syn-C2H3C(O)NH2, v=0
   97263.4203  0.0012 -5.3850 3    4.8393 15  71510 303 7 2 5       6 1 6        syn-C2H3C(O)NH2, v=0
   97265.6054  0.0334 -6.8382 3 1095.6820143  71510 303714526      724429        syn-C2H3C(O)NH2, v=0
   97265.6054  0.0334 -6.8382 3 1095.6820143  71510 303714527      724428        syn-C2H3C(O)NH2, v=0
   97330.8740  0.0052 -5.9408 3  816.9277141  71510 303703040      693139        syn-C2H3C(O)NH2, v=0
   97330.8740  0.0052 -5.9408 3  816.9277141  71510 303703041      693138        syn-C2H3C(O)NH2, v=0
   97334.5723  0.0027 -6.2670 3  373.5278107  71510 30353 944      54 847        syn-C2H3C(O)NH2, v=0
   97368.5461  0.0027 -6.2668 3  373.5278107  71510 303531044      54 747        syn-C2H3C(O)NH2, v=0
   97392.6577  0.0017 -3.9963 3  159.4369 67  71510 303331023      33 924        syn-C2H3C(O)NH2, v=0
   97401.3275  0.0008 -6.2251 3   25.0646 27  71510 30313 5 8      12 5 7        syn-C2H3C(O)NH2, v=0
   97431.0002  0.0008 -4.3425 3   17.8429 25  71510 30312 310      11 2 9        syn-C2H3C(O)NH2, v=0
   97433.2093  0.0052 -6.0593 3  621.1636105  71510 303523517      533420        syn-C2H3C(O)NH2, v=0
   97433.2093  0.0052 -6.0593 3  621.1636105  71510 303523518      533419        syn-C2H3C(O)NH2, v=0
   97616.4292  0.0009 -6.0020 3    9.3408 17  71510 303 8 4 4       8 1 7        syn-C2H3C(O)NH2, v=0
   97659.7419  0.0021 -7.3089 3   70.3792 47  71510 30323 419      23 420        syn-C2H3C(O)NH2, v=0
   97660.6915  0.0745 -7.2692 3 1215.7255189  71510 303942074      932371        syn-C2H3C(O)NH2, v=0
   97716.5246  0.0012 -5.0827 3  350.1471 95  71510 303471830      461927        syn-C2H3C(O)NH2, v=0
   97716.8410  0.0023 -5.7476 3  253.4969 63  71510 3033124 7      322310        syn-C2H3C(O)NH2, v=0
   97716.8410  0.0023 -5.7476 3  253.4969 63  71510 3033124 8      3223 9        syn-C2H3C(O)NH2, v=0
   97717.1382  0.0012 -5.0827 3  350.1471 95  71510 303471829      461928        syn-C2H3C(O)NH2, v=0
   97721.2742  0.0396 -7.0974 3 1414.4657183  71510 303914150      904249        syn-C2H3C(O)NH2, v=0
   97721.2742  0.0396 -7.0974 3 1414.4657183  71510 303914151      904248        syn-C2H3C(O)NH2, v=0
   97800.4043  0.0028 -6.8993 3   38.7210 33  71510 30316 610      17 315        syn-C2H3C(O)NH2, v=0
   97834.5723  0.0009 -6.6967 3    5.6406 13  71510 303 6 4 2       6 1 5        syn-C2H3C(O)NH2, v=0
   97865.2872  0.0157 -6.5373 3  842.5706157  71510 303781761      772058        syn-C2H3C(O)NH2, v=0
   97898.1139  0.0070 -6.6970 3  694.5470145  71510 303721359      731262        syn-C2H3C(O)NH2, v=0
   97908.8839  0.0070 -6.6969 3  694.5470145  71510 303721459      731162        syn-C2H3C(O)NH2, v=0
   97952.5175  0.0021 -4.1492 3   70.3695 47  71510 30323 419      23 320        syn-C2H3C(O)NH2, v=0
   98020.9931  0.0097 -6.4202 3  765.5723149  71510 303741757      732054        syn-C2H3C(O)NH2, v=0
   98047.9548  0.0020 -4.5692 3   39.4296 35  71510 30317 413      16 512        syn-C2H3C(O)NH2, v=0
   98073.2241  0.0286 -6.7360 3 1040.4905139  71510 303694425      704328        syn-C2H3C(O)NH2, v=0
   98073.2241  0.0286 -6.7360 3 1040.4905139  71510 303694426      704327        syn-C2H3C(O)NH2, v=0
   98083.4514  0.0065 -6.0269 3  866.1227145  71510 303723141      713240        syn-C2H3C(O)NH2, v=0
   98083.4514  0.0065 -6.0269 3  866.1227145  71510 303723142      713239        syn-C2H3C(O)NH2, v=0
   98086.8746  0.0032 -7.3409 3  203.3679 77  71510 30338 929      38 930        syn-C2H3C(O)NH2, v=0
   98089.4565  0.0041 -6.4792 3  305.0206 91  71510 303451531      461234        syn-C2H3C(O)NH2, v=0
   98112.1960  0.0085 -6.8624 3  604.8214129  71510 303642045      651748        syn-C2H3C(O)NH2, v=0
   98183.3885  0.0042 -5.9981 3  579.8258101  71510 303503416      513319        syn-C2H3C(O)NH2, v=0
   98183.3885  0.0042 -5.9981 3  579.8258101  71510 303503417      513318        syn-C2H3C(O)NH2, v=0
   98239.4585  0.0034 -7.2092 3   28.5619 29  71510 30314 5 9      15 214        syn-C2H3C(O)NH2, v=0
   98279.0604  0.0200 -5.1325 3  382.5550 99 -71510 303491931      482028        syn-C2H3C(O)NH2, v=0
   98279.0604  0.0200 -5.1325 3  382.5550 99 -71510 303491930      482029        syn-C2H3C(O)NH2, v=0
   98281.3978  0.0020 -7.0834 3   27.5139 27  71510 30313 6 7      14 312        syn-C2H3C(O)NH2, v=0
   98284.7747  0.0013 -4.7580 3  112.4350 57  71510 30328 821      27 918        syn-C2H3C(O)NH2, v=0
   98349.7261  0.0018 -4.3925 3   43.9286 39  71510 30319 217      19 118        syn-C2H3C(O)NH2, v=0
   98383.6257  0.0023 -5.7687 3  227.5315 59  71510 3032923 6      3022 9        syn-C2H3C(O)NH2, v=0
   98383.6257  0.0023 -5.7687 3  227.5315 59  71510 3032923 7      3022 8        syn-C2H3C(O)NH2, v=0
   98388.9380  0.0013 -7.3046 3   79.4475 49  71510 30324 619      24 420        syn-C2H3C(O)NH2, v=0
   98422.9564  0.0509 -6.8947 3 1015.7152173  71510 303861968      852065        syn-C2H3C(O)NH2, v=0
   98539.2638  0.0460 -7.2164 3 1478.8959187  71510 303934251      924350        syn-C2H3C(O)NH2, v=0
   98539.2638  0.0460 -7.2164 3 1478.8959187  71510 303934252      924349        syn-C2H3C(O)NH2, v=0
   98542.4772  0.0018 -4.3909 3   43.9289 39  71510 30319 317      19 218        syn-C2H3C(O)NH2, v=0
   98795.3786  0.0015 -4.0001 3  209.4324 77  71510 303381127      381028        syn-C2H3C(O)NH2, v=0
   98842.2703  0.0081 -6.1162 3  916.7519149  71510 303743242      733341        syn-C2H3C(O)NH2, v=0
   98842.2703  0.0081 -6.1162 3  916.7519149  71510 303743243      733340        syn-C2H3C(O)NH2, v=0
   98869.5211  0.0014 -5.1854 3  416.4066103  71510 303512032      502129        syn-C2H3C(O)NH2, v=0
   98869.5845  0.0014 -5.1854 3  416.4066103  71510 303512031      502130        syn-C2H3C(O)NH2, v=0
   98874.7626  0.0243 -6.6377 3  986.7289135  71510 303674324      684227        syn-C2H3C(O)NH2, v=0
   98874.7626  0.0243 -6.6377 3  986.7289135  71510 303674325      684226        syn-C2H3C(O)NH2, v=0
   98926.5139  0.0034 -5.9421 3  539.9267 97  71510 303483315      493218        syn-C2H3C(O)NH2, v=0
   98926.5139  0.0034 -5.9421 3  539.9267 97  71510 303483316      493217        syn-C2H3C(O)NH2, v=0
   98994.1049  0.0200 -4.0224 3   85.8130 49 -71510 30324 817      24 718        syn-C2H3C(O)NH2, v=0
   98994.4919  0.0059 -5.7367 3  400.5792109  71510 303541243      531340        syn-C2H3C(O)NH2, v=0
   99011.2821  0.0200 -4.0669 3  301.7179 93 -71510 303461234      461135        syn-C2H3C(O)NH2, v=0
   99030.6313  0.0019 -7.3555 3   56.5208 43  71510 30321 318      21 319        syn-C2H3C(O)NH2, v=0
   99038.9879  0.0023 -5.8067 3  203.0112 55  71510 3032722 5      2821 8        syn-C2H3C(O)NH2, v=0
   99038.9879  0.0023 -5.8067 3  203.0112 55  71510 3032722 6      2821 7        syn-C2H3C(O)NH2, v=0
   99088.6640  0.0019 -4.2366 3   56.5188 43  71510 30321 318      21 219        syn-C2H3C(O)NH2, v=0
   99143.4439  0.0200 -4.0336 3   79.8045 47 -71510 30323 816      23 717        syn-C2H3C(O)NH2, v=0
   99196.1235  0.0012 -4.0249 3   95.2521 53  71510 30326 720      26 621        syn-C2H3C(O)NH2, v=0
   99304.4162  0.0200 -4.0104 3   92.0671 51 -71510 30325 818      25 719        syn-C2H3C(O)NH2, v=0
   99361.7049  0.0532 -7.3385 3 1544.7486191  71510 303954352      944451        syn-C2H3C(O)NH2, v=0
   99361.7049  0.0532 -7.3385 3 1544.7486191  71510 303954353      944450        syn-C2H3C(O)NH2, v=0
   99368.0291  0.0009 -7.2126 3    4.1212 11  71510 303 5 4 1       5 1 4        syn-C2H3C(O)NH2, v=0
   99388.6846  0.0200 -4.0851 3   63.3606 41 -71510 30320 812      20 713        syn-C2H3C(O)NH2, v=0
   99396.8271  0.0029 -6.1813 3  254.8656 89  71510 30344 737      45 640        syn-C2H3C(O)NH2, v=0
   99439.5109  0.0029 -6.1809 3  254.8656 89  71510 30344 837      45 540        syn-C2H3C(O)NH2, v=0
   99440.3395  0.0031 -6.3380 3  448.0426117  71510 303581048      59 951        syn-C2H3C(O)NH2, v=0
   99462.7510  0.0031 -6.3378 3  448.0426117  71510 303581148      59 851        syn-C2H3C(O)NH2, v=0
   99466.8116  0.0007 -6.1304 3   24.1961 29  71510 30314 312      13 311        syn-C2H3C(O)NH2, v=0
   99483.6995  0.0015 -5.2416 3  451.7012107  71510 303532133      522230        syn-C2H3C(O)NH2, v=0
   99483.7195  0.0015 -5.2416 3  451.7012107  71510 303532132      522231        syn-C2H3C(O)NH2, v=0
   99494.6294  0.0045 -6.5323 3   84.3618 53  71510 30326 323      27 226        syn-C2H3C(O)NH2, v=0
   99508.7138  0.0120 -6.8490 3  794.6611155  71510 303771463      781366        syn-C2H3C(O)NH2, v=0
   99515.6455  0.0120 -6.8490 3  794.6611155  71510 303771563      781266        syn-C2H3C(O)NH2, v=0
   99542.7059  0.0045 -6.5319 3   84.3618 53  71510 30326 423      27 126        syn-C2H3C(O)NH2, v=0
   99601.8710  0.0020 -4.7384 3  123.5512 59  71510 30329 920      281019        syn-C2H3C(O)NH2, v=0
   99607.0351  0.0100 -6.2087 3  968.8144153  71510 303763343      753442        syn-C2H3C(O)NH2, v=0
   99607.0351  0.0100 -6.2087 3  968.8144153  71510 303763344      753441        syn-C2H3C(O)NH2, v=0
   99624.2201  0.0200 -4.0450 3   74.0467 45 -71510 30322 815      22 716        syn-C2H3C(O)NH2, v=0
   99662.3550  0.0029 -5.8918 3  501.4670 93  71510 303463214      473117        syn-C2H3C(O)NH2, v=0
   99662.3550  0.0029 -5.8918 3  501.4670 93  71510 303463215      473116        syn-C2H3C(O)NH2, v=0
   99670.1520  0.0206 -6.5435 3  934.3982131  71510 303654223      664126        syn-C2H3C(O)NH2, v=0
   99670.1520  0.0206 -6.5435 3  934.3982131  71510 303654224      664125        syn-C2H3C(O)NH2, v=0
   99682.0598  0.0022 -5.8669 3  179.9365 51  71510 3032521 4      2620 7        syn-C2H3C(O)NH2, v=0
   99682.0598  0.0022 -5.8669 3  179.9365 51  71510 3032521 5      2620 6        syn-C2H3C(O)NH2, v=0
   99890.7582  0.0200 -3.9990 3   25.2260 31 -71510 30315 114      14 213        syn-C2H3C(O)NH2, v=0
   99930.2308  0.0010 -5.7867 3   11.4979 19  71510 303 9 4 5       9 1 8        syn-C2H3C(O)NH2, v=0
   99938.8307  0.0018 -4.2296 3   56.5208 43  71510 30321 418      21 319        syn-C2H3C(O)NH2, v=0
   99939.2871  0.0005 -4.4611 3    7.2854 15  71510 303 7 4 4       6 3 3        syn-C2H3C(O)NH2, v=0
   99996.7736  0.0760 -7.4405 3 1436.3363165  71510 303825131      835034        syn-C2H3C(O)NH2, v=0
   99996.7736  0.0760 -7.4405 3 1436.3363165  71510 303825132      835033        syn-C2H3C(O)NH2, v=0
   99996.8634  0.0018 -7.3480 3   56.5188 43  71510 30321 418      21 219        syn-C2H3C(O)NH2, v=0
  100005.6400  0.0200 -3.8735 3   25.7497 33 -71510 30316 016      15 115        syn-C2H3C(O)NH2, v=0
  100006.9088  0.0009 -6.0497 3   25.7497 33  71510 30316 116      15 115        syn-C2H3C(O)NH2, v=0
  100007.2454  0.0008 -6.0871 3   25.2260 31  71510 30315 214      14 213        syn-C2H3C(O)NH2, v=0
  100008.3006  0.0009 -6.0497 3   25.7496 33  71510 30316 016      15 015        syn-C2H3C(O)NH2, v=0
  100009.6024  0.0200 -3.8735 3   25.7496 33 -71510 30316 116      15 015        syn-C2H3C(O)NH2, v=0
  100109.9077  0.0008 -6.0861 3   25.2187 31  71510 30315 114      14 113        syn-C2H3C(O)NH2, v=0
  100118.0295  0.0016 -5.3009 3  488.4380111  71510 303552234      542331        syn-C2H3C(O)NH2, v=0
  100118.0358  0.0016 -5.3009 3  488.4380111  71510 303552233      542332        syn-C2H3C(O)NH2, v=0
  100175.8212  0.0015 -3.9962 3  109.0935 55  71510 30327 918      27 819        syn-C2H3C(O)NH2, v=0
  100193.8020  0.0200 -3.9971 3   98.5609 53 -71510 30326 819      26 720        syn-C2H3C(O)NH2, v=0
  100226.4070  0.0200 -3.9959 3   25.2187 31 -71510 30315 214      14 113        syn-C2H3C(O)NH2, v=0
  100239.4109  0.0200 -4.3490 3    6.2155 11 -71510 303 5 5 1       4 4 0        syn-C2H3C(O)NH2, v=0
  100240.2322  0.0200 -4.3490 3    6.2155 11 -71510 303 5 5 0       4 4 1        syn-C2H3C(O)NH2, v=0
  100279.2108  0.0040 -6.2319 3  158.4613 71  71510 30335 530      36 433        syn-C2H3C(O)NH2, v=0
  100306.0769  0.0033 -7.4239 3  286.3565 91  71510 303451134      451135        syn-C2H3C(O)NH2, v=0
  100311.8533  0.0022 -5.9577 3  158.3077 47  71510 3032320 3      2419 6        syn-C2H3C(O)NH2, v=0
  100311.8533  0.0022 -5.9577 3  158.3077 47  71510 3032320 4      2419 5        syn-C2H3C(O)NH2, v=0
  100313.4201  0.0200 -4.0573 3   68.5435 43 -71510 30321 814      21 715        syn-C2H3C(O)NH2, v=0
  100328.3626  0.0040 -6.2315 3  158.4613 71  71510 30335 630      36 333        syn-C2H3C(O)NH2, v=0
  100335.7426  0.0212 -6.7054 3  898.5652161  71510 303801961      792258        syn-C2H3C(O)NH2, v=0
  100377.4987  0.0123 -6.3043 3 1022.3091157  71510 303783444      773543        syn-C2H3C(O)NH2, v=0
  100377.4987  0.0123 -6.3043 3 1022.3091157  71510 303783445      773542        syn-C2H3C(O)NH2, v=0
  100390.6506  0.0026 -5.8474 3  464.4475 89  71510 303443113      453016        syn-C2H3C(O)NH2, v=0
  100390.6506  0.0026 -5.8474 3  464.4475 89  71510 303443114      453015        syn-C2H3C(O)NH2, v=0
  100459.3126  0.0173 -6.4535 3  883.4993127  71510 303634122      644025        syn-C2H3C(O)NH2, v=0
  100459.3126  0.0173 -6.4535 3  883.4993127  71510 303634123      644024        syn-C2H3C(O)NH2, v=0
  100523.4913  0.0009 -6.1659 3   23.1770 27  71510 30313 4 9      12 4 8        syn-C2H3C(O)NH2, v=0
  100577.5261  0.0200 -4.0255 3  266.3103 87 -71510 303431231      431132        syn-C2H3C(O)NH2, v=0
  100725.1223  0.0008 -4.2478 3   20.8362 27  71510 30313 311      12 210        syn-C2H3C(O)NH2, v=0
  100769.7480  0.0018 -5.3635 3  526.6163115  71510 303572335      562432        syn-C2H3C(O)NH2, v=0
  100769.7500  0.0018 -5.3635 3  526.6163115  71510 303572334      562433        syn-C2H3C(O)NH2, v=0
  100835.6486  0.0670 -7.3180 3 1373.0725161  71510 303805030      814933        syn-C2H3C(O)NH2, v=0
  100835.6486  0.0670 -7.3180 3 1373.0725161  71510 303805031      814932        syn-C2H3C(O)NH2, v=0
  100860.4504  0.0018 -4.1256 3   70.3792 47  71510 30323 519      23 420        syn-C2H3C(O)NH2, v=0
  100927.2450  0.0021 -6.0943 3  138.1251 43  71510 3032119 2      2218 5        syn-C2H3C(O)NH2, v=0
  100927.2450  0.0021 -6.0943 3  138.1251 43  71510 3032119 3      2218 4        syn-C2H3C(O)NH2, v=0
  100983.3394  0.0005 -4.4562 3    7.2546 15  71510 303 7 4 3       6 3 4        syn-C2H3C(O)NH2, v=0
  101019.9245  0.0200 -4.0953 3   58.3434 39 -71510 30319 811      19 712        syn-C2H3C(O)NH2, v=0
  101023.9932  0.0204 -7.0195 3  901.4621165  71510 303821567      831470        syn-C2H3C(O)NH2, v=0
  101028.4382  0.0204 -7.0195 3  901.4621165  71510 303821667      831370        syn-C2H3C(O)NH2, v=0
  101086.2382  0.0137 -6.5366 3  830.7437155  71510 303771859      762156        syn-C2H3C(O)NH2, v=0
  101104.6855  0.0200 -4.0715 3   63.2978 41 -71510 30320 813      20 714        syn-C2H3C(O)NH2, v=0
  101111.1049  0.0025 -5.8094 3  428.8688 85  71510 303423012      432915        syn-C2H3C(O)NH2, v=0
  101111.1049  0.0025 -5.8094 3  428.8688 85  71510 303423013      432914        syn-C2H3C(O)NH2, v=0
  101153.2259  0.0017 -7.2822 3   70.3695 47  71510 30323 519      23 320        syn-C2H3C(O)NH2, v=0
  101153.4550  0.0150 -6.4031 3 1077.2350161  71510 303803545      793644        syn-C2H3C(O)NH2, v=0
  101153.4550  0.0150 -6.4031 3 1077.2350161  71510 303803546      793643        syn-C2H3C(O)NH2, v=0
  101242.1526  0.0144 -6.3677 3  834.0333123  71510 303614021      623924        syn-C2H3C(O)NH2, v=0
  101242.1526  0.0144 -6.3677 3  834.0333123  71510 303614022      623923        syn-C2H3C(O)NH2, v=0
  101293.7961  0.0007 -6.1391 3   21.9732 27  71510 30313 310      12 3 9        syn-C2H3C(O)NH2, v=0
  101295.5754  0.0045 -6.9070 3   58.0963 45  71510 30322 220      23 123        syn-C2H3C(O)NH2, v=0
  101326.2096  0.0045 -6.9068 3   58.0963 45  71510 30322 320      23 023        syn-C2H3C(O)NH2, v=0
  101348.4784  0.0007 -6.1112 3   24.0259 29  71510 30314 212      13 211        syn-C2H3C(O)NH2, v=0
  101417.7951  0.0037 -6.4320 3  529.2689127  71510 303631152      641055        syn-C2H3C(O)NH2, v=0
  101432.4641  0.0037 -6.4319 3  529.2689127  71510 303631252      64 955        syn-C2H3C(O)NH2, v=0
  101436.6466  0.0019 -5.4292 3  566.2354119  71510 303592436      582533        syn-C2H3C(O)NH2, v=0
  101436.6472  0.0019 -5.4292 3  566.2354119  71510 303592435      582534        syn-C2H3C(O)NH2, v=0
  101526.9625  0.0020 -6.3098 3  119.3889 39  71510 3031918 1      2017 4        syn-C2H3C(O)NH2, v=0
  101526.9625  0.0020 -6.3098 3  119.3889 39  71510 3031918 2      2017 3        syn-C2H3C(O)NH2, v=0
  101549.3824  0.0033 -6.8810 3   42.8669 35  71510 30317 611      18 316        syn-C2H3C(O)NH2, v=0
  101562.6058  0.0019 -7.1965 3   24.1961 25  71510 30312 6 6      13 311        syn-C2H3C(O)NH2, v=0
  101571.9697  0.0137 -6.4632 3  822.9481155  71510 303771760      762057        syn-C2H3C(O)NH2, v=0
  101593.8140  0.0024 -7.2499 3   91.6646 53  71510 30326 521      26 522        syn-C2H3C(O)NH2, v=0
  101668.5110  0.0588 -7.1992 3 1311.2321157  71510 303784929      794832        syn-C2H3C(O)NH2, v=0
  101668.5110  0.0588 -7.1992 3 1311.2321157  71510 303784930      794831        syn-C2H3C(O)NH2, v=0
  101758.8330  0.0200 -3.9818 3  105.2881 55 -71510 30327 820      27 721        syn-C2H3C(O)NH2, v=0
  101812.8339  0.0016 -4.0526 3   85.4868 51  71510 30325 620      25 521        syn-C2H3C(O)NH2, v=0
  101823.3828  0.0024 -5.7784 3  394.7316 81  71510 303402911      412814        syn-C2H3C(O)NH2, v=0
  101823.3828  0.0024 -5.7784 3  394.7316 81  71510 303402912      412813        syn-C2H3C(O)NH2, v=0
  101882.5646  0.0026 -6.2001 3  317.1544 99  71510 30349 841      50 744        syn-C2H3C(O)NH2, v=0
  101911.4099  0.0026 -6.1998 3  317.1544 99  71510 30349 941      50 644        syn-C2H3C(O)NH2, v=0
  101915.1800  0.0200 -4.0883 3   58.3110 39 -71510 30319 812      19 713        syn-C2H3C(O)NH2, v=0
  101934.7324  0.0181 -6.5051 3 1133.5911165  71510 303823646      813745        syn-C2H3C(O)NH2, v=0
  101934.7324  0.0181 -6.5051 3 1133.5911165  71510 303823647      813744        syn-C2H3C(O)NH2, v=0
  102018.5670  0.0119 -6.2862 3  786.0012119  71510 303593920      603823        syn-C2H3C(O)NH2, v=0
  102018.5670  0.0119 -6.2862 3  786.0012119  71510 303593921      603822        syn-C2H3C(O)NH2, v=0
  102027.5862  0.0200 -4.7214 3  130.8244 61 -71510 30330 922      291019        syn-C2H3C(O)NH2, v=0
  102052.7427  0.0073 -5.9774 3  545.5380127  71510 303631450      621547        syn-C2H3C(O)NH2, v=0
  102095.3914  0.1029 -7.2879 3 1239.0583191  71510 303952175      942272        syn-C2H3C(O)NH2, v=0
  102109.5716  0.0019 -6.7002 3  102.0995 35  71510 3031717 0      1816 3        syn-C2H3C(O)NH2, v=0
  102109.5716  0.0019 -6.7002 3  102.0995 35  71510 3031717 1      1816 2        syn-C2H3C(O)NH2, v=0
  102116.9439  0.0022 -5.4982 3  607.2946123  71510 303612537      602634        syn-C2H3C(O)NH2, v=0
  102116.9441  0.0022 -5.4982 3  607.2946123  71510 303612536      602635        syn-C2H3C(O)NH2, v=0
  102127.4568  0.0106 -6.3980 3  784.4410151  71510 303751758      742055        syn-C2H3C(O)NH2, v=0
  102154.7264  0.0031 -7.2764 3  171.4707 71  71510 30335 827      35 828        syn-C2H3C(O)NH2, v=0
  102203.5833  0.0020 -6.1610 3    9.9758 19  71510 303 9 3 6       9 0 9        syn-C2H3C(O)NH2, v=0
  102217.4287  0.0008 -7.0194 3   62.0764 29  71510 3031413 1      1313 0        syn-C2H3C(O)NH2, v=0
  102217.4287  0.0008 -7.0194 3   62.0764 29  71510 3031413 2      1313 1        syn-C2H3C(O)NH2, v=0
  102240.2064  0.0038 -5.0790 3  159.4369 69  71510 30334 827      33 924        syn-C2H3C(O)NH2, v=0
  102245.7911  0.0200 -4.1119 3   53.5994 37 -71510 30318 810      18 711        syn-C2H3C(O)NH2, v=0
  102270.5033  0.0023 -4.0567 3   91.6421 53  71510 30326 521      26 422        syn-C2H3C(O)NH2, v=0
  102286.1152  0.0267 -6.7047 3  952.3812167  71510 303831865      822162        syn-C2H3C(O)NH2, v=0
  102291.6476  0.0008 -6.7218 3   56.1736 29  71510 3031412 2      1312 1        syn-C2H3C(O)NH2, v=0
  102291.6476  0.0008 -6.7218 3   56.1736 29  71510 3031412 3      1312 2        syn-C2H3C(O)NH2, v=0
  102386.1958  0.0008 -6.5507 3   50.7454 29  71510 3031411 3      1311 2        syn-C2H3C(O)NH2, v=0
  102386.1958  0.0008 -6.5507 3   50.7454 29  71510 3031411 4      1311 3        syn-C2H3C(O)NH2, v=0
  102446.1824  0.0330 -7.2078 3 1014.9427175  71510 303871671      881574        syn-C2H3C(O)NH2, v=0
  102449.0241  0.0330 -7.2078 3 1014.9427175  71510 303871771      881474        syn-C2H3C(O)NH2, v=0
  102470.7930  0.0040 -6.4258 3  254.9887 83  71510 303411428      421131        syn-C2H3C(O)NH2, v=0
  102495.3302  0.0513 -7.0842 3 1250.8163153  71510 303764828      774731        syn-C2H3C(O)NH2, v=0
  102495.3302  0.0513 -7.0842 3 1250.8163153  71510 303764829      774730        syn-C2H3C(O)NH2, v=0
  102509.9937  0.0008 -6.4321 3   45.7928 29  71510 3031410 5      1310 4        syn-C2H3C(O)NH2, v=0
  102509.9938  0.0008 -6.4321 3   45.7928 29  71510 3031410 4      1310 3        syn-C2H3C(O)NH2, v=0
  102519.1851  0.0018 -4.6393 3   36.3637 37  71510 30318 117      18 018        syn-C2H3C(O)NH2, v=0
  102527.1047  0.0024 -5.7551 3  362.0365 77  71510 303382810      392713        syn-C2H3C(O)NH2, v=0
  102527.1047  0.0024 -5.7551 3  362.0365 77  71510 303382811      392712        syn-C2H3C(O)NH2, v=0
  102535.0054  0.0018 -4.6392 3   36.3637 37  71510 30318 217      18 118        syn-C2H3C(O)NH2, v=0
  102677.5203  0.0008 -6.3429 3   41.3173 29  71510 30314 9 6      13 9 5        syn-C2H3C(O)NH2, v=0
  102677.5289  0.0008 -6.3429 3   41.3173 29  71510 30314 9 5      13 9 4        syn-C2H3C(O)NH2, v=0
  102687.2637  0.0200 -4.1084 3   53.5837 37 -71510 30318 811      18 712        syn-C2H3C(O)NH2, v=0
  102721.1888  0.0217 -6.6102 3 1191.3764169  71510 303843747      833846        syn-C2H3C(O)NH2, v=0
  102721.1888  0.0217 -6.6102 3 1191.3764169  71510 303843748      833845        syn-C2H3C(O)NH2, v=0
  102760.5342  0.0009 -4.7395 3    7.6449 17  71510 303 8 3 5       7 2 6        syn-C2H3C(O)NH2, v=0
  102788.4360  0.0098 -6.2092 3  739.4038115  71510 303573819      583722        syn-C2H3C(O)NH2, v=0
  102788.4360  0.0098 -6.2092 3  739.4038115  71510 303573820      583721        syn-C2H3C(O)NH2, v=0
  102809.1904  0.0025 -5.5703 3  649.7930127  71510 303632638      622735        syn-C2H3C(O)NH2, v=0
  102809.1905  0.0025 -5.5703 3  649.7930127  71510 303632637      622736        syn-C2H3C(O)NH2, v=0
  102913.6654  0.0008 -6.2728 3   37.3213 29  71510 30314 8 7      13 8 6        syn-C2H3C(O)NH2, v=0
  102914.0112  0.0008 -6.2728 3   37.3213 29  71510 30314 8 6      13 8 5        syn-C2H3C(O)NH2, v=0
  102972.8326  0.0015 -7.2519 3   85.4481 51  71510 30325 620      25 421        syn-C2H3C(O)NH2, v=0
  103055.1105  0.0006 -6.3275 3    2.3485 11  71510 303 5 3 3       4 0 4        syn-C2H3C(O)NH2, v=0
  103107.2089  0.0007 -6.1158 3   26.1464 29  71510 30314 411      13 410        syn-C2H3C(O)NH2, v=0
  103148.1348  0.0119 -6.4149 3  803.5688153  71510 303761759      752056        syn-C2H3C(O)NH2, v=0
  103181.2024  0.0200 -4.1342 3   49.1227 35 -71510 30317 8 9      17 710        syn-C2H3C(O)NH2, v=0
  103221.8410  0.0024 -5.7403 3  330.7842 73  71510 3033627 9      372612        syn-C2H3C(O)NH2, v=0
  103221.8410  0.0024 -5.7403 3  330.7842 73  71510 303362710      372611        syn-C2H3C(O)NH2, v=0
  103261.7362  0.0008 -6.2158 3   33.8092 29  71510 30314 7 8      13 7 7        syn-C2H3C(O)NH2, v=0
  103271.0617  0.0008 -6.2157 3   33.8094 29  71510 30314 7 7      13 7 6        syn-C2H3C(O)NH2, v=0
  103278.1807  0.0049 -6.5474 3  617.2009137  71510 303681256      691159        syn-C2H3C(O)NH2, v=0
  103287.7207  0.0049 -6.5473 3  617.2009137  71510 303681356      691059        syn-C2H3C(O)NH2, v=0
  103295.5823  0.0034 -6.1754 3  208.5031 81  71510 30340 634      41 537        syn-C2H3C(O)NH2, v=0
  103312.7017  0.0027 -6.6836 3   54.8972 39  71510 30319 712      20 417        syn-C2H3C(O)NH2, v=0
  103316.0692  0.0447 -6.9729 3 1191.8263149  71510 303744727      754630        syn-C2H3C(O)NH2, v=0
  103316.0692  0.0447 -6.9729 3 1191.8263149  71510 303744728      754629        syn-C2H3C(O)NH2, v=0
  103316.1824  0.0044 -6.3260 3  122.1323 63  71510 30331 427      32 330        syn-C2H3C(O)NH2, v=0
  103330.2278  0.0034 -6.1751 3  208.5031 81  71510 30340 734      41 437        syn-C2H3C(O)NH2, v=0
  103353.0912  0.0044 -6.3257 3  122.1323 63  71510 30331 527      32 230        syn-C2H3C(O)NH2, v=0
  103386.4003  0.0200 -4.1326 3   49.1154 35 -71510 30317 810      17 711        syn-C2H3C(O)NH2, v=0
  103512.1978  0.0030 -5.6457 3  693.7297131  71510 303652738      642837        syn-C2H3C(O)NH2, v=0
  103512.1978  0.0030 -5.6457 3  693.7297131  71510 303652739      642836        syn-C2H3C(O)NH2, v=0
  103512.7071  0.0258 -6.7185 3 1250.5896173  71510 303863848      853947        syn-C2H3C(O)NH2, v=0
  103512.7071  0.0258 -6.7185 3 1250.5896173  71510 303863849      853946        syn-C2H3C(O)NH2, v=0
  103543.0873  0.0024 -6.7193 3   50.1456 37  71510 30318 711      19 416        syn-C2H3C(O)NH2, v=0
  103551.6231  0.0080 -6.1369 3  694.2419111  71510 303553718      563621        syn-C2H3C(O)NH2, v=0
  103551.6231  0.0080 -6.1369 3  694.2419111  71510 303553719      563620        syn-C2H3C(O)NH2, v=0
  103563.3391  0.0027 -4.6422 3   68.5435 45  71510 30322 616      21 715        syn-C2H3C(O)NH2, v=0
  103597.5040  0.0014 -3.9956 3  101.8325 55  71510 30327 721      27 622        syn-C2H3C(O)NH2, v=0
  103661.7371  0.0017 -3.9574 3  150.8236 65  71510 303321022      32 923        syn-C2H3C(O)NH2, v=0
  103681.7781  0.0200 -4.7213 3  150.6817 65 -71510 303321023      311120        syn-C2H3C(O)NH2, v=0
  103699.9899  0.0441 -7.3374 3  913.2658159  71510 303792456      802159        syn-C2H3C(O)NH2, v=0
  103759.8059  0.0008 -6.1686 3   30.7884 29  71510 30314 6 9      13 6 8        syn-C2H3C(O)NH2, v=0
  103776.4802  0.0507 -7.4135 3 1135.0954185  71510 303921775      931678        syn-C2H3C(O)NH2, v=0
  103778.2922  0.0507 -7.4135 3 1135.0954185  71510 303921875      931578        syn-C2H3C(O)NH2, v=0
  103799.1464  0.0200 -4.0802 3  342.9048 99 -71510 303491336      491237        syn-C2H3C(O)NH2, v=0
  103802.2286  0.0131 -6.2711 3  712.6769145  71510 303721657      711754        syn-C2H3C(O)NH2, v=0
  103810.5748  0.0027 -7.2278 3  115.6135 59  71510 30329 623      29 624        syn-C2H3C(O)NH2, v=0
  103835.3899  0.0200 -4.1114 3   27.5139 31 -71510 30315 213      14 312        syn-C2H3C(O)NH2, v=0
  103906.7894  0.0200 -4.1621 3   44.9084 33 -71510 30316 8 8      16 7 9        syn-C2H3C(O)NH2, v=0
  103907.1054  0.0024 -5.7354 3  300.9751 69  71510 3033426 8      352511        syn-C2H3C(O)NH2, v=0
  103907.1054  0.0024 -5.7354 3  300.9751 69  71510 3033426 9      352510        syn-C2H3C(O)NH2, v=0
  103920.3123  0.0008 -6.1673 3   30.7922 29  71510 30314 6 8      13 6 7        syn-C2H3C(O)NH2, v=0
  103996.2327  0.0200 -4.1614 3   44.9052 33 -71510 30316 8 9      16 710        syn-C2H3C(O)NH2, v=0
  104054.1490  0.0029 -7.2378 3  142.2176 65  71510 30332 725      32 726        syn-C2H3C(O)NH2, v=0
  104061.8286  0.0200 -3.9643 3  112.2423 57 -71510 30328 821      28 722        syn-C2H3C(O)NH2, v=0
  104114.4537  0.0069 -6.7210 3  533.5122121  71510 303601942      611645        syn-C2H3C(O)NH2, v=0
  104128.9303  0.0008 -6.1318 3   28.2595 29  71510 30314 510      13 5 9        syn-C2H3C(O)NH2, v=0
  104130.6840  0.0387 -6.8654 3 1134.2632145  71510 303724626      734529        syn-C2H3C(O)NH2, v=0
  104130.6840  0.0387 -6.8654 3 1134.2632145  71510 303724627      734528        syn-C2H3C(O)NH2, v=0
  104196.5784  0.0027 -6.2479 3  386.1653109  71510 30354 945      55 848        syn-C2H3C(O)NH2, v=0
  104215.8292  0.0027 -6.2477 3  386.1653109  71510 303541045      55 748        syn-C2H3C(O)NH2, v=0
  104222.3441  0.0200 -4.0638 3  330.0397 97 -71510 303481335      481236        syn-C2H3C(O)NH2, v=0
  104224.9855  0.0037 -5.7242 3  739.1041135  71510 303672839      662938        syn-C2H3C(O)NH2, v=0
  104224.9855  0.0037 -5.7242 3  739.1041135  71510 303672840      662937        syn-C2H3C(O)NH2, v=0
  104301.2281  0.0020 -4.0188 3  274.4117 89  71510 303441133      441034        syn-C2H3C(O)NH2, v=0
  104307.9735  0.0065 -6.0694 3  650.5166107  71510 303533617      543520        syn-C2H3C(O)NH2, v=0
  104307.9735  0.0065 -6.0694 3  650.5166107  71510 303533618      543519        syn-C2H3C(O)NH2, v=0
  104309.1921  0.0305 -6.8299 3 1311.2297177  71510 303883949      874048        syn-C2H3C(O)NH2, v=0
  104309.1921  0.0305 -6.8299 3 1311.2297177  71510 303883950      874047        syn-C2H3C(O)NH2, v=0
  104336.2351  0.0014 -4.7392 3  171.9967 69  71510 303341124      331221        syn-C2H3C(O)NH2, v=0
  104358.5006  0.0024 -4.6793 3  105.6125 55  71510 30327 819      26 918        syn-C2H3C(O)NH2, v=0
  104417.1107  0.0013 -4.7226 3  119.5077 59  71510 30329 822      28 919        syn-C2H3C(O)NH2, v=0
  104420.6746  0.0012 -5.6480 3   13.8505 21  71510 30310 4 6      10 1 9        syn-C2H3C(O)NH2, v=0
  104476.8774  0.0200 -4.1962 3   40.9531 31 -71510 30315 8 7      15 7 8        syn-C2H3C(O)NH2, v=0
  104513.2520  0.0200 -4.1959 3   40.9518 31 -71510 30315 8 8      15 7 9        syn-C2H3C(O)NH2, v=0
  104537.6432  0.0200 -3.9743 3  102.1594 53 -71510 30326 917      26 818        syn-C2H3C(O)NH2, v=0
  104556.3686  0.0007 -7.3510 3   88.5795 51  71510 30325 719      25 520        syn-C2H3C(O)NH2, v=0
  104565.8664  0.0019 -4.3482 3   48.2757 41  71510 30320 218      20 119        syn-C2H3C(O)NH2, v=0
  104566.8098  0.0017 -4.0501 3  313.9139 95  71510 303471235      471136        syn-C2H3C(O)NH2, v=0
  104568.3555  0.0008 -4.1539 3   24.0259 29  71510 30314 312      13 211        syn-C2H3C(O)NH2, v=0
  104582.3471  0.0024 -5.7420 3  272.6098 65  71510 3033225 7      332410        syn-C2H3C(O)NH2, v=0
  104582.3471  0.0024 -5.7420 3  272.6098 65  71510 3033225 8      3324 9        syn-C2H3C(O)NH2, v=0
  104605.6104  0.0013 -4.7664 3  194.7647 73  71510 303361225      351322        syn-C2H3C(O)NH2, v=0
  104670.4658  0.0018 -4.3474 3   48.2758 41  71510 30320 318      20 219        syn-C2H3C(O)NH2, v=0
  104786.4894  0.0200 -4.7991 3  218.9828 77 -71510 303381326      371423        syn-C2H3C(O)NH2, v=0
  104865.8564  0.0053 -5.5242 3  330.0397 99  71510 303491139      481236        syn-C2H3C(O)NH2, v=0
  104927.9446  0.0200 -4.2374 3   37.2541 29 -71510 30314 8 6      14 7 7        syn-C2H3C(O)NH2, v=0
  104939.1227  0.0333 -6.7619 3 1078.1281141  71510 303704525      714428        syn-C2H3C(O)NH2, v=0
  104939.1227  0.0333 -6.7619 3 1078.1281141  71510 303704526      714427        syn-C2H3C(O)NH2, v=0
  104941.5663  0.0200 -4.2373 3   37.2537 29 -71510 30314 8 7      14 7 8        syn-C2H3C(O)NH2, v=0
  104946.7393  0.0046 -5.8059 3  785.9151139  71510 303692940      683039        syn-C2H3C(O)NH2, v=0
  104946.7393  0.0046 -5.8059 3  785.9151139  71510 303692941      683038        syn-C2H3C(O)NH2, v=0
  104996.0140  0.0021 -7.2484 3   75.9452 49  71510 30324 420      24 421        syn-C2H3C(O)NH2, v=0
  104998.4886  0.0200 -4.8357 3  244.6495 81 -71510 303401427      391524        syn-C2H3C(O)NH2, v=0
  105029.5387  0.0077 -6.6829 3  711.8324147  71510 303731360      741263        syn-C2H3C(O)NH2, v=0
  105035.7102  0.0077 -6.6828 3  711.8324147  71510 303731460      741163        syn-C2H3C(O)NH2, v=0
  105052.9633  0.0013 -4.7969 3  218.9824 77  71510 303381325      371424        syn-C2H3C(O)NH2, v=0
  105057.3119  0.0052 -6.0070 3  608.2286103  71510 303513516      523419        syn-C2H3C(O)NH2, v=0
  105057.3119  0.0052 -6.0070 3  608.2286103  71510 303513517      523418        syn-C2H3C(O)NH2, v=0
  105094.5865  0.0200 -4.8349 3  244.6494 81 -71510 303401426      391525        syn-C2H3C(O)NH2, v=0
  105110.5670  0.0358 -6.9445 3 1373.2956181  71510 303904050      894149        syn-C2H3C(O)NH2, v=0
  105110.5670  0.0358 -6.9445 3 1373.2956181  71510 303904051      894148        syn-C2H3C(O)NH2, v=0
  105110.9231  0.0436 -6.9050 3 1068.9099177  71510 303881969      872266        syn-C2H3C(O)NH2, v=0
  105113.9447  0.0031 -6.6627 3   59.8544 41  71510 30320 713      21 418        syn-C2H3C(O)NH2, v=0
  105114.7938  0.0023 -3.9905 3  237.4683 83  71510 303411031      41 932        syn-C2H3C(O)NH2, v=0
  105152.0965  0.0008 -7.2954 3   95.0534 53  71510 30326 720      26 521        syn-C2H3C(O)NH2, v=0
  105158.3473  0.0020 -4.0998 3   75.9398 49  71510 30324 420      24 321        syn-C2H3C(O)NH2, v=0
  105215.6732  0.0025 -3.9988 3  115.5666 59  71510 30329 623      29 524        syn-C2H3C(O)NH2, v=0
  105246.9425  0.0024 -5.7623 3  245.6888 61  71510 3033024 6      3123 9        syn-C2H3C(O)NH2, v=0
  105246.9425  0.0024 -5.7623 3  245.6888 61  71510 3033024 7      3123 8        syn-C2H3C(O)NH2, v=0
  105277.6579  0.0012 -4.8755 3  271.7638 85  71510 303421528      411625        syn-C2H3C(O)NH2, v=0
  105282.1354  0.0017 -3.9577 3  199.4560 75  71510 303371126      371027        syn-C2H3C(O)NH2, v=0
  105285.0088  0.0200 -4.2874 3   33.8094 27 -71510 30313 8 5      13 7 6        syn-C2H3C(O)NH2, v=0
  105289.6585  0.0200 -4.2874 3   33.8092 27 -71510 30313 8 6      13 7 7        syn-C2H3C(O)NH2, v=0
  105311.3779  0.0200 -4.8752 3  271.7638 85 -71510 303421527      411626        syn-C2H3C(O)NH2, v=0
  105321.2217  0.0014 -4.7603 3  194.7635 73  71510 303361224      351323        syn-C2H3C(O)NH2, v=0
  105546.1761  0.0022 -6.7708 3   45.6020 35  71510 30317 710      18 415        syn-C2H3C(O)NH2, v=0
  105563.4388  0.0334 -6.6095 3  901.9121163  71510 303811864      801961        syn-C2H3C(O)NH2, v=0
  105566.0200  0.0200 -4.3492 3   30.6171 25 -71510 30312 8 4      12 7 5        syn-C2H3C(O)NH2, v=0
  105567.4543  0.0200 -4.3492 3   30.6170 25 -71510 30312 8 5      12 7 6        syn-C2H3C(O)NH2, v=0
  105583.0318  0.0019 -7.3037 3   61.4762 45  71510 30322 319      22 320        syn-C2H3C(O)NH2, v=0
  105613.6592  0.0019 -4.1917 3   61.4752 45  71510 30322 319      22 220        syn-C2H3C(O)NH2, v=0
  105626.5832  0.0012 -4.9184 3  300.3247 89  71510 303441629      431726        syn-C2H3C(O)NH2, v=0
  105638.1977  0.0200 -4.9183 3  300.3247 89 -71510 303441628      431727        syn-C2H3C(O)NH2, v=0
  105676.7802  0.0057 -5.8908 3  834.1620143  71510 303713041      703140        syn-C2H3C(O)NH2, v=0
  105676.7802  0.0057 -5.8908 3  834.1620143  71510 303713042      703139        syn-C2H3C(O)NH2, v=0
  105685.2528  0.0009 -6.1188 3   28.3135 29  71510 30314 5 9      13 5 8        syn-C2H3C(O)NH2, v=0
  105737.9336  0.0046 -6.5125 3   90.3251 55  71510 30327 324      28 227        syn-C2H3C(O)NH2, v=0
  105741.3250  0.0286 -6.6623 3 1023.4221137  71510 303684424      694327        syn-C2H3C(O)NH2, v=0
  105741.3250  0.0286 -6.6623 3 1023.4221137  71510 303684425      694326        syn-C2H3C(O)NH2, v=0
  105763.6670  0.0046 -6.5123 3   90.3251 55  71510 30327 424      28 127        syn-C2H3C(O)NH2, v=0
  105784.6869  0.0008 -4.4277 3   27.6756 23  71510 30311 8 3      11 7 4        syn-C2H3C(O)NH2, v=0
  105785.0702  0.0008 -4.4277 3   27.6756 23  71510 30311 8 4      11 7 5        syn-C2H3C(O)NH2, v=0
  105786.6794  0.0008 -6.0522 3   27.5139 31  71510 30315 313      14 312        syn-C2H3C(O)NH2, v=0
  105799.4401  0.0043 -5.9499 3  567.3786 99  71510 303493415      503318        syn-C2H3C(O)NH2, v=0
  105799.4401  0.0043 -5.9499 3  567.3786 99  71510 303493416      503317        syn-C2H3C(O)NH2, v=0
  105900.1856  0.0024 -5.7998 3  220.2126 57  71510 3032823 5      2922 8        syn-C2H3C(O)NH2, v=0
  105900.1856  0.0024 -5.7998 3  220.2126 57  71510 3032823 6      2922 7        syn-C2H3C(O)NH2, v=0
  105916.7711  0.0418 -7.0621 3 1436.7860185  71510 303924151      914250        syn-C2H3C(O)NH2, v=0
  105916.7711  0.0418 -7.0621 3 1436.7860185  71510 303924152      914249        syn-C2H3C(O)NH2, v=0
  105952.0953  0.0008 -4.5327 3   24.9837 21  71510 30310 8 2      10 7 3        syn-C2H3C(O)NH2, v=0
  105952.1817  0.0008 -4.5327 3   24.9837 21  71510 30310 8 3      10 7 4        syn-C2H3C(O)NH2, v=0
  106018.5664  0.0200 -3.9159 3   28.5619 33 -71510 30316 115      15 214        syn-C2H3C(O)NH2, v=0
  106037.1609  0.0200 -4.9644 3  330.3315 93 -71510 303461730      451827        syn-C2H3C(O)NH2, v=0
  106041.1027  0.0200 -4.9644 3  330.3315 93 -71510 303461729      451828        syn-C2H3C(O)NH2, v=0
  106051.1040  0.0019 -7.3438 3   21.0929 23  71510 30311 6 5      12 310        syn-C2H3C(O)NH2, v=0
  106060.5604  0.0028 -6.1619 3  265.2777 91  71510 30345 738      46 641        syn-C2H3C(O)NH2, v=0
  106066.3336  0.0200 -3.8008 3   29.0856 35 -71510 30317 017      16 116        syn-C2H3C(O)NH2, v=0
  106066.9659  0.0009 -5.9791 3   29.0856 35  71510 30317 117      16 116        syn-C2H3C(O)NH2, v=0
  106067.6402  0.0009 -5.9791 3   29.0855 35  71510 30317 017      16 016        syn-C2H3C(O)NH2, v=0
  106068.2504  0.0200 -3.8008 3   29.0855 35 -71510 30317 117      16 016        syn-C2H3C(O)NH2, v=0
  106077.4915  0.0008 -4.6869 3   22.5402 19  71510 303 9 8 1       9 7 2        syn-C2H3C(O)NH2, v=0
  106077.5069  0.0008 -4.6869 3   22.5402 19  71510 303 9 8 2       9 7 3        syn-C2H3C(O)NH2, v=0
  106079.5476  0.0008 -6.0141 3   28.5619 33  71510 30316 215      15 214        syn-C2H3C(O)NH2, v=0
  106084.4423  0.0028 -6.1617 3  265.2777 91  71510 30345 838      46 541        syn-C2H3C(O)NH2, v=0
  106103.1960  0.0019 -4.1879 3   61.4762 45  71510 30322 419      22 320        syn-C2H3C(O)NH2, v=0
  106108.8828  0.0200 -3.9862 3  254.9887 85 -71510 303421230      421131        syn-C2H3C(O)NH2, v=0
  106133.8234  0.0018 -7.2996 3   61.4752 45  71510 30322 419      22 220        syn-C2H3C(O)NH2, v=0
  106135.0477  0.0008 -6.0136 3   28.5580 33  71510 30316 115      15 114        syn-C2H3C(O)NH2, v=0
  106168.8552  0.0008 -4.9631 3   20.3440 17  71510 303 8 8 0       8 7 1        syn-C2H3C(O)NH2, v=0
  106168.8572  0.0008 -4.9631 3   20.3440 17  71510 303 8 8 1       8 7 2        syn-C2H3C(O)NH2, v=0
  106169.2860  0.0041 -6.4000 3  209.4324 75  71510 303371325      381028        syn-C2H3C(O)NH2, v=0
  106181.0910  0.0015 -4.7231 3  171.9935 69  71510 303341123      331222        syn-C2H3C(O)NH2, v=0
  106196.0508  0.0200 -3.9143 3   28.5580 33 -71510 30316 215      15 114        syn-C2H3C(O)NH2, v=0
  106243.5653  0.0005 -4.4107 3    9.0412 17  71510 303 8 4 5       7 3 4        syn-C2H3C(O)NH2, v=0
  106243.6029  0.0025 -3.9695 3  203.0959 77  71510 30338 929      38 830        syn-C2H3C(O)NH2, v=0
  106360.8196  0.0032 -6.3212 3  461.8928119  71510 303591049      60 952        syn-C2H3C(O)NH2, v=0
  106373.5400  0.0032 -6.3211 3  461.8928119  71510 303591149      60 852        syn-C2H3C(O)NH2, v=0
  106402.0535  0.0040 -7.2275 3   32.1003 31  71510 30315 510      16 215        syn-C2H3C(O)NH2, v=0
  106414.5398  0.0071 -5.9789 3  883.8437147  71510 303733142      723241        syn-C2H3C(O)NH2, v=0
  106414.5398  0.0071 -5.9789 3  883.8437147  71510 303733143      723240        syn-C2H3C(O)NH2, v=0
  106494.9445  0.0492 -7.0009 3 1064.0617175  71510 303872166      862463        syn-C2H3C(O)NH2, v=0
  106499.4857  0.0012 -5.0135 3  361.7833 97  71510 303481831      471928        syn-C2H3C(O)NH2, v=0
  106500.7844  0.0012 -5.0134 3  361.7833 97  71510 303481830      471929        syn-C2H3C(O)NH2, v=0
  106534.1341  0.0036 -5.8983 3  527.9675 95  71510 303473314      483217        syn-C2H3C(O)NH2, v=0
  106534.1341  0.0036 -5.8983 3  527.9675 95  71510 303473315      483216        syn-C2H3C(O)NH2, v=0
  106537.2210  0.0243 -6.5668 3  970.1463133  71510 303664323      674226        syn-C2H3C(O)NH2, v=0
  106537.2210  0.0243 -6.5668 3  970.1463133  71510 303664324      674225        syn-C2H3C(O)NH2, v=0
  106541.2779  0.0023 -5.8595 3  196.1815 53  71510 3032622 4      2721 7        syn-C2H3C(O)NH2, v=0
  106541.2779  0.0023 -5.8595 3  196.1815 53  71510 3032622 5      2721 6        syn-C2H3C(O)NH2, v=0
  106615.1840  0.0200 -4.0808 3  355.9693101 -71510 303501337      501238        syn-C2H3C(O)NH2, v=0
  106676.8308  0.0679 -7.1328 3 1192.1391187  71510 303932073      922370        syn-C2H3C(O)NH2, v=0
  106677.5399  0.0133 -6.8376 3  813.1569157  71510 303781464      791367        syn-C2H3C(O)NH2, v=0
  106681.5146  0.0133 -6.8375 3  813.1569157  71510 303781564      791267        syn-C2H3C(O)NH2, v=0
  106727.7576  0.0485 -7.1829 3 1501.6998189  71510 303944252      934351        syn-C2H3C(O)NH2, v=0
  106727.7576  0.0485 -7.1829 3 1501.6998189  71510 303944253      934350        syn-C2H3C(O)NH2, v=0
  106731.6831  0.0039 -6.2124 3  166.6484 73  71510 30336 531      37 434        syn-C2H3C(O)NH2, v=0
  106743.5082  0.0026 -3.9685 3  142.1279 65  71510 30332 725      32 626        syn-C2H3C(O)NH2, v=0
  106758.7029  0.0039 -6.2121 3  166.6484 73  71510 30336 631      37 334        syn-C2H3C(O)NH2, v=0
  106945.6927  0.0018 -4.0861 3   75.9452 49  71510 30324 520      24 421        syn-C2H3C(O)NH2, v=0
  106973.0004  0.0026 -3.9605 3  171.3100 71  71510 30335 827      35 728        syn-C2H3C(O)NH2, v=0
  107004.5830  0.0013 -5.0656 3  394.6795101  71510 303501932      492029        syn-C2H3C(O)NH2, v=0
  107005.0083  0.0013 -5.0656 3  394.6795101  71510 303501931      492030        syn-C2H3C(O)NH2, v=0
  107055.2812  0.0008 -6.0404 3   27.4065 31  71510 30315 213      14 212        syn-C2H3C(O)NH2, v=0
  107059.2527  0.0013 -4.2625 3   33.2563 33  71510 30316 313      15 412        syn-C2H3C(O)NH2, v=0
  107108.0260  0.0018 -7.2330 3   75.9398 49  71510 30324 520      24 321        syn-C2H3C(O)NH2, v=0
  107120.2750  0.0031 -7.3224 3  248.3674 85  71510 303421032      421033        syn-C2H3C(O)NH2, v=0
  107123.9267  0.0200 -3.9446 3  119.4174 59 -71510 30329 822      29 723        syn-C2H3C(O)NH2, v=0
  107159.5404  0.0088 -6.0701 3  934.9594151  71510 303753243      743342        syn-C2H3C(O)NH2, v=0
  107159.5404  0.0088 -6.0701 3  934.9594151  71510 303753244      743341        syn-C2H3C(O)NH2, v=0
  107169.3165  0.0023 -5.9500 3  173.5960 49  71510 3032421 3      2520 6        syn-C2H3C(O)NH2, v=0
  107169.3165  0.0023 -5.9500 3  173.5960 49  71510 3032421 4      2520 5        syn-C2H3C(O)NH2, v=0
  107261.1413  0.0031 -5.8528 3  489.9961 91  71510 303453213      463116        syn-C2H3C(O)NH2, v=0
  107261.1413  0.0031 -5.8528 3  489.9961 91  71510 303453214      463115        syn-C2H3C(O)NH2, v=0
  107288.1214  0.1011 -7.3841 3 1322.0513197  71510 303982177      972474        syn-C2H3C(O)NH2, v=0
  107326.7306  0.0206 -6.4754 3  918.3016129  71510 303644222      654125        syn-C2H3C(O)NH2, v=0
  107326.7306  0.0206 -6.4754 3  918.3016129  71510 303644223      654124        syn-C2H3C(O)NH2, v=0
  107372.5209  0.0010 -7.2439 3  101.7066 55  71510 30327 721      27 522        syn-C2H3C(O)NH2, v=0
  107386.1631  0.0044 -5.1832 3  209.4324 79  71510 30339 931      381028        syn-C2H3C(O)NH2, v=0
  107438.3466  0.0046 -6.8883 3   63.0492 47  71510 30323 221      24 124        syn-C2H3C(O)NH2, v=0
  107454.3488  0.0046 -6.8881 3   63.0492 47  71510 30323 321      24 024        syn-C2H3C(O)NH2, v=0
  107526.0680  0.0200 -4.2927 3    7.4358 13 -71510 303 6 5 2       5 4 1        syn-C2H3C(O)NH2, v=0
  107533.3639  0.0200 -4.2926 3    7.4355 13 -71510 303 6 5 1       5 4 2        syn-C2H3C(O)NH2, v=0
  107543.4920  0.0559 -7.3068 3 1568.0356193  71510 303964353      954452        syn-C2H3C(O)NH2, v=0
  107543.4920  0.0559 -7.3068 3 1568.0356193  71510 303964354      954451        syn-C2H3C(O)NH2, v=0
  107545.2443  0.0200 -5.1209 3  429.0194105 -71510 303522033      512130        syn-C2H3C(O)NH2, v=0
  107545.2443  0.0200 -5.1208 3  429.0194105 -71510 303522032      512131        syn-C2H3C(O)NH2, v=0
  107549.7870  0.0017 -4.0167 3   91.6646 53  71510 30326 621      26 522        syn-C2H3C(O)NH2, v=0
  107580.2038  0.0200 -4.0330 3  317.4019 95 -71510 303471334      471235        syn-C2H3C(O)NH2, v=0
  107685.9206  0.0758 -7.3560 3 1416.1228163  71510 303815130      825033        syn-C2H3C(O)NH2, v=0
  107685.9206  0.0758 -7.3560 3 1416.1228163  71510 303815131      825032        syn-C2H3C(O)NH2, v=0
  107720.1749  0.0039 -6.8838 3   47.2159 37  71510 30318 612      19 317        syn-C2H3C(O)NH2, v=0
  107783.2838  0.0022 -6.0866 3  152.4562 45  71510 3032220 2      2319 5        syn-C2H3C(O)NH2, v=0
  107783.2838  0.0022 -6.0866 3  152.4562 45  71510 3032220 3      2319 4        syn-C2H3C(O)NH2, v=0
  107902.5914  0.0232 -6.6093 3  931.4958165  71510 303821864      812161        syn-C2H3C(O)NH2, v=0
  107911.3799  0.0109 -6.1645 3  987.5081155  71510 303773344      763443        syn-C2H3C(O)NH2, v=0
  107911.3799  0.0109 -6.1645 3  987.5081155  71510 303773345      763442        syn-C2H3C(O)NH2, v=0
  107980.1767  0.0027 -5.8137 3  453.4649 87  71510 303433112      443015        syn-C2H3C(O)NH2, v=0
  107980.1767  0.0027 -5.8137 3  453.4649 87  71510 303433113      443014        syn-C2H3C(O)NH2, v=0
  108002.8260  0.0200 -3.9606 3   95.5317 51 -71510 30325 916      25 817        syn-C2H3C(O)NH2, v=0
  108014.2141  0.0048 -5.3365 3  266.3103 89  71510 303441035      431132        syn-C2H3C(O)NH2, v=0
  108109.7620  0.0173 -6.3882 3  867.8891125  71510 303624121      634024        syn-C2H3C(O)NH2, v=0
  108109.7620  0.0173 -6.3882 3  867.8891125  71510 303624122      634023        syn-C2H3C(O)NH2, v=0
  108111.8407  0.0736 -6.9887 3 1113.1730181  71510 303902071      892168        syn-C2H3C(O)NH2, v=0
  108115.5356  0.0200 -5.1792 3  464.8022109 -71510 303542134      532231        syn-C2H3C(O)NH2, v=0
  108115.5356  0.0200 -5.1792 3  464.8022109 -71510 303542133      532232        syn-C2H3C(O)NH2, v=0
  108184.9919  0.0018 -4.6812 3  150.6727 65  71510 303321022      311121        syn-C2H3C(O)NH2, v=0
  108226.0704  0.0223 -7.0106 3  921.1674167  71510 303831568      841471        syn-C2H3C(O)NH2, v=0
  108226.4763  0.0016 -7.2027 3   91.6421 53  71510 30326 621      26 422        syn-C2H3C(O)NH2, v=0
  108228.6209  0.0223 -7.0106 3  921.1674167  71510 303831668      841371        syn-C2H3C(O)NH2, v=0
  108243.3205  0.0032 -4.9281 3  150.8236 67  71510 30333 826      32 923        syn-C2H3C(O)NH2, v=0
  108262.7766  0.1076 -7.3745 3 1243.4331189  71510 303942371      932668        syn-C2H3C(O)NH2, v=0
  108306.1775  0.0007 -6.0555 3   25.3520 29  71510 30314 311      13 310        syn-C2H3C(O)NH2, v=0
  108382.0355  0.0021 -6.3023 3  132.7627 41  71510 3032019 1      2118 4        syn-C2H3C(O)NH2, v=0
  108382.0355  0.0021 -6.3023 3  132.7627 41  71510 3032019 2      2118 3        syn-C2H3C(O)NH2, v=0
  108391.2053  0.0039 -6.4176 3  544.3314129  71510 303641153      651056        syn-C2H3C(O)NH2, v=0
  108399.5433  0.0039 -6.4175 3  544.3314129  71510 303641253      65 956        syn-C2H3C(O)NH2, v=0
  108520.3464  0.0668 -7.2359 3 1353.3427159  71510 303795029      804932        syn-C2H3C(O)NH2, v=0
  108520.3464  0.0668 -7.2359 3 1353.3427159  71510 303795030      804931        syn-C2H3C(O)NH2, v=0
  108579.2111  0.0015 -3.9658 3  108.6205 57  71510 30328 722      28 623        syn-C2H3C(O)NH2, v=0
  108602.7100  0.0019 -4.5974 3   40.3060 39  71510 30319 118      19 019        syn-C2H3C(O)NH2, v=0
  108610.7282  0.0019 -4.5974 3   40.3060 39  71510 30319 218      19 119        syn-C2H3C(O)NH2, v=0
  108617.0660  0.0026 -6.1829 3  328.7797101  71510 30350 842      51 745        syn-C2H3C(O)NH2, v=0
  108633.2543  0.0026 -6.1828 3  328.7797101  71510 30350 942      51 645        syn-C2H3C(O)NH2, v=0
  108669.7192  0.0133 -6.2621 3 1041.4887159  71510 303793445      783544        syn-C2H3C(O)NH2, v=0
  108669.7192  0.0133 -6.2621 3 1041.4887159  71510 303793446      783543        syn-C2H3C(O)NH2, v=0
  108690.9193  0.0026 -5.7815 3  418.3747 83  71510 303413011      422914        syn-C2H3C(O)NH2, v=0
  108690.9193  0.0026 -5.7815 3  418.3747 83  71510 303413012      422913        syn-C2H3C(O)NH2, v=0
  108702.8320  0.0140 -6.4761 3  850.3775157  71510 303781860      772157        syn-C2H3C(O)NH2, v=0
  108711.0727  0.0200 -5.2408 3  502.0271113 -71510 303562235      552332        syn-C2H3C(O)NH2, v=0
  108711.0727  0.0200 -5.2408 3  502.0271113 -71510 303562234      552333        syn-C2H3C(O)NH2, v=0
  108786.4374  0.0006 -4.4014 3    8.9682 17  71510 303 8 4 4       7 3 5        syn-C2H3C(O)NH2, v=0
  108886.2104  0.0145 -6.3055 3  818.9097121  71510 303604020      613923        syn-C2H3C(O)NH2, v=0
  108886.2104  0.0145 -6.3055 3  818.9097121  71510 303604021      613922        syn-C2H3C(O)NH2, v=0
  108954.2406  0.0015 -4.7173 3  126.8735 61  71510 30330 823      29 920        syn-C2H3C(O)NH2, v=0
  108964.2930  0.0020 -6.6933 3  114.5155 37  71510 3031818 0      1917 3        syn-C2H3C(O)NH2, v=0
  108964.2930  0.0020 -6.6933 3  114.5155 37  71510 3031818 1      1917 2        syn-C2H3C(O)NH2, v=0
  109006.5565  0.0008 -4.0637 3   27.4065 31  71510 30315 313      14 212        syn-C2H3C(O)NH2, v=0
  109084.2084  0.0021 -6.8400 3   41.2697 33  71510 30316 7 9      17 414        syn-C2H3C(O)NH2, v=0
  109110.9384  0.0009 -6.0627 3   26.5301 29  71510 30314 410      13 4 9        syn-C2H3C(O)NH2, v=0
  109111.2626  0.0027 -7.2135 3   30.1697 27  71510 30313 7 7      14 410        syn-C2H3C(O)NH2, v=0
  109119.4662  0.0043 -6.4049 3  168.3537 67  71510 303331222      34 925        syn-C2H3C(O)NH2, v=0
  109236.9289  0.0037 -6.6569 3   65.0154 43  71510 30321 714      22 419        syn-C2H3C(O)NH2, v=0
  109293.1679  0.0029 -6.5100 3   79.5125 47  71510 30323 815      24 520        syn-C2H3C(O)NH2, v=0
  109328.1256  0.0018 -5.3055 3  540.6935117  71510 303582336      572433        syn-C2H3C(O)NH2, v=0
  109328.1300  0.0018 -5.3055 3  540.6935117  71510 303582335      572434        syn-C2H3C(O)NH2, v=0
  109348.5862  0.0586 -7.1194 3 1291.9863155  71510 303774928      784831        syn-C2H3C(O)NH2, v=0
  109348.5862  0.0586 -7.1194 3 1291.9863155  71510 303774929      784830        syn-C2H3C(O)NH2, v=0
  109393.0072  0.0025 -5.7572 3  384.7261 79  71510 303392910      402813        syn-C2H3C(O)NH2, v=0
  109393.0072  0.0025 -5.7572 3  384.7261 79  71510 303392911      402812        syn-C2H3C(O)NH2, v=0
  109432.4702  0.0026 -6.5298 3   73.7436 45  71510 30322 814      23 519        syn-C2H3C(O)NH2, v=0
  109434.2721  0.0162 -6.3628 3 1096.9002163  71510 303813546      803645        syn-C2H3C(O)NH2, v=0
  109434.2721  0.0162 -6.3628 3 1096.9002163  71510 303813547      803644        syn-C2H3C(O)NH2, v=0
  109464.2457  0.0016 -3.9223 3  142.5246 63  71510 303311021      31 922        syn-C2H3C(O)NH2, v=0
  109509.0401  0.0008 -6.9791 3   71.8610 31  71510 3031514 1      1414 0        syn-C2H3C(O)NH2, v=0
  109509.0401  0.0008 -6.9791 3   71.8610 31  71510 3031514 2      1414 1        syn-C2H3C(O)NH2, v=0
  109554.1188  0.0025 -4.5102 3   55.3967 41  71510 30320 515      19 614        syn-C2H3C(O)NH2, v=0
  109581.9087  0.0008 -6.6795 3   65.4861 31  71510 3031513 2      1413 1        syn-C2H3C(O)NH2, v=0
  109581.9087  0.0008 -6.6795 3   65.4861 31  71510 3031513 3      1413 2        syn-C2H3C(O)NH2, v=0
  109618.9917  0.0060 -6.6005 3  466.6646113  71510 303561839      571542        syn-C2H3C(O)NH2, v=0
  109643.8880  0.0044 -6.3079 3  129.3083 65  71510 30332 428      33 331        syn-C2H3C(O)NH2, v=0
  109655.9573  0.0120 -6.2272 3  771.3643117  71510 303583919      593822        syn-C2H3C(O)NH2, v=0
  109655.9573  0.0120 -6.2272 3  771.3643117  71510 303583920      593821        syn-C2H3C(O)NH2, v=0
  109663.8478  0.0043 -6.3077 3  129.3083 65  71510 30332 528      33 231        syn-C2H3C(O)NH2, v=0
  109672.7764  0.0008 -6.5061 3   59.5857 31  71510 3031512 3      1412 2        syn-C2H3C(O)NH2, v=0
  109672.7764  0.0008 -6.5061 3   59.5857 31  71510 3031512 4      1412 3        syn-C2H3C(O)NH2, v=0
  109677.6565  0.0357 -7.2016 3 1035.8566177  71510 303881672      891575        syn-C2H3C(O)NH2, v=0
  109679.2880  0.0357 -7.2016 3 1035.8566177  71510 303881772      891475        syn-C2H3C(O)NH2, v=0
  109775.3810  0.0022 -7.1853 3   98.0449 55  71510 30327 522      27 523        syn-C2H3C(O)NH2, v=0
  109788.7805  0.0008 -6.3854 3   54.1606 31  71510 3031511 4      1411 3        syn-C2H3C(O)NH2, v=0
  109788.7805  0.0008 -6.3854 3   54.1606 31  71510 3031511 5      1411 4        syn-C2H3C(O)NH2, v=0
  109829.5954  0.0033 -6.1577 3  217.9034 83  71510 30341 635      42 538        syn-C2H3C(O)NH2, v=0
  109848.7453  0.0033 -6.1576 3  217.9034 83  71510 30341 735      42 438        syn-C2H3C(O)NH2, v=0
  109941.0056  0.0008 -6.2940 3   49.2122 31  71510 3031510 6      1410 5        syn-C2H3C(O)NH2, v=0
  109941.0063  0.0008 -6.2940 3   49.2122 31  71510 3031510 5      1410 4        syn-C2H3C(O)NH2, v=0
  109963.9624  0.0200 -5.3733 3  580.8005121 -71510 303602437      592534        syn-C2H3C(O)NH2, v=0
  109963.9624  0.0200 -5.3733 3  580.8005121 -71510 303602436      592535        syn-C2H3C(O)NH2, v=0
  110045.1192  0.0008 -6.0326 3   29.5856 31  71510 30315 412      14 411        syn-C2H3C(O)NH2, v=0
  110062.0964  0.0013 -4.6603 3  138.3597 63  71510 30331 923      301020        syn-C2H3C(O)NH2, v=0
  110086.0329  0.0025 -5.7414 3  352.5198 75  71510 3033728 9      382712        syn-C2H3C(O)NH2, v=0
  110086.0329  0.0025 -5.7414 3  352.5198 75  71510 303372810      382711        syn-C2H3C(O)NH2, v=0
  110124.3668  0.0067 -5.7353 3  462.7226117  71510 303581346      571443        syn-C2H3C(O)NH2, v=0
  110147.5384  0.0008 -6.2216 3   44.7423 31  71510 30315 9 7      14 9 6        syn-C2H3C(O)NH2, v=0
  110147.5708  0.0008 -6.2216 3   44.7423 31  71510 30315 9 6      14 9 5        syn-C2H3C(O)NH2, v=0
  110163.5395  0.0022 -4.0069 3   98.0319 55  71510 30327 522      27 423        syn-C2H3C(O)NH2, v=0
  110170.6015  0.0513 -7.0067 3 1232.0548151  71510 303754827      764730        syn-C2H3C(O)NH2, v=0
  110170.6015  0.0513 -7.0067 3 1232.0548151  71510 303754828      764729        syn-C2H3C(O)NH2, v=0
  110204.7975  0.0194 -6.4666 3 1153.7417167  71510 303833647      823746        syn-C2H3C(O)NH2, v=0
  110204.7975  0.0194 -6.4666 3 1153.7417167  71510 303833648      823745        syn-C2H3C(O)NH2, v=0
  110299.3129  0.0053 -6.5355 3  633.4751139  71510 303691257      701160        syn-C2H3C(O)NH2, v=0
  110304.7424  0.0053 -6.5354 3  633.4751139  71510 303691357      701060        syn-C2H3C(O)NH2, v=0
  110341.4184  0.0275 -7.1462 3  825.2068151  71510 303752353      762056        syn-C2H3C(O)NH2, v=0
  110382.5706  0.0200 -3.9169 3  115.7134 57 -71510 30328 920      28 821        syn-C2H3C(O)NH2, v=0
  110418.8680  0.0099 -6.1536 3  725.2539113  71510 303563818      573721        syn-C2H3C(O)NH2, v=0
  110418.8680  0.0099 -6.1536 3  725.2539113  71510 303563819      573720        syn-C2H3C(O)NH2, v=0
  110439.5315  0.0008 -6.1626 3   40.7541 31  71510 30315 8 8      14 8 7        syn-C2H3C(O)NH2, v=0
  110440.5994  0.0008 -6.1626 3   40.7542 31  71510 30315 8 7      14 8 6        syn-C2H3C(O)NH2, v=0
  110612.7450  0.0200 -3.9218 3  108.6824 55 -71510 30327 919      27 820        syn-C2H3C(O)NH2, v=0
  110616.1572  0.0023 -5.4444 3  622.3474125  71510 303622538      612635        syn-C2H3C(O)NH2, v=0
  110616.1576  0.0023 -5.4444 3  622.3474125  71510 303622537      612636        syn-C2H3C(O)NH2, v=0
  110644.7598  0.0200 -3.9109 3  122.9906 59 -71510 30329 921      29 822        syn-C2H3C(O)NH2, v=0
  110674.4410  0.0200 -3.9546 3   89.2012 49 -71510 30324 915      24 816        syn-C2H3C(O)NH2, v=0
  110744.2389  0.0019 -4.3078 3   52.8248 43  71510 30321 219      21 120        syn-C2H3C(O)NH2, v=0
  110769.5374  0.0025 -5.7356 3  321.7562 71  71510 3033527 8      362611        syn-C2H3C(O)NH2, v=0
  110769.5374  0.0025 -5.7356 3  321.7562 71  71510 3033527 9      362610        syn-C2H3C(O)NH2, v=0
  110800.2322  0.0019 -4.3074 3   52.8249 43  71510 30321 319      21 220        syn-C2H3C(O)NH2, v=0
  110867.8787  0.0008 -6.1133 3   37.2537 31  71510 30315 7 9      14 7 8        syn-C2H3C(O)NH2, v=0
  110870.6862  0.0200 -4.0049 3   31.0426 33 -71510 30316 214      15 313        syn-C2H3C(O)NH2, v=0
  110891.6697  0.0008 -6.1131 3   37.2541 31  71510 30315 7 8      14 7 7        syn-C2H3C(O)NH2, v=0
  110908.2526  0.0013 -7.1957 3  108.5428 57  71510 30328 722      28 523        syn-C2H3C(O)NH2, v=0
  110923.8121  0.0200 -3.9231 3  126.8078 61 -71510 30330 823      30 724        syn-C2H3C(O)NH2, v=0
  110981.0920  0.0232 -6.5736 3 1212.0119171  71510 303853748      843847        syn-C2H3C(O)NH2, v=0
  110981.0920  0.0232 -6.5736 3 1212.0119171  71510 303853749      843846        syn-C2H3C(O)NH2, v=0
  110986.3468  0.0446 -6.8979 3 1173.5495147  71510 303734726      744629        syn-C2H3C(O)NH2, v=0
  110986.3468  0.0446 -6.8979 3 1173.5495147  71510 303734727      744628        syn-C2H3C(O)NH2, v=0
  110995.7348  0.0028 -6.2329 3  399.0035111  71510 30355 946      56 849        syn-C2H3C(O)NH2, v=0
  111004.9087  0.0200 -4.1086 3  400.5792107 -71510 303531439      531340        syn-C2H3C(O)NH2, v=0
  111006.5662  0.0028 -6.2328 3  399.0035111  71510 303551046      56 749        syn-C2H3C(O)NH2, v=0
  111174.7907  0.0081 -6.0848 3  680.5793109  71510 303543717      553620        syn-C2H3C(O)NH2, v=0
  111174.7907  0.0081 -6.0848 3  680.5793109  71510 303543718      553619        syn-C2H3C(O)NH2, v=0
  111187.8999  0.0200 -4.0903 3  386.6612105 -71510 303521438      521339        syn-C2H3C(O)NH2, v=0
  111206.3065  0.0200 -3.9265 3  101.9030 53 -71510 30326 918      26 819        syn-C2H3C(O)NH2, v=0
  111242.7718  0.0043 -6.4452 3  131.7542 59  71510 303291119      30 822        syn-C2H3C(O)NH2, v=0
  111265.4285  0.0025 -4.8169 3  142.5246 65  71510 30332 825      31 922        syn-C2H3C(O)NH2, v=0
  111282.8967  0.0027 -5.5185 3  665.3334129  71510 303642639      632736        syn-C2H3C(O)NH2, v=0
  111282.8968  0.0027 -5.5185 3  665.3334129  71510 303642638      632737        syn-C2H3C(O)NH2, v=0
  111355.0992  0.0034 -6.5010 3   85.4868 49  71510 30324 816      25 521        syn-C2H3C(O)NH2, v=0
  111388.5661  0.0016 -5.5765 3   16.3973 23  71510 30311 4 7      11 110        syn-C2H3C(O)NH2, v=0
  111393.3432  0.0019 -4.7473 3  134.5429 63  71510 30331 824      30 921        syn-C2H3C(O)NH2, v=0
  111431.1788  0.0019 -4.3686 3   43.6454 37  71510 30318 414      17 513        syn-C2H3C(O)NH2, v=0
  111439.3291  0.0008 -6.0718 3   34.2495 31  71510 30315 610      14 6 9        syn-C2H3C(O)NH2, v=0
  111443.0040  0.0025 -5.7413 3  292.4360 67  71510 3033326 7      342510        syn-C2H3C(O)NH2, v=0
  111443.0040  0.0025 -5.7413 3  292.4360 67  71510 3033326 8      3425 9        syn-C2H3C(O)NH2, v=0
  111445.3431  0.0307 -6.7738 3  990.1857169  71510 303842064      832361        syn-C2H3C(O)NH2, v=0
  111490.5133  0.0024 -6.5605 3   68.1826 43  71510 30321 813      22 518        syn-C2H3C(O)NH2, v=0
  111517.6247  0.0200 -3.9033 3  130.5079 61 -71510 30330 922      30 823        syn-C2H3C(O)NH2, v=0
  111517.7788  0.0028 -4.5923 3   89.1151 51  71510 30325 718      24 817        syn-C2H3C(O)NH2, v=0
  111557.2842  0.0033 -6.8794 3   48.8429 35  71510 30317 810      18 513        syn-C2H3C(O)NH2, v=0
  111655.6481  0.0008 -6.0409 3   31.7329 31  71510 30315 511      14 510        syn-C2H3C(O)NH2, v=0
  111762.9849  0.0275 -6.6837 3 1271.7099175  71510 303873849      863948        syn-C2H3C(O)NH2, v=0
  111762.9849  0.0275 -6.6837 3 1271.7099175  71510 303873850      863947        syn-C2H3C(O)NH2, v=0
  111777.3256  0.0009 -6.0691 3   34.2586 31  71510 30315 6 9      14 6 8        syn-C2H3C(O)NH2, v=0
  111793.0901  0.0006 -4.3701 3   11.0726 19  71510 303 9 4 6       8 3 5        syn-C2H3C(O)NH2, v=0
  111795.7692  0.0387 -6.7929 3 1116.4713143  71510 303714625      724528        syn-C2H3C(O)NH2, v=0
  111795.7692  0.0387 -6.7929 3 1116.4713143  71510 303714626      724527        syn-C2H3C(O)NH2, v=0
  111807.6592  0.0200 -6.5344 3  910.8442163  71510 303811863      802160        syn-C2H3C(O)NH2, v=0
  111860.5585  0.0030 -7.2434 3  213.0145 79  71510 30339 930      39 931        syn-C2H3C(O)NH2, v=0
  111923.5540  0.0066 -6.0210 3  637.3414105  71510 303523616      533519        syn-C2H3C(O)NH2, v=0
  111923.5540  0.0066 -6.0210 3  637.3414105  71510 303523617      533518        syn-C2H3C(O)NH2, v=0
  111955.0458  0.0046 -6.4954 3   96.4904 57  71510 30328 325      29 228        syn-C2H3C(O)NH2, v=0
  111962.6185  0.0032 -5.5959 3  709.7576133  71510 303662740      652837        syn-C2H3C(O)NH2, v=0
  111962.6186  0.0032 -5.5959 3  709.7576133  71510 303662739      652838        syn-C2H3C(O)NH2, v=0
  111968.6913  0.0046 -6.4953 3   96.4904 57  71510 30328 425      29 128        syn-C2H3C(O)NH2, v=0
  111978.6025  0.0020 -7.1964 3   81.7129 51  71510 30325 421      25 422        syn-C2H3C(O)NH2, v=0
  112002.8017  0.0019 -7.2575 3   66.6335 47  71510 30323 320      23 321        syn-C2H3C(O)NH2, v=0
  112008.5621  0.0199 -6.6004 3  918.9582163  71510 303811962      802259        syn-C2H3C(O)NH2, v=0
  112015.2048  0.0008 -5.9806 3   31.0426 33  71510 30316 314      15 313        syn-C2H3C(O)NH2, v=0
  112018.8007  0.0019 -4.1514 3   66.6329 47  71510 30323 320      23 221        syn-C2H3C(O)NH2, v=0
  112037.1518  0.0200 -3.9317 3   95.3796 51 -71510 30325 917      25 818        syn-C2H3C(O)NH2, v=0
  112067.4353  0.0020 -4.0570 3   81.7099 51  71510 30325 421      25 322        syn-C2H3C(O)NH2, v=0
  112067.7880  0.0017 -3.9145 3  189.7845 73  71510 303361125      361026        syn-C2H3C(O)NH2, v=0
  112093.5364  0.0086 -6.6735 3  729.3175149  71510 303741361      751264        syn-C2H3C(O)NH2, v=0
  112097.0528  0.0086 -6.6734 3  729.3175149  71510 303741461      751164        syn-C2H3C(O)NH2, v=0
  112105.8508  0.0025 -5.7608 3  264.5597 63  71510 3033125 6      3224 9        syn-C2H3C(O)NH2, v=0
  112105.8508  0.0025 -5.7608 3  264.5597 63  71510 3033125 7      3224 8        syn-C2H3C(O)NH2, v=0
  112112.3867  0.0200 -3.8396 3   32.1003 35 -71510 30317 116      16 215        syn-C2H3C(O)NH2, v=0
  112126.5235  0.0200 -3.7332 3   32.6236 37 -71510 30318 018      17 117        syn-C2H3C(O)NH2, v=0
  112126.8161  0.0009 -5.9133 3   32.6236 37  71510 30318 118      17 117        syn-C2H3C(O)NH2, v=0
  112127.1404  0.0009 -5.9133 3   32.6235 37  71510 30318 018      17 017        syn-C2H3C(O)NH2, v=0
  112127.4419  0.0200 -3.7332 3   32.6235 37 -71510 30318 118      17 017        syn-C2H3C(O)NH2, v=0
  112143.9118  0.0008 -5.9463 3   32.1003 35  71510 30317 216      16 215        syn-C2H3C(O)NH2, v=0
  112173.3789  0.0009 -5.9460 3   32.0983 35  71510 30317 116      16 115        syn-C2H3C(O)NH2, v=0
  112204.9263  0.0200 -3.8389 3   32.0983 35 -71510 30317 216      16 115        syn-C2H3C(O)NH2, v=0
  112206.0435  0.0022 -4.6275 3  130.8001 61  71510 30330 921      291020        syn-C2H3C(O)NH2, v=0
  112259.3913  0.0385 -6.7936 3 1046.7726175  71510 303871968      862265        syn-C2H3C(O)NH2, v=0
  112295.5772  0.0019 -4.1494 3   66.6335 47  71510 30323 420      23 321        syn-C2H3C(O)NH2, v=0
  112311.5762  0.0019 -7.2553 3   66.6329 47  71510 30323 420      23 221        syn-C2H3C(O)NH2, v=0
  112442.9841  0.0041 -6.5280 3   99.6353 51  71510 303251016      26 719        syn-C2H3C(O)NH2, v=0
  112550.3332  0.0324 -6.7969 3 1332.8344179  71510 303893950      884049        syn-C2H3C(O)NH2, v=0
  112550.3332  0.0324 -6.7969 3 1332.8344179  71510 303893951      884048        syn-C2H3C(O)NH2, v=0
  112589.8558  0.0090 -6.0077 3  617.6548135  71510 303671553      661650        syn-C2H3C(O)NH2, v=0
  112598.8076  0.0333 -6.6920 3 1060.8215139  71510 303694524      704427        syn-C2H3C(O)NH2, v=0
  112598.8076  0.0333 -6.6920 3 1060.8215139  71510 303694525      704426        syn-C2H3C(O)NH2, v=0
  112599.5132  0.0038 -6.6655 3   71.9980 43  71510 30321 913      22 616        syn-C2H3C(O)NH2, v=0
  112636.6899  0.0020 -4.0668 3  369.2094103  71510 303511338      511239        syn-C2H3C(O)NH2, v=0
  112654.0512  0.0040 -5.6764 3  755.6191137  71510 303682840      672939        syn-C2H3C(O)NH2, v=0
  112654.0512  0.0040 -5.6764 3  755.6191137  71510 303682841      672938        syn-C2H3C(O)NH2, v=0
  112664.9650  0.0053 -5.9626 3  595.5410101  71510 303503515      513418        syn-C2H3C(O)NH2, v=0
  112664.9650  0.0053 -5.9626 3  595.5410101  71510 303503516      513417        syn-C2H3C(O)NH2, v=0
  112670.4384  0.0027 -6.1463 3  275.8912 93  71510 30346 739      47 642        syn-C2H3C(O)NH2, v=0
  112678.6396  0.0200 -4.6490 3  158.6912 67 -71510 303331024      321121        syn-C2H3C(O)NH2, v=0
  112683.6972  0.0027 -6.1462 3  275.8912 93  71510 30346 839      47 542        syn-C2H3C(O)NH2, v=0
  112697.0530  0.0152 -6.4616 3  870.2768159  71510 303791861      782158        syn-C2H3C(O)NH2, v=0
  112716.8271  0.0200 -3.9553 3   83.1581 47 -71510 30323 914      23 815        syn-C2H3C(O)NH2, v=0
  112757.4233  0.0025 -5.7975 3  238.1277 59  71510 3032924 5      3023 8        syn-C2H3C(O)NH2, v=0
  112757.4233  0.0025 -5.7975 3  238.1277 59  71510 3032924 6      3023 7        syn-C2H3C(O)NH2, v=0
  112821.9455  0.0008 -5.9736 3   30.9775 33  71510 30316 214      15 213        syn-C2H3C(O)NH2, v=0
  112894.7395  0.0022 -4.0214 3  326.2739 97  71510 303481236      481137        syn-C2H3C(O)NH2, v=0
  112952.1375  0.0016 -3.9406 3  243.9519 83  71510 303411229      411130        syn-C2H3C(O)NH2, v=0
  112993.9429  0.0200 -3.9381 3   89.1151 49 -71510 30324 916      24 817        syn-C2H3C(O)NH2, v=0
  113094.9144  0.0008 -3.8936 3  138.2585 63  71510 30331 923      31 824        syn-C2H3C(O)NH2, v=0
  113121.8282  0.0024 -7.1569 3  122.8095 61  71510 30330 624      30 625        syn-C2H3C(O)NH2, v=0
  113138.6013  0.0019 -4.0492 3   81.7129 51  71510 30325 521      25 422        syn-C2H3C(O)NH2, v=0
  113142.3518  0.0039 -6.1960 3  175.0373 75  71510 30337 532      38 435        syn-C2H3C(O)NH2, v=0
  113157.0787  0.0039 -6.1959 3  175.0373 75  71510 30337 632      38 335        syn-C2H3C(O)NH2, v=0
  113218.7704  0.0033 -6.3085 3  475.9436121  71510 303601050      61 953        syn-C2H3C(O)NH2, v=0
  113225.9431  0.0033 -6.3085 3  475.9436121  71510 303601150      61 853        syn-C2H3C(O)NH2, v=0
  113227.4341  0.0019 -7.1877 3   81.7099 51  71510 30325 521      25 322        syn-C2H3C(O)NH2, v=0
  113260.9823  0.0015 -3.9912 3  305.0206 93  71510 303461333      461234        syn-C2H3C(O)NH2, v=0
  113285.9364  0.0007 -5.9855 3    3.4758 13  71510 303 6 3 4       5 0 5        syn-C2H3C(O)NH2, v=0
  113343.0181  0.0379 -6.9132 3 1395.3843183  71510 303914051      904150        syn-C2H3C(O)NH2, v=0
  113343.0181  0.0379 -6.9132 3 1395.3843183  71510 303914052      904149        syn-C2H3C(O)NH2, v=0
  113356.1382  0.0050 -5.7600 3  802.9171141  71510 303702941      693040        syn-C2H3C(O)NH2, v=0
  113356.1382  0.0050 -5.7600 3  802.9171141  71510 303702942      693039        syn-C2H3C(O)NH2, v=0
  113395.3917  0.0286 -6.5951 3 1006.6010135  71510 303674423      684326        syn-C2H3C(O)NH2, v=0
  113395.3917  0.0286 -6.5951 3 1006.6010135  71510 303674424      684325        syn-C2H3C(O)NH2, v=0
  113396.9856  0.0024 -5.8567 3  213.1405 55  71510 3032723 4      2822 7        syn-C2H3C(O)NH2, v=0
  113396.9856  0.0024 -5.8567 3  213.1405 55  71510 3032723 5      2822 6        syn-C2H3C(O)NH2, v=0
  113398.8067  0.0044 -5.9099 3  555.1789 97  71510 303483414      493317        syn-C2H3C(O)NH2, v=0
  113398.8067  0.0044 -5.9099 3  555.1789 97  71510 303483415      493316        syn-C2H3C(O)NH2, v=0
  113550.3980  0.0018 -3.9825 3   98.0449 55  71510 30327 622      27 523        syn-C2H3C(O)NH2, v=0
  113564.6665  0.0173 -6.4834 3  890.4350161  71510 303801862      792159        syn-C2H3C(O)NH2, v=0
  113566.0021  0.0047 -6.8718 3   68.2041 49  71510 30324 222      25 125        syn-C2H3C(O)NH2, v=0
  113574.2848  0.0047 -6.8718 3   68.2041 49  71510 30324 322      25 025        syn-C2H3C(O)NH2, v=0
  113712.6017  0.0013 -4.6633 3  180.4868 71  71510 303351125      341222        syn-C2H3C(O)NH2, v=0
  113779.8941  0.0147 -6.8307 3  831.8521159  71510 303791465      801368        syn-C2H3C(O)NH2, v=0
  113782.1611  0.0147 -6.8307 3  831.8521159  71510 303791565      801268        syn-C2H3C(O)NH2, v=0
  113928.3005  0.0021 -6.9295 3   37.1529 31  71510 30315 7 8      16 413        syn-C2H3C(O)NH2, v=0
  113938.5564  0.0017 -7.1568 3   98.0319 55  71510 30327 622      27 423        syn-C2H3C(O)NH2, v=0
  113946.7784  0.0208 -6.3297 3  794.7433153  71510 303761760      751857        syn-C2H3C(O)NH2, v=0
  113953.6456  0.0023 -3.9473 3  122.7818 61  71510 30330 624      30 525        syn-C2H3C(O)NH2, v=0
  113966.4802  0.0008 -3.9785 3   30.9775 33  71510 30316 314      15 213        syn-C2H3C(O)NH2, v=0
  113987.4454  0.0008 -3.9462 3   83.1116 47  71510 30323 915      23 816        syn-C2H3C(O)NH2, v=0
  114023.7116  0.0024 -5.9467 3  189.5984 51  71510 3032522 3      2621 6        syn-C2H3C(O)NH2, v=0
  114023.7116  0.0024 -5.9467 3  189.5984 51  71510 3032522 4      2621 5        syn-C2H3C(O)NH2, v=0
  114038.4028  0.0016 -3.9360 3  115.6135 59  71510 30329 723      29 624        syn-C2H3C(O)NH2, v=0
  114053.4110  0.0013 -4.6906 3  203.7384 75  71510 303371226      361323        syn-C2H3C(O)NH2, v=0
  114067.9969  0.0062 -5.8468 3  851.6508145  71510 303723043      713140        syn-C2H3C(O)NH2, v=0
  114067.9970  0.0062 -5.8468 3  851.6508145  71510 303723042      713141        syn-C2H3C(O)NH2, v=0
  114124.8355  0.0037 -5.8631 3  516.2558 93  71510 303463313      473216        syn-C2H3C(O)NH2, v=0
  114124.8355  0.0037 -5.8631 3  516.2558 93  71510 303463314      473215        syn-C2H3C(O)NH2, v=0
  114140.9415  0.0442 -7.0327 3 1459.3583187  71510 303934152      924251        syn-C2H3C(O)NH2, v=0
  114140.9415  0.0442 -7.0327 3 1459.3583187  71510 303934153      924250        syn-C2H3C(O)NH2, v=0
  114170.0918  0.0012 -4.7248 3  228.4420 79  71510 303391327      381424        syn-C2H3C(O)NH2, v=0
  114185.4411  0.0244 -6.5023 3  953.8110131  71510 303654322      664225        syn-C2H3C(O)NH2, v=0
  114185.4411  0.0244 -6.5023 3  953.8110131  71510 303654323      664224        syn-C2H3C(O)NH2, v=0
  114202.7101  0.0017 -4.1114 3  414.6919109  71510 303541440      541341        syn-C2H3C(O)NH2, v=0
  114242.1426  0.0010 -6.0204 3   31.8388 31  71510 30315 510      14 5 9        syn-C2H3C(O)NH2, v=0
  114245.7612  0.0023 -3.9785 3  285.8915 91  71510 303451134      451035        syn-C2H3C(O)NH2, v=0
  114273.0494  0.0012 -4.7636 3  254.5951 83  71510 303411428      401525        syn-C2H3C(O)NH2, v=0
  114289.2388  0.0008 -3.9615 3   77.3939 45  71510 30322 913      22 814        syn-C2H3C(O)NH2, v=0
  114337.2374  0.0027 -6.4003 3  101.8325 53  71510 30326 917      27 622        syn-C2H3C(O)NH2, v=0
  114356.2515  0.0030 -6.3918 3  108.6205 55  71510 30327 918      28 623        syn-C2H3C(O)NH2, v=0
  114366.9289  0.0016 -5.3832 3    6.3485 17  71510 303 8 2 6       7 1 7        syn-C2H3C(O)NH2, v=0
  114391.2808  0.0028 -7.1882 3  180.3007 73  71510 30336 828      36 829        syn-C2H3C(O)NH2, v=0
  114426.1612  0.0014 -3.8939 3  134.5429 61  71510 303301020      30 921        syn-C2H3C(O)NH2, v=0
  114438.6353  0.0012 -4.8058 3  282.1963 87  71510 303431529      421626        syn-C2H3C(O)NH2, v=0
  114458.1000  0.0012 -4.7621 3  254.5948 83  71510 303411427      401526        syn-C2H3C(O)NH2, v=0
  114475.8491  0.0012 -4.0576 3  372.9666103  71510 303511437      511338        syn-C2H3C(O)NH2, v=0
  114505.0467  0.0012 -4.8053 3  282.1962 87  71510 303431528      421627        syn-C2H3C(O)NH2, v=0
  114591.7380  0.0052 -6.5012 3  404.2819105  71510 303521736      531439        syn-C2H3C(O)NH2, v=0
  114636.6761  0.0023 -6.0831 3  167.5018 47  71510 3032321 2      2420 5        syn-C2H3C(O)NH2, v=0
  114636.6761  0.0023 -6.0831 3  167.5018 47  71510 3032321 3      2420 4        syn-C2H3C(O)NH2, v=0
  114670.8328  0.0013 -4.7209 3  228.4412 79  71510 303391326      381425        syn-C2H3C(O)NH2, v=0
  114680.0917  0.0019 -4.5588 3   44.4504 41  71510 30320 119      20 020        syn-C2H3C(O)NH2, v=0
  114683.9759  0.0012 -4.8511 3  311.2445 91  71510 303451630      441727        syn-C2H3C(O)NH2, v=0
  114684.1203  0.0019 -4.5587 3   44.4504 41  71510 30320 219      20 120        syn-C2H3C(O)NH2, v=0
  114707.2390  0.0012 -4.8509 3  311.2445 91  71510 303451629      441728        syn-C2H3C(O)NH2, v=0
  114750.3170  0.0026 -7.1587 3  150.2305 67  71510 30333 726      33 727        syn-C2H3C(O)NH2, v=0
  114781.1562  0.0006 -4.2382 3    8.9040 15  71510 303 7 5 3       6 4 2        syn-C2H3C(O)NH2, v=0
  114788.8867  0.0078 -5.9368 3  901.8190149  71510 303743143      733242        syn-C2H3C(O)NH2, v=0
  114788.8867  0.0078 -5.9368 3  901.8190149  71510 303743144      733241        syn-C2H3C(O)NH2, v=0
  114817.6788  0.0006 -4.2380 3    8.9029 15  71510 303 7 5 2       6 4 3        syn-C2H3C(O)NH2, v=0
  114825.8049  0.0007 -5.9831 3   28.9647 31  71510 30315 312      14 311        syn-C2H3C(O)NH2, v=0
  114842.7775  0.0032 -5.8228 3  478.7725 89  71510 303443212      453115        syn-C2H3C(O)NH2, v=0
  114842.7775  0.0032 -5.8228 3  478.7725 89  71510 303443213      453114        syn-C2H3C(O)NH2, v=0
  114944.0230  0.0511 -7.1552 3 1524.7554191  71510 303954253      944352        syn-C2H3C(O)NH2, v=0
  114944.0230  0.0511 -7.1552 3 1524.7554191  71510 303954254      944351        syn-C2H3C(O)NH2, v=0
  114953.0421  0.0008 -3.9568 3   77.3698 45  71510 30322 914      22 815        syn-C2H3C(O)NH2, v=0
  114968.8645  0.0207 -6.4138 3  902.4524127  71510 303634221      644124        syn-C2H3C(O)NH2, v=0
  114968.8645  0.0207 -6.4138 3  902.4524127  71510 303634222      644123        syn-C2H3C(O)NH2, v=0
  115004.2992  0.0012 -4.8994 3  341.7388 95  71510 303471731      461828        syn-C2H3C(O)NH2, v=0
  115011.3900  0.0610 -7.0091 3 1168.7605185  71510 303922072      912369        syn-C2H3C(O)NH2, v=0
  115012.2830  0.0012 -4.8994 3  341.7388 95  71510 303471730      461829        syn-C2H3C(O)NH2, v=0
  115208.0021  0.0023 -6.6033 3   62.8329 41  71510 30320 812      21 517        syn-C2H3C(O)NH2, v=0
  115234.8468  0.0022 -6.2988 3  146.8510 43  71510 3032120 1      2219 4        syn-C2H3C(O)NH2, v=0
  115234.8468  0.0022 -6.2988 3  146.8510 43  71510 3032120 2      2219 3        syn-C2H3C(O)NH2, v=0
  115296.8520  0.0026 -6.1694 3  340.6061103  71510 30351 843      52 746        syn-C2H3C(O)NH2, v=0
  115302.4196  0.0041 -6.4074 3  559.5942131  71510 303651154      661057        syn-C2H3C(O)NH2, v=0
  115305.8722  0.0026 -6.1694 3  340.6061103  71510 30351 943      52 646        syn-C2H3C(O)NH2, v=0
  115307.1300  0.0041 -6.4073 3  559.5942131  71510 303651254      66 957        syn-C2H3C(O)NH2, v=0
  115359.9390  0.0014 -4.6802 3  203.7362 75  71510 303371225      361324        syn-C2H3C(O)NH2, v=0
  115362.6038  0.0244 -7.0063 3  941.0719169  71510 303841569      851472        syn-C2H3C(O)NH2, v=0
  115362.6488  0.0756 -7.2774 3 1396.1561161  71510 303805129      815032        syn-C2H3C(O)NH2, v=0
  115362.6488  0.0756 -7.2774 3 1396.1561161  71510 303805130      815031        syn-C2H3C(O)NH2, v=0
  115364.0599  0.0244 -7.0063 3  941.0719169  71510 303841669      851372        syn-C2H3C(O)NH2, v=0
  115388.9102  0.0013 -4.9508 3  373.6784 99  71510 303491832      481929        syn-C2H3C(O)NH2, v=0
  115391.6026  0.0013 -4.9508 3  373.6784 99  71510 303491831      481930        syn-C2H3C(O)NH2, v=0
  115401.9648  0.0014 -3.9003 3  134.4091 63  71510 30331 824      31 725        syn-C2H3C(O)NH2, v=0
  115434.9465  0.0009 -3.8817 3  146.2361 65  71510 30332 924      32 825        syn-C2H3C(O)NH2, v=0
  115443.5013  0.0015 -7.1505 3  115.5666 59  71510 30329 723      29 524        syn-C2H3C(O)NH2, v=0
  115480.0744  0.0505 -6.6946 3  993.9031171  71510 303851967      842064        syn-C2H3C(O)NH2, v=0
  115518.1829  0.0096 -6.0299 3  953.4209153  71510 303763244      753343        syn-C2H3C(O)NH2, v=0
  115518.1829  0.0096 -6.0299 3  953.4209153  71510 303763245      753342        syn-C2H3C(O)NH2, v=0
  115518.9069  0.0008 -3.9725 3   71.9015 43  71510 30321 912      21 813        syn-C2H3C(O)NH2, v=0
  115552.3258  0.0029 -5.7895 3  442.7296 85  71510 303423111      433014        syn-C2H3C(O)NH2, v=0
  115552.3258  0.0029 -5.7895 3  442.7296 85  71510 303423112      433013        syn-C2H3C(O)NH2, v=0
  115745.5582  0.0174 -6.3296 3  852.5262123  71510 303614120      624023        syn-C2H3C(O)NH2, v=0
  115745.5582  0.0174 -6.3296 3  852.5262123  71510 303614121      624022        syn-C2H3C(O)NH2, v=0
  115752.1983  0.0589 -7.2808 3 1591.5741195  71510 303974354      964453        syn-C2H3C(O)NH2, v=0
  115752.1983  0.0589 -7.2808 3 1591.5741195  71510 303974355      964452        syn-C2H3C(O)NH2, v=0
  115811.9826  0.0012 -4.7373 3    9.5218 19  71510 303 9 3 6       8 2 7        syn-C2H3C(O)NH2, v=0
  115817.0783  0.0021 -6.6902 3  127.6463 39  71510 3031919 0      2018 3        syn-C2H3C(O)NH2, v=0
  115817.0783  0.0021 -6.6902 3  127.6463 39  71510 3031919 1      2018 2        syn-C2H3C(O)NH2, v=0
  115827.0435  0.0013 -5.0052 3  407.0624103  71510 303511933      502030        syn-C2H3C(O)NH2, v=0
  115827.9378  0.0013 -5.0052 3  407.0624103  71510 303511932      502031        syn-C2H3C(O)NH2, v=0
  115849.4365  0.0008 -3.9701 3   71.8896 43  71510 30321 913      21 814        syn-C2H3C(O)NH2, v=0
  115905.1980  0.0024 -3.9421 3  248.0743 85  71510 303421032      42 933        syn-C2H3C(O)NH2, v=0
  115930.8274  0.0040 -6.5033 3   91.6646 51  71510 30325 817      26 522        syn-C2H3C(O)NH2, v=0
  115940.5771  0.0043 -6.2925 3  136.6862 67  71510 30333 429      34 332        syn-C2H3C(O)NH2, v=0
  115951.2788  0.0043 -6.2924 3  136.6862 67  71510 30333 529      34 232        syn-C2H3C(O)NH2, v=0
  115996.2728  0.0044 -6.6673 3   70.3792 45  71510 30322 715      23 420        syn-C2H3C(O)NH2, v=0
  116167.7142  0.0032 -7.3227 3  297.8430 93  71510 303461135      461136        syn-C2H3C(O)NH2, v=0
  116192.4508  0.0667 -7.1595 3 1333.8597157  71510 303785028      794931        syn-C2H3C(O)NH2, v=0
  116192.4508  0.0667 -7.1595 3 1333.8597157  71510 303785029      794930        syn-C2H3C(O)NH2, v=0
  116231.2583  0.0026 -6.2086 3   12.1005 21  71510 30310 3 7      10 010        syn-C2H3C(O)NH2, v=0
  116253.1360  0.0027 -5.7640 3  408.1279 81  71510 303403010      412913        syn-C2H3C(O)NH2, v=0
  116253.1360  0.0027 -5.7640 3  408.1279 81  71510 303403011      412912        syn-C2H3C(O)NH2, v=0
  116255.3577  0.0118 -6.1261 3 1006.4556157  71510 303783345      773444        syn-C2H3C(O)NH2, v=0
  116255.3577  0.0118 -6.1261 3 1006.4556157  71510 303783346      773443        syn-C2H3C(O)NH2, v=0
  116309.5440  0.0014 -5.0626 3  441.8901107  71510 303532034      522131        syn-C2H3C(O)NH2, v=0
  116309.8371  0.0014 -5.0626 3  441.8901107  71510 303532033      522132        syn-C2H3C(O)NH2, v=0
  116319.2096  0.0032 -6.1433 3  227.5053 85  71510 30342 636      43 539        syn-C2H3C(O)NH2, v=0
  116329.7118  0.0032 -6.1433 3  227.5053 85  71510 30342 736      43 439        syn-C2H3C(O)NH2, v=0
  116383.8537  0.0025 -6.4165 3   95.2521 51  71510 30325 916      26 621        syn-C2H3C(O)NH2, v=0
  116391.3682  0.0024 -3.9152 3  150.1758 67  71510 30333 726      33 627        syn-C2H3C(O)NH2, v=0
  116417.2375  0.0007 -4.3363 3   13.3849 21  71510 30310 4 7       9 3 6        syn-C2H3C(O)NH2, v=0
  116497.8696  0.0008 -3.9878 3   66.6758 41  71510 30320 911      20 812        syn-C2H3C(O)NH2, v=0
  116504.2894  0.0925 -7.2509 3 1297.4416195  71510 303972176      962473        syn-C2H3C(O)NH2, v=0
  116515.4051  0.0146 -6.2500 3  804.0333119  71510 303594019      603922        syn-C2H3C(O)NH2, v=0
  116515.4051  0.0146 -6.2500 3  804.0333119  71510 303594020      603921        syn-C2H3C(O)NH2, v=0
  116570.9601  0.0168 -6.9735 3  741.5945143  71510 303712250      721953        syn-C2H3C(O)NH2, v=0
  116607.0438  0.0047 -6.9084 3   51.7673 39  71510 30319 613      20 318        syn-C2H3C(O)NH2, v=0
  116654.4361  0.0008 -3.9867 3   66.6703 41  71510 30320 912      20 813        syn-C2H3C(O)NH2, v=0
  116745.2096  0.0035 -6.3911 3  115.6135 57  71510 30328 919      29 624        syn-C2H3C(O)NH2, v=0
  116799.7188  0.0009 -6.9443 3   82.3608 33  71510 3031615 1      1515 0        syn-C2H3C(O)NH2, v=0
  116799.7188  0.0009 -6.9443 3   82.3608 33  71510 3031615 2      1515 1        syn-C2H3C(O)NH2, v=0
  116814.2947  0.0008 -5.9575 3   33.2563 33  71510 30316 413      15 412        syn-C2H3C(O)NH2, v=0
  116829.0487  0.0015 -5.1231 3  478.1607111  71510 303552135      542232        syn-C2H3C(O)NH2, v=0
  116829.1436  0.0015 -5.1231 3  478.1607111  71510 303552134      542233        syn-C2H3C(O)NH2, v=0
  116839.1677  0.0059 -5.5091 3  386.6612107  71510 303531242      521339        syn-C2H3C(O)NH2, v=0
  116844.5009  0.0386 -7.1998 3 1056.9693179  71510 303891673      901576        syn-C2H3C(O)NH2, v=0
  116845.4331  0.0386 -7.1998 3 1056.9693179  71510 303891773      901476        syn-C2H3C(O)NH2, v=0
  116871.5668  0.0009 -6.6427 3   75.5138 33  71510 3031614 2      1514 1        syn-C2H3C(O)NH2, v=0
  116871.5668  0.0009 -6.6427 3   75.5138 33  71510 3031614 3      1514 2        syn-C2H3C(O)NH2, v=0
  116879.1715  0.0011 -4.1081 3   37.1529 35  71510 30317 314      16 413        syn-C2H3C(O)NH2, v=0
  116897.1365  0.0020 -4.2707 3   57.5759 45  71510 30322 220      22 121        syn-C2H3C(O)NH2, v=0
  116926.7550  0.0020 -4.2705 3   57.5759 45  71510 30322 320      22 221        syn-C2H3C(O)NH2, v=0
  116944.8218  0.0026 -5.7471 3  374.9678 77  71510 3033829 9      392812        syn-C2H3C(O)NH2, v=0
  116944.8218  0.0026 -5.7471 3  374.9678 77  71510 303382910      392811        syn-C2H3C(O)NH2, v=0
  116959.5329  0.0009 -6.4674 3   69.1413 33  71510 3031613 3      1513 2        syn-C2H3C(O)NH2, v=0
  116959.5329  0.0009 -6.4674 3   69.1413 33  71510 3031613 4      1513 3        syn-C2H3C(O)NH2, v=0
  116964.4464  0.0016 -4.6371 3  180.4805 71  71510 303351124      341223        syn-C2H3C(O)NH2, v=0
  116999.9635  0.0144 -6.2255 3 1060.9219161  71510 303803446      793545        syn-C2H3C(O)NH2, v=0
  116999.9635  0.0144 -6.2255 3 1060.9219161  71510 303803447      793544        syn-C2H3C(O)NH2, v=0
  117015.8908  0.0585 -7.0454 3 1272.9874153  71510 303764927      774830        syn-C2H3C(O)NH2, v=0
  117015.8908  0.0585 -7.0454 3 1272.9874153  71510 303764928      774829        syn-C2H3C(O)NH2, v=0
  117069.4523  0.0009 -6.3446 3   63.2439 33  71510 3031612 4      1512 3        syn-C2H3C(O)NH2, v=0
  117069.4523  0.0009 -6.3446 3   63.2439 33  71510 3031612 5      1512 4        syn-C2H3C(O)NH2, v=0
  117124.1656  0.0007 -4.3573 3   10.9244 19  71510 303 9 4 5       8 3 6        syn-C2H3C(O)NH2, v=0
  117149.2360  0.0025 -3.9166 3  212.8381 79  71510 30339 930      39 831        syn-C2H3C(O)NH2, v=0
  117210.0618  0.0009 -6.2512 3   57.8228 33  71510 3031611 6      1511 5        syn-C2H3C(O)NH2, v=0
  117210.0619  0.0009 -6.2512 3   57.8228 33  71510 3031611 5      1511 4        syn-C2H3C(O)NH2, v=0
  117236.1293  0.0012 -4.6185 3  146.1760 65  71510 30332 924      311021        syn-C2H3C(O)NH2, v=0
  117258.6203  0.0058 -6.5276 3  649.9492141  71510 303701258      711161        syn-C2H3C(O)NH2, v=0
  117261.6927  0.0058 -6.5276 3  649.9492141  71510 303701358      711061        syn-C2H3C(O)NH2, v=0
  117278.2729  0.0121 -6.1750 3  756.9748115  71510 303573918      583821        syn-C2H3C(O)NH2, v=0
  117278.2729  0.0121 -6.1750 3  756.9748115  71510 303573919      583820        syn-C2H3C(O)NH2, v=0
  117278.3181  0.0039 -4.9989 3  199.4560 77  71510 30338 930      371027        syn-C2H3C(O)NH2, v=0
  117281.4191  0.0048 -7.2727 3   35.8411 33  71510 30316 511      17 216        syn-C2H3C(O)NH2, v=0
  117289.5231  0.0008 -4.0074 3   61.7130 39  71510 30319 910      19 811        syn-C2H3C(O)NH2, v=0
  117351.7454  0.0008 -7.2511 3  119.0762 59  71510 30329 822      29 623        syn-C2H3C(O)NH2, v=0
  117359.8502  0.0008 -4.0069 3   61.7105 39  71510 30319 911      19 812        syn-C2H3C(O)NH2, v=0
  117379.7310  0.0017 -5.1868 3  515.8735115  71510 303572236      562333        syn-C2H3C(O)NH2, v=0
  117379.7615  0.0017 -5.1868 3  515.8735115  71510 303572235      562334        syn-C2H3C(O)NH2, v=0
  117394.9887  0.0009 -6.1767 3   52.8794 33  71510 3031610 7      1510 6        syn-C2H3C(O)NH2, v=0
  117394.9915  0.0009 -6.1767 3   52.8794 33  71510 3031610 6      1510 5        syn-C2H3C(O)NH2, v=0
  117399.6966  0.0021 -7.1312 3  104.6268 57  71510 30328 523      28 524        syn-C2H3C(O)NH2, v=0
  117421.0157  0.0025 -3.9062 3  180.1997 73  71510 30336 828      36 729        syn-C2H3C(O)NH2, v=0
  117439.6885  0.0009 -5.9714 3   30.1697 31  71510 30315 411      14 410        syn-C2H3C(O)NH2, v=0
  117522.8396  0.0008 -3.9130 3   34.7790 35  71510 30317 215      16 314        syn-C2H3C(O)NH2, v=0
  117619.1149  0.0021 -3.9647 3  104.6195 57  71510 30328 523      28 424        syn-C2H3C(O)NH2, v=0
  117626.9507  0.0026 -5.7402 3  343.2501 73  71510 3033628 8      372711        syn-C2H3C(O)NH2, v=0
  117626.9507  0.0026 -5.7402 3  343.2501 73  71510 3033628 9      372710        syn-C2H3C(O)NH2, v=0
  117646.6001  0.0009 -6.1157 3   48.4164 33  71510 30316 9 8      15 9 7        syn-C2H3C(O)NH2, v=0
  117646.7096  0.0009 -6.1157 3   48.4164 33  71510 30316 9 7      15 9 6        syn-C2H3C(O)NH2, v=0
  117669.2178  0.0008 -7.2042 3  126.5828 61  71510 30330 823      30 624        syn-C2H3C(O)NH2, v=0
  117739.5302  0.0029 -6.2217 3  412.0426113  71510 30356 947      57 850        syn-C2H3C(O)NH2, v=0
  117745.5840  0.0029 -6.2216 3  412.0426113  71510 303561047      57 750        syn-C2H3C(O)NH2, v=0
  117751.6201  0.0174 -6.3280 3 1116.8189165  71510 303823547      813646        syn-C2H3C(O)NH2, v=0
  117751.6201  0.0174 -6.3280 3 1116.8189165  71510 303823548      813645        syn-C2H3C(O)NH2, v=0
  117832.9225  0.0512 -6.9351 3 1213.5403149  71510 303744826      754729        syn-C2H3C(O)NH2, v=0
  117832.9225  0.0512 -6.9351 3 1213.5403149  71510 303744827      754728        syn-C2H3C(O)NH2, v=0
  117909.7960  0.0688 -7.0893 3 1163.5126183  71510 303912269      902566        syn-C2H3C(O)NH2, v=0
  117916.7231  0.1031 -7.0995 3 1215.0628189  71510 303942174      932271        syn-C2H3C(O)NH2, v=0
  117936.8171  0.0008 -4.0314 3   57.0100 37  71510 30318 9 9      18 810        syn-C2H3C(O)NH2, v=0
  117956.9797  0.0018 -5.2535 3  555.0275119  71510 303592337      582434        syn-C2H3C(O)NH2, v=0
  117956.9894  0.0018 -5.2535 3  555.0275119  71510 303592336      582435        syn-C2H3C(O)NH2, v=0
  117966.6391  0.0008 -4.0312 3   57.0090 37  71510 30318 910      18 811        syn-C2H3C(O)NH2, v=0
  118003.2576  0.0009 -6.0646 3   44.4380 33  71510 30316 8 9      15 8 8        syn-C2H3C(O)NH2, v=0
  118006.2626  0.0009 -6.0645 3   44.4381 33  71510 30316 8 8      15 8 7        syn-C2H3C(O)NH2, v=0
  118034.0132  0.0100 -6.1048 3  711.3514111  71510 303553817      563720        syn-C2H3C(O)NH2, v=0
  118034.0132  0.0100 -6.1048 3  711.3514111  71510 303553818      563719        syn-C2H3C(O)NH2, v=0
  118084.4763  0.0335 -6.6987 3 1024.8594173  71510 303861967      852264        syn-C2H3C(O)NH2, v=0
  118093.1657  0.0011 -4.1326 3  447.7525113  71510 303561541      561442        syn-C2H3C(O)NH2, v=0
  118151.4060  0.0047 -6.4807 3  102.8577 59  71510 30329 326      30 229        syn-C2H3C(O)NH2, v=0
  118158.5805  0.0047 -6.4806 3  102.8577 59  71510 30329 426      30 129        syn-C2H3C(O)NH2, v=0
  118176.8025  0.0008 -5.9145 3   34.7790 35  71510 30317 315      16 314        syn-C2H3C(O)NH2, v=0
  118179.2804  0.0013 -4.1527 3  462.7226115  71510 303571542      571443        syn-C2H3C(O)NH2, v=0
  118186.3761  0.0009 -3.6701 3   36.3637 39  71510 30319 019      18 118        syn-C2H3C(O)NH2, v=0
  118186.5157  0.0009 -5.8519 3   36.3637 39  71510 30319 119      18 118        syn-C2H3C(O)NH2, v=0
  118186.6708  0.0009 -5.8519 3   36.3637 39  71510 30319 019      18 018        syn-C2H3C(O)NH2, v=0
  118186.8104  0.0009 -3.6701 3   36.3637 39  71510 30319 119      18 018        syn-C2H3C(O)NH2, v=0
  118187.9831  0.0009 -3.7692 3   35.8411 37  71510 30318 117      17 216        syn-C2H3C(O)NH2, v=0
  118204.0982  0.0009 -5.8830 3   35.8411 37  71510 30318 217      17 216        syn-C2H3C(O)NH2, v=0
  118219.5094  0.0009 -5.8829 3   35.8400 37  71510 30318 117      17 116        syn-C2H3C(O)NH2, v=0
  118235.6244  0.0009 -3.7689 3   35.8400 37  71510 30318 217      17 116        syn-C2H3C(O)NH2, v=0
  118299.0377  0.0026 -5.7449 3  312.9753 69  71510 3033427 7      352610        syn-C2H3C(O)NH2, v=0
  118299.0377  0.0026 -5.7449 3  312.9753 69  71510 3033427 8      3526 9        syn-C2H3C(O)NH2, v=0
  118334.5543  0.0020 -7.2159 3   71.9926 49  71510 30324 321      24 322        syn-C2H3C(O)NH2, v=0
  118342.8355  0.0020 -4.1149 3   71.9923 49  71510 30324 321      24 222        syn-C2H3C(O)NH2, v=0
  118434.7827  0.0027 -6.3150 3  134.4091 61  71510 303301020      31 725        syn-C2H3C(O)NH2, v=0
  118444.2868  0.0012 -3.8733 3  126.8735 59  71510 303291019      29 920        syn-C2H3C(O)NH2, v=0
  118451.2252  0.0016 -3.8745 3  180.4309 71  71510 303351124      351025        syn-C2H3C(O)NH2, v=0
  118469.1601  0.0008 -4.0603 3   52.5644 35  71510 30317 9 8      17 8 9        syn-C2H3C(O)NH2, v=0
  118481.0275  0.0008 -4.0603 3   52.5640 35  71510 30317 9 9      17 810        syn-C2H3C(O)NH2, v=0
  118496.8877  0.0019 -4.1139 3   71.9926 49  71510 30324 421      24 322        syn-C2H3C(O)NH2, v=0
  118505.1689  0.0019 -7.2147 3   71.9923 49  71510 30324 421      24 222        syn-C2H3C(O)NH2, v=0
  118510.0044  0.0209 -6.4336 3 1174.1455169  71510 303843648      833747        syn-C2H3C(O)NH2, v=0
  118510.0044  0.0209 -6.4336 3 1174.1455169  71510 303843649      833746        syn-C2H3C(O)NH2, v=0
  118520.2357  0.0009 -6.0209 3   40.9518 33  71510 30316 710      15 7 9        syn-C2H3C(O)NH2, v=0
  118554.3408  0.0011 -3.8676 3  154.4342 67  71510 30333 925      33 826        syn-C2H3C(O)NH2, v=0
  118557.1205  0.0020 -5.3234 3  595.6221123  71510 303612438      602535        syn-C2H3C(O)NH2, v=0
  118557.1236  0.0020 -5.3234 3  595.6221123  71510 303612437      602536        syn-C2H3C(O)NH2, v=0
  118576.3592  0.0009 -6.0205 3   40.9531 33  71510 30316 7 9      15 7 8        syn-C2H3C(O)NH2, v=0
  118643.4922  0.0446 -6.8288 3 1155.5196145  71510 303724725      734628        syn-C2H3C(O)NH2, v=0
  118643.4922  0.0446 -6.8288 3 1155.5196145  71510 303724726      734627        syn-C2H3C(O)NH2, v=0
  118667.3743  0.0008 -5.9105 3   34.7408 35  71510 30317 215      16 214        syn-C2H3C(O)NH2, v=0
  118668.7657  0.0031 -6.3149 3  142.2176 63  71510 303311021      32 726        syn-C2H3C(O)NH2, v=0
  118714.1996  0.0020 -7.1510 3   87.6822 53  71510 30326 422      26 423        syn-C2H3C(O)NH2, v=0
  118762.2486  0.0020 -4.0194 3   87.6806 53  71510 30326 422      26 323        syn-C2H3C(O)NH2, v=0
  118782.4590  0.0082 -6.0398 3  667.1641107  71510 303533716      543619        syn-C2H3C(O)NH2, v=0
  118782.4590  0.0082 -6.0398 3  667.1641107  71510 303533717      543618        syn-C2H3C(O)NH2, v=0
  118907.3709  0.0008 -4.0949 3   48.3743 33  71510 30316 9 7      16 8 8        syn-C2H3C(O)NH2, v=0
  118911.7685  0.0008 -4.0948 3   48.3742 33  71510 30316 9 8      16 8 9        syn-C2H3C(O)NH2, v=0
  118941.5761  0.0027 -4.5516 3  112.3721 57  71510 30328 820      27 919        syn-C2H3C(O)NH2, v=0
  118960.5401  0.0026 -5.7636 3  284.1439 65  71510 3033226 6      3325 9        syn-C2H3C(O)NH2, v=0
  118960.5401  0.0026 -5.7636 3  284.1439 65  71510 3033226 7      3325 8        syn-C2H3C(O)NH2, v=0
  118994.5657  0.0044 -6.4237 3  346.3672 97  71510 303481633      491336        syn-C2H3C(O)NH2, v=0
  119017.2516  0.0011 -7.3019 3  111.7434 57  71510 30328 821      28 622        syn-C2H3C(O)NH2, v=0
  119085.8119  0.0008 -5.9588 3   35.4573 33  71510 30316 512      15 511        syn-C2H3C(O)NH2, v=0
  119096.1301  0.0095 -6.6681 3  747.0024151  71510 303751362      761265        syn-C2H3C(O)NH2, v=0
  119098.1229  0.0095 -6.6681 3  747.0024151  71510 303751462      761165        syn-C2H3C(O)NH2, v=0
  119137.9912  0.0009 -5.9839 3   37.9667 33  71510 30316 611      15 610        syn-C2H3C(O)NH2, v=0
  119177.1998  0.0024 -5.3964 3  637.6565127  71510 303632539      622636        syn-C2H3C(O)NH2, v=0
  119177.2007  0.0024 -5.3964 3  637.6565127  71510 303632538      622637        syn-C2H3C(O)NH2, v=0
  119233.8677  0.0027 -6.1340 3  286.7060 95  71510 30347 740      48 643        syn-C2H3C(O)NH2, v=0
  119241.1757  0.0027 -6.1339 3  286.7060 95  71510 30347 840      48 543        syn-C2H3C(O)NH2, v=0
  119266.9239  0.0009 -4.1362 3   44.4381 31  71510 30315 9 6      15 8 7        syn-C2H3C(O)NH2, v=0
  119268.4260  0.0009 -4.1362 3   44.4380 31  71510 30315 9 7      15 8 8        syn-C2H3C(O)NH2, v=0
  119274.8415  0.0248 -6.5423 3 1232.9005173  71510 303863749      853848        syn-C2H3C(O)NH2, v=0
  119274.8415  0.0248 -6.5423 3 1232.9005173  71510 303863750      853847        syn-C2H3C(O)NH2, v=0
  119275.2958  0.0028 -4.4710 3   74.0467 47  71510 30323 617      22 716        syn-C2H3C(O)NH2, v=0
  119321.3372  0.0008 -3.8987 3   34.7408 35  71510 30317 315      16 214        syn-C2H3C(O)NH2, v=0
  119390.8889  0.0019 -4.0150 3   87.6822 53  71510 30326 522      26 423        syn-C2H3C(O)NH2, v=0
  119438.9378  0.0019 -7.1462 3   87.6806 53  71510 30326 522      26 323        syn-C2H3C(O)NH2, v=0
  119447.5383  0.0387 -6.7263 3 1098.9265141  71510 303704624      714527        syn-C2H3C(O)NH2, v=0
  119447.5383  0.0387 -6.7263 3 1098.9265141  71510 303704625      714526        syn-C2H3C(O)NH2, v=0
  119518.0758  0.0038 -6.1825 3  183.6280 77  71510 30338 533      39 436        syn-C2H3C(O)NH2, v=0
  119523.4231  0.0067 -5.9800 3  624.4136103  71510 303513615      523518        syn-C2H3C(O)NH2, v=0
  119523.4231  0.0067 -5.9800 3  624.4136103  71510 303513616      523517        syn-C2H3C(O)NH2, v=0
  119526.0395  0.0038 -6.1825 3  183.6280 77  71510 30338 633      39 336        syn-C2H3C(O)NH2, v=0
  119555.1187  0.0198 -6.5502 3  939.6226165  71510 303821963      812260        syn-C2H3C(O)NH2, v=0
  119559.9524  0.0009 -4.1863 3   40.7542 29  71510 30314 9 5      14 8 6        syn-C2H3C(O)NH2, v=0
  119560.4191  0.0009 -4.1863 3   40.7541 29  71510 30314 9 6      14 8 7        syn-C2H3C(O)NH2, v=0
  119610.8504  0.0026 -5.7995 3  256.7564 61  71510 3033025 5      3124 8        syn-C2H3C(O)NH2, v=0
  119610.8504  0.0026 -5.7995 3  256.7564 61  71510 3033025 6      3124 7        syn-C2H3C(O)NH2, v=0
  119681.9952  0.0048 -6.8575 3   73.5612 51  71510 30325 223      26 126        syn-C2H3C(O)NH2, v=0
  119686.2471  0.0048 -6.8575 3   73.5612 51  71510 30325 323      26 026        syn-C2H3C(O)NH2, v=0
  119716.0306  0.0010 -7.1604 3  134.2652 63  71510 30331 824      31 625        syn-C2H3C(O)NH2, v=0
  119728.7380  0.0018 -3.9501 3  104.6268 57  71510 30328 623      28 524        syn-C2H3C(O)NH2, v=0
  119796.4347  0.0009 -4.2480 3   37.3213 27  71510 30313 9 4      13 8 5        syn-C2H3C(O)NH2, v=0
  119796.5642  0.0009 -4.2480 3   37.3213 27  71510 30313 9 5      13 8 6        syn-C2H3C(O)NH2, v=0
  119800.0554  0.0009 -5.9791 3   37.9871 33  71510 30316 610      15 6 9        syn-C2H3C(O)NH2, v=0
  119814.8208  0.0028 -5.4725 3  681.1297131  71510 303652640      642737        syn-C2H3C(O)NH2, v=0
  119814.8211  0.0028 -5.4725 3  681.1297131  71510 303652639      642738        syn-C2H3C(O)NH2, v=0
  119850.9255  0.0021 -7.0425 3   33.2563 29  71510 30314 7 7      15 412        syn-C2H3C(O)NH2, v=0
  119867.2591  0.0017 -3.9070 3  122.8095 61  71510 30330 724      30 625        syn-C2H3C(O)NH2, v=0
  119948.1564  0.0018 -7.1144 3  104.6195 57  71510 30328 623      28 424        syn-C2H3C(O)NH2, v=0
  119984.8766  0.0009 -4.3267 3   34.1384 25  71510 30312 9 3      12 8 4        syn-C2H3C(O)NH2, v=0
  119984.9079  0.0009 -4.3267 3   34.1384 25  71510 30312 9 4      12 8 5        syn-C2H3C(O)NH2, v=0
  120020.9062  0.0035 -6.2996 3  490.1950123  71510 303611051      62 954        syn-C2H3C(O)NH2, v=0
  120024.9256  0.0035 -6.2996 3  490.1950123  71510 303611151      62 854        syn-C2H3C(O)NH2, v=0
  120045.8976  0.0294 -6.6542 3 1293.0830177  71510 303883850      873949        syn-C2H3C(O)NH2, v=0
  120045.8976  0.0294 -6.6542 3 1293.0830177  71510 303883851      873948        syn-C2H3C(O)NH2, v=0
  120087.7328  0.0008 -4.3042 3   15.9775 23  71510 30311 4 8      10 3 7        syn-C2H3C(O)NH2, v=0
  120132.7014  0.0009 -4.4321 3   31.2042 23  71510 30311 9 2      11 8 3        syn-C2H3C(O)NH2, v=0
  120132.7077  0.0009 -4.4321 3   31.2042 23  71510 30311 9 3      11 8 4        syn-C2H3C(O)NH2, v=0
  120216.6875  0.0024 -6.4414 3   88.8829 49  71510 30324 915      25 620        syn-C2H3C(O)NH2, v=0
  120223.1642  0.0017 -3.8936 3  233.2214 81  71510 303401228      401129        syn-C2H3C(O)NH2, v=0
  120244.9904  0.0334 -6.6280 3 1043.7619137  71510 303684523      694426        syn-C2H3C(O)NH2, v=0
  120244.9904  0.0334 -6.6280 3 1043.7619137  71510 303684524      694425        syn-C2H3C(O)NH2, v=0
  120246.4742  0.0009 -4.5870 3   28.5179 21  71510 30310 9 1      10 8 2        syn-C2H3C(O)NH2, v=0
  120246.4752  0.0009 -4.5870 3   28.5179 21  71510 30310 9 2      10 8 3        syn-C2H3C(O)NH2, v=0
  120249.2896  0.0025 -5.8580 3  230.8132 57  71510 3032824 4      2923 7        syn-C2H3C(O)NH2, v=0
  120249.2896  0.0025 -5.8580 3  230.8132 57  71510 3032824 5      2923 6        syn-C2H3C(O)NH2, v=0
  120256.6959  0.0055 -5.9259 3  583.1008 99  71510 303493514      503417        syn-C2H3C(O)NH2, v=0
  120256.6959  0.0055 -5.9259 3  583.1008 99  71510 303493515      503416        syn-C2H3C(O)NH2, v=0
  120266.0122  0.0019 -4.5862 3  158.6739 67  71510 303331023      321122        syn-C2H3C(O)NH2, v=0
  120268.5482  0.0016 -4.0137 3  359.5256101  71510 303501436      501337        syn-C2H3C(O)NH2, v=0
  120332.0365  0.0009 -4.8645 3   26.0786 19  71510 303 9 9 0       9 8 1        syn-C2H3C(O)NH2, v=0
  120332.0366  0.0009 -4.8645 3   26.0786 19  71510 303 9 9 1       9 8 2        syn-C2H3C(O)NH2, v=0
  120337.3385  0.0023 -6.6598 3   57.6990 39  71510 30319 811      20 516        syn-C2H3C(O)NH2, v=0
  120413.8330  0.0025 -6.3204 3  126.8078 59  71510 303291019      30 724        syn-C2H3C(O)NH2, v=0
  120424.2148  0.0016 -3.9429 3  292.9230 91  71510 303451332      451233        syn-C2H3C(O)NH2, v=0
  120468.0223  0.0035 -5.5517 3  726.0411135  71510 303672741      662838        syn-C2H3C(O)NH2, v=0
  120468.0224  0.0035 -5.5517 3  726.0411135  71510 303672740      662839        syn-C2H3C(O)NH2, v=0
  120469.9485  0.0015 -3.8767 3  142.2176 65  71510 30332 825      32 726        syn-C2H3C(O)NH2, v=0
  120699.0765  0.0016 -7.1081 3  122.7818 61  71510 30330 724      30 525        syn-C2H3C(O)NH2, v=0
  120703.4683  0.0023 -4.1000 3  428.9753111  71510 303551441      551342        syn-C2H3C(O)NH2, v=0
  120752.9761  0.0020 -4.5230 3   48.7969 43  71510 30321 120      21 021        syn-C2H3C(O)NH2, v=0
  120754.9846  0.0020 -4.5230 3   48.7969 43  71510 30321 220      21 121        syn-C2H3C(O)NH2, v=0
  120821.3177  0.0162 -6.8278 3  850.7468161  71510 303801466      811369        syn-C2H3C(O)NH2, v=0
  120822.6042  0.0162 -6.8278 3  850.7468161  71510 303801566      811269        syn-C2H3C(O)NH2, v=0
  120822.9743  0.0345 -6.7691 3 1354.6916181  71510 303903951      894050        syn-C2H3C(O)NH2, v=0
  120822.9743  0.0345 -6.7691 3 1354.6916181  71510 303903952      894049        syn-C2H3C(O)NH2, v=0
  120875.1003  0.0025 -5.9475 3  206.3148 53  71510 3032623 3      2722 6        syn-C2H3C(O)NH2, v=0
  120875.1003  0.0025 -5.9475 3  206.3148 53  71510 3032623 4      2722 5        syn-C2H3C(O)NH2, v=0
  120892.8502  0.0008 -5.9196 3   32.7949 33  71510 30316 313      15 312        syn-C2H3C(O)NH2, v=0
  120964.4479  0.0051 -5.3046 3  317.4019 97  71510 303481138      471235        syn-C2H3C(O)NH2, v=0
  120982.0426  0.0045 -5.8779 3  543.2265 95  71510 303473413      483316        syn-C2H3C(O)NH2, v=0
  120982.0426  0.0045 -5.8779 3  543.2265 95  71510 303473414      483315        syn-C2H3C(O)NH2, v=0
  121035.2774  0.0022 -5.5609 3   19.1397 25  71510 30312 4 8      12 111        syn-C2H3C(O)NH2, v=0
  121035.7685  0.0287 -6.5338 3  990.0270133  71510 303664422      674325        syn-C2H3C(O)NH2, v=0
  121035.7685  0.0287 -6.5338 3  990.0270133  71510 303664423      674324        syn-C2H3C(O)NH2, v=0
  121135.1861  0.0043 -5.6341 3  772.3895139  71510 303692842      682939        syn-C2H3C(O)NH2, v=0
  121135.1862  0.0043 -5.6341 3  772.3895139  71510 303692841      682940        syn-C2H3C(O)NH2, v=0
  121277.3130  0.0014 -4.0982 3  433.0015111  71510 303551540      551441        syn-C2H3C(O)NH2, v=0
  121317.3797  0.0075 -5.7547 3  529.3317125  71510 303621449      611546        syn-C2H3C(O)NH2, v=0
  121324.9451  0.0013 -4.5897 3  166.9741 69  71510 303341025      331122        syn-C2H3C(O)NH2, v=0
  121385.2502  0.0045 -5.1303 3  254.9887 87  71510 303431034      421131        syn-C2H3C(O)NH2, v=0
  121440.6177  0.0036 -6.3204 3  150.2305 65  71510 303321022      33 727        syn-C2H3C(O)NH2, v=0
  121483.9645  0.0025 -4.0414 3  382.6089105  71510 303521339      521240        syn-C2H3C(O)NH2, v=0
  121487.4393  0.0024 -6.0835 3  183.2616 49  71510 3032422 2      2521 5        syn-C2H3C(O)NH2, v=0
  121487.4393  0.0024 -6.0835 3  183.2616 49  71510 3032422 3      2521 4        syn-C2H3C(O)NH2, v=0
  121522.5818  0.0007 -3.8418 3  150.0866 65  71510 303321023      32 924        syn-C2H3C(O)NH2, v=0
  121538.7916  0.0029 -7.2307 3  259.0377 87  71510 303431033      431034        syn-C2H3C(O)NH2, v=0
  121600.4728  0.0010 -3.8600 3  119.5077 57  71510 303281018      28 919        syn-C2H3C(O)NH2, v=0
  121605.9036  0.0403 -6.8872 3 1417.7253185  71510 303924052      914151        syn-C2H3C(O)NH2, v=0
  121605.9036  0.0403 -6.8872 3 1417.7253185  71510 303924053      914150        syn-C2H3C(O)NH2, v=0
  121650.0049  0.0022 -7.0985 3  130.2074 63  71510 30331 625      31 626        syn-C2H3C(O)NH2, v=0
  121699.2010  0.0038 -5.8363 3  504.7914 91  71510 303453312      463215        syn-C2H3C(O)NH2, v=0
  121699.2010  0.0038 -5.8363 3  504.7914 91  71510 303453313      463214        syn-C2H3C(O)NH2, v=0
  121702.6761  0.0007 -4.1000 3    9.5592 13  71510 303 6 6 1       5 5 0        syn-C2H3C(O)NH2, v=0
  121702.7232  0.0007 -4.1000 3    9.5592 13  71510 303 6 6 0       5 5 1        syn-C2H3C(O)NH2, v=0
  121748.2485  0.0007 -3.8408 3  158.3887 67  71510 303331024      33 925        syn-C2H3C(O)NH2, v=0
  121779.9341  0.0019 -4.1575 3  477.8825117  71510 303581543      581444        syn-C2H3C(O)NH2, v=0
  121814.9684  0.0054 -5.7196 3  820.1743143  71510 303712942      703041        syn-C2H3C(O)NH2, v=0
  121814.9684  0.0054 -5.7196 3  820.1743143  71510 303712943      703040        syn-C2H3C(O)NH2, v=0
  121819.7819  0.0245 -6.4438 3  937.7228129  71510 303644321      654224        syn-C2H3C(O)NH2, v=0
  121819.7819  0.0245 -6.4438 3  937.7228129  71510 303644322      654223        syn-C2H3C(O)NH2, v=0
  121821.6474  0.0007 -3.8416 3  142.0310 63  71510 303311022      31 923        syn-C2H3C(O)NH2, v=0
  121823.2419  0.0012 -7.2161 3    4.8393 13  71510 303 6 4 3       6 1 6        syn-C2H3C(O)NH2, v=0
  121836.8053  0.0041 -6.3991 3  122.8095 59  71510 30329 920      30 625        syn-C2H3C(O)NH2, v=0
  121855.2231  0.0028 -6.2643 3  171.4707 69  71510 303341123      35 828        syn-C2H3C(O)NH2, v=0
  121928.5784  0.0026 -6.1592 3  352.6336105  71510 30352 844      53 747        syn-C2H3C(O)NH2, v=0
  121933.5709  0.0026 -6.1592 3  352.6336105  71510 30352 944      53 647        syn-C2H3C(O)NH2, v=0
  121964.1179  0.0006 -4.1876 3   10.6231 17  71510 303 8 5 4       7 4 3        syn-C2H3C(O)NH2, v=0
  122085.3718  0.0023 -6.2990 3  161.6537 45  71510 3032221 1      2320 4        syn-C2H3C(O)NH2, v=0
  122085.3718  0.0023 -6.2990 3  161.6537 45  71510 3032221 2      2320 3        syn-C2H3C(O)NH2, v=0
  122097.8102  0.0006 -4.1869 3   10.6190 17  71510 303 8 5 3       7 4 4        syn-C2H3C(O)NH2, v=0
  122134.5038  0.0022 -3.9042 3  130.1913 63  71510 30331 625      31 526        syn-C2H3C(O)NH2, v=0
  122157.5374  0.0044 -6.4008 3  575.0573133  71510 303661155      671058        syn-C2H3C(O)NH2, v=0
  122160.1831  0.0044 -6.4007 3  575.0573133  71510 303661255      67 958        syn-C2H3C(O)NH2, v=0
  122190.3402  0.0287 -6.6226 3 1003.1791171  71510 303851966      842263        syn-C2H3C(O)NH2, v=0
  122211.5769  0.0043 -6.2797 3  144.2660 69  71510 30334 430      35 333        syn-C2H3C(O)NH2, v=0
  122217.2698  0.0043 -6.2796 3  144.2660 69  71510 30334 530      35 233        syn-C2H3C(O)NH2, v=0
  122353.5055  0.0032 -6.2708 3  180.3007 71  71510 303351124      36 829        syn-C2H3C(O)NH2, v=0
  122364.6507  0.0106 -6.8189 3  662.4330135  71510 303672147      681850        syn-C2H3C(O)NH2, v=0
  122369.7459  0.0540 -6.8991 3 1145.5971183  71510 303912071      902368        syn-C2H3C(O)NH2, v=0
  122394.5435  0.0467 -7.0083 3 1482.1828189  71510 303944153      934252        syn-C2H3C(O)NH2, v=0
  122394.5435  0.0467 -7.0083 3 1482.1828189  71510 303944154      934251        syn-C2H3C(O)NH2, v=0
  122407.8777  0.0033 -5.8018 3  467.7961 87  71510 303433211      443114        syn-C2H3C(O)NH2, v=0
  122407.8777  0.0033 -5.8018 3  467.7961 87  71510 303433212      443113        syn-C2H3C(O)NH2, v=0
  122427.2054  0.0012 -3.8516 3  162.8473 69  71510 30334 926      34 827        syn-C2H3C(O)NH2, v=0
  122438.7299  0.0266 -7.0059 3  961.1755171  71510 303851570      861473        syn-C2H3C(O)NH2, v=0
  122439.5572  0.0266 -7.0059 3  961.1755171  71510 303851670      861373        syn-C2H3C(O)NH2, v=0
  122506.2457  0.0068 -5.8083 3  869.3944147  71510 303733043      723142        syn-C2H3C(O)NH2, v=0
  122506.2457  0.0068 -5.8083 3  869.3944147  71510 303733044      723141        syn-C2H3C(O)NH2, v=0
  122515.7636  0.0007 -3.8409 3  134.2277 61  71510 303301021      30 922        syn-C2H3C(O)NH2, v=0
  122596.9283  0.0207 -6.3582 3  886.8503125  71510 303624220      634123        syn-C2H3C(O)NH2, v=0
  122596.9283  0.0207 -6.3582 3  886.8503125  71510 303624221      634122        syn-C2H3C(O)NH2, v=0
  122615.5239  0.0007 -3.8381 3  166.9310 69  71510 303341025      34 926        syn-C2H3C(O)NH2, v=0
  122667.8673  0.0023 -6.6905 3  141.4917 41  71510 3032020 0      2119 3        syn-C2H3C(O)NH2, v=0
  122667.8673  0.0023 -6.6905 3  141.4917 41  71510 3032020 1      2119 2        syn-C2H3C(O)NH2, v=0
  122733.6817  0.0431 -6.8604 3 1086.2383177  71510 303882167      872464        syn-C2H3C(O)NH2, v=0
  122770.7072  0.0032 -6.1318 3  237.3087 87  71510 30343 637      44 540        syn-C2H3C(O)NH2, v=0
  122776.4249  0.0032 -6.1318 3  237.3087 87  71510 30343 737      44 440        syn-C2H3C(O)NH2, v=0
  122784.3120  0.0040 -6.3691 3  292.9230 89  71510 303441530      451233        syn-C2H3C(O)NH2, v=0
  122916.3044  0.0009 -4.2684 3   18.8439 25  71510 30312 4 9      11 3 8        syn-C2H3C(O)NH2, v=0
  123023.2774  0.0010 -5.9292 3   35.6495 33  71510 30316 511      15 510        syn-C2H3C(O)NH2, v=0
  123027.2152  0.0755 -7.2042 3 1376.4360159  71510 303795128      805031        syn-C2H3C(O)NH2, v=0
  123027.2152  0.0755 -7.2042 3 1376.4360159  71510 303795129      805030        syn-C2H3C(O)NH2, v=0
  123032.2296  0.0020 -4.2366 3   62.5290 47  71510 30323 221      23 122        syn-C2H3C(O)NH2, v=0
  123036.3849  0.0013 -4.5970 3  189.2457 73  71510 303361126      351223        syn-C2H3C(O)NH2, v=0
  123047.7326  0.0020 -4.2365 3   62.5290 47  71510 30323 321      23 222        syn-C2H3C(O)NH2, v=0
  123104.1321  0.0280 -6.6821 3 1011.6089171  71510 303852065      842362        syn-C2H3C(O)NH2, v=0
  123107.7454  0.0030 -5.7751 3  432.2415 83  71510 303413110      423013        syn-C2H3C(O)NH2, v=0
  123107.7454  0.0030 -5.7751 3  432.2415 83  71510 303413111      423012        syn-C2H3C(O)NH2, v=0
  123135.9242  0.0013 -4.5997 3  154.2813 67  71510 30333 925      321022        syn-C2H3C(O)NH2, v=0
  123159.3077  0.0012 -7.1192 3  142.1279 65  71510 30332 825      32 626        syn-C2H3C(O)NH2, v=0
  123188.7751  0.0539 -7.1325 3 1548.0630193  71510 303964254      954353        syn-C2H3C(O)NH2, v=0
  123188.7751  0.0539 -7.1325 3 1548.0630193  71510 303964255      954352        syn-C2H3C(O)NH2, v=0
  123205.0748  0.0128 -6.0568 3  694.2291143  71510 303711656      701753        syn-C2H3C(O)NH2, v=0
  123208.0740  0.0085 -5.9000 3  920.0489151  71510 303753144      743243        syn-C2H3C(O)NH2, v=0
  123208.0740  0.0085 -5.9000 3  920.0489151  71510 303753145      743242        syn-C2H3C(O)NH2, v=0
  123349.9871  0.0047 -6.5186 3   98.0449 53  71510 30326 818      27 523        syn-C2H3C(O)NH2, v=0
  123362.2377  0.0026 -3.9851 3  338.7899 99  71510 303491237      491138        syn-C2H3C(O)NH2, v=0
  123367.0925  0.0175 -6.2772 3  837.4104121  71510 303604119      614022        syn-C2H3C(O)NH2, v=0
  123367.0925  0.0175 -6.2772 3  837.4104121  71510 303604120      614021        syn-C2H3C(O)NH2, v=0
  123420.4512  0.0008 -5.8895 3   37.1529 35  71510 30317 414      16 413        syn-C2H3C(O)NH2, v=0
  123425.9322  0.0215 -6.5427 3  960.5523167  71510 303831964      822261        syn-C2H3C(O)NH2, v=0
  123476.2342  0.0008 -3.8403 3  126.6813 59  71510 303291020      29 921        syn-C2H3C(O)NH2, v=0
  123595.1369  0.0013 -4.6225 3  212.9783 77  71510 303381227      371324        syn-C2H3C(O)NH2, v=0
  123703.9478  0.0012 -4.6575 3  238.1654 81  71510 303401328      391425        syn-C2H3C(O)NH2, v=0
  123709.0424  0.0012 -4.6979 3  264.8036 85  71510 303421429      411526        syn-C2H3C(O)NH2, v=0
  123717.7843  0.0026 -6.2613 3  162.8473 67  71510 303331122      34 827        syn-C2H3C(O)NH2, v=0
  123753.4855  0.0012 -4.7423 3  292.8907 89  71510 303441530      431627        syn-C2H3C(O)NH2, v=0
  123798.4386  0.0028 -5.7571 3  398.1281 79  71510 3033930 9      402912        syn-C2H3C(O)NH2, v=0
  123798.4386  0.0028 -5.7571 3  398.1281 79  71510 303393010      402911        syn-C2H3C(O)NH2, v=0
  123852.2283  0.0666 -7.0886 3 1314.6234155  71510 303775027      784930        syn-C2H3C(O)NH2, v=0
  123852.2283  0.0666 -7.0886 3 1314.6234155  71510 303775028      784929        syn-C2H3C(O)NH2, v=0
  123881.2683  0.0012 -4.7414 3  292.8905 89  71510 303441529      431628        syn-C2H3C(O)NH2, v=0
  123881.8556  0.0012 -4.7898 3  322.4254 93  71510 303461631      451728        syn-C2H3C(O)NH2, v=0
  123919.6563  0.0105 -5.9949 3  972.1369155  71510 303773245      763344        syn-C2H3C(O)NH2, v=0
  123919.6563  0.0105 -5.9949 3  972.1369155  71510 303773246      763343        syn-C2H3C(O)NH2, v=0
  123926.8128  0.0008 -3.8320 3   38.7210 37  71510 30318 216      17 315        syn-C2H3C(O)NH2, v=0
  123927.5285  0.0012 -4.7895 3  322.4254 93  71510 303461630      451729        syn-C2H3C(O)NH2, v=0
  123951.5049  0.0416 -7.2019 3 1078.2808181  71510 303901674      911577        syn-C2H3C(O)NH2, v=0
  123952.0351  0.0416 -7.2019 3 1078.2808181  71510 303901774      911477        syn-C2H3C(O)NH2, v=0
  123988.4990  0.0620 -7.2598 3 1615.3645197  71510 303984355      974454        syn-C2H3C(O)NH2, v=0
  123988.4990  0.0620 -7.2598 3 1615.3645197  71510 303984356      974453        syn-C2H3C(O)NH2, v=0
  123999.8323  0.0014 -3.8406 3  171.3992 69  71510 303341123      341024        syn-C2H3C(O)NH2, v=0
  124056.3530  0.0009 -3.8531 3  112.4350 55  71510 303271017      27 918        syn-C2H3C(O)NH2, v=0
  124057.0626  0.0012 -4.6954 3  264.8030 85  71510 303421428      411527        syn-C2H3C(O)NH2, v=0
  124065.5104  0.0018 -4.1887 3   48.0994 39  71510 30319 415      18 514        syn-C2H3C(O)NH2, v=0
  124089.3754  0.0009 -6.9145 3   93.5756 35  71510 3031716 1      1616 0        syn-C2H3C(O)NH2, v=0
  124089.3754  0.0009 -6.9145 3   93.5756 35  71510 3031716 2      1616 1        syn-C2H3C(O)NH2, v=0
  124098.0869  0.0012 -4.8404 3  353.4066 97  71510 303481732      471829        syn-C2H3C(O)NH2, v=0
  124114.0473  0.0012 -4.8403 3  353.4066 97  71510 303481731      471830        syn-C2H3C(O)NH2, v=0
  124130.1452  0.0146 -6.2008 3  789.4042117  71510 303584018      593921        syn-C2H3C(O)NH2, v=0
  124130.1452  0.0146 -6.2008 3  789.4042117  71510 303584019      593920        syn-C2H3C(O)NH2, v=0
  124132.8885  0.0246 -6.5690 3  981.7405169  71510 303841965      832262        syn-C2H3C(O)NH2, v=0
  124160.4681  0.0009 -6.6111 3   86.2568 35  71510 3031715 2      1615 1        syn-C2H3C(O)NH2, v=0
  124160.4681  0.0009 -6.6111 3   86.2568 35  71510 3031715 3      1615 2        syn-C2H3C(O)NH2, v=0
  124161.7035  0.0064 -6.5234 3  666.6235143  71510 303711259      721162        syn-C2H3C(O)NH2, v=0
  124163.4326  0.0064 -6.5234 3  666.6235143  71510 303711359      721062        syn-C2H3C(O)NH2, v=0
  124184.8838  0.0327 -6.4058 3  881.2580161  71510 303801863      791960        syn-C2H3C(O)NH2, v=0
  124215.1763  0.0008 -3.8332 3  175.7066 71  71510 303351026      35 927        syn-C2H3C(O)NH2, v=0
  124246.0166  0.0010 -3.6112 3   40.3060 41  71510 30320 020      19 119        syn-C2H3C(O)NH2, v=0
  124246.0825  0.0010 -5.7944 3   40.3060 41  71510 30320 120      19 119        syn-C2H3C(O)NH2, v=0
  124246.1301  0.0009 -6.4339 3   79.4122 35  71510 3031714 3      1614 2        syn-C2H3C(O)NH2, v=0
  124246.1301  0.0009 -6.4339 3   79.4122 35  71510 3031714 4      1614 3        syn-C2H3C(O)NH2, v=0
  124246.1563  0.0010 -5.7944 3   40.3060 41  71510 30320 020      19 019        syn-C2H3C(O)NH2, v=0
  124246.2221  0.0010 -3.6112 3   40.3060 41  71510 30320 120      19 019        syn-C2H3C(O)NH2, v=0
  124254.0806  0.0009 -3.7040 3   39.7839 39  71510 30319 118      18 217        syn-C2H3C(O)NH2, v=0
  124262.2384  0.0009 -5.8239 3   39.7839 39  71510 30319 218      18 217        syn-C2H3C(O)NH2, v=0
  124270.1957  0.0009 -5.8239 3   39.7834 39  71510 30319 118      18 117        syn-C2H3C(O)NH2, v=0
  124278.3535  0.0009 -3.7038 3   39.7834 39  71510 30319 218      18 117        syn-C2H3C(O)NH2, v=0
  124292.5473  0.0009 -5.8532 3   38.7210 37  71510 30318 316      17 315        syn-C2H3C(O)NH2, v=0
  124307.2796  0.0024 -6.3319 3  119.4174 57  71510 303281018      29 723        syn-C2H3C(O)NH2, v=0
  124311.7995  0.0033 -4.8461 3  189.7845 75  71510 30337 929      361026        syn-C2H3C(O)NH2, v=0
  124330.8023  0.0047 -6.4682 3  109.4271 61  71510 30330 327      31 230        syn-C2H3C(O)NH2, v=0
  124334.5453  0.0047 -6.4681 3  109.4271 61  71510 30330 427      31 130        syn-C2H3C(O)NH2, v=0
  124351.2182  0.0009 -6.3092 3   73.0427 35  71510 3031713 4      1613 3        syn-C2H3C(O)NH2, v=0
  124351.2182  0.0009 -6.3092 3   73.0427 35  71510 3031713 5      1613 4        syn-C2H3C(O)NH2, v=0
  124392.5549  0.0013 -4.8939 3  385.8333101  71510 303501833      491930        syn-C2H3C(O)NH2, v=0
  124398.0259  0.0013 -4.8939 3  385.8333101  71510 303501832      491931        syn-C2H3C(O)NH2, v=0
  124418.0584  0.0025 -4.3253 3   60.3853 43  71510 30321 516      20 615        syn-C2H3C(O)NH2, v=0
  124434.0180  0.0030 -6.2137 3  425.2826115  71510 30357 948      58 851        syn-C2H3C(O)NH2, v=0
  124437.3805  0.0030 -6.2137 3  425.2826115  71510 303571048      58 751        syn-C2H3C(O)NH2, v=0
  124470.7794  0.0024 -7.0938 3  158.4459 69  71510 30334 727      34 728        syn-C2H3C(O)NH2, v=0
  124479.5493  0.0027 -5.7491 3  365.4565 75  71510 3033729 8      382811        syn-C2H3C(O)NH2, v=0
  124479.5493  0.0027 -5.7491 3  365.4565 75  71510 3033729 9      382810        syn-C2H3C(O)NH2, v=0
  124482.7836  0.0009 -6.2139 3   67.1490 35  71510 3031712 5      1612 4        syn-C2H3C(O)NH2, v=0
  124482.7836  0.0009 -6.2139 3   67.1490 35  71510 3031712 6      1612 5        syn-C2H3C(O)NH2, v=0
  124580.7757  0.0009 -5.8510 3   38.6991 37  71510 30318 216      17 215        syn-C2H3C(O)NH2, v=0
  124587.1573  0.0008 -3.8406 3  119.3954 57  71510 303281019      28 920        syn-C2H3C(O)NH2, v=0
  124607.2529  0.0020 -7.1782 3   77.5535 51  71510 30325 322      25 323        syn-C2H3C(O)NH2, v=0
  124611.3891  0.0020 -7.0851 3  111.4100 59  71510 30329 524      29 525        syn-C2H3C(O)NH2, v=0
  124611.5042  0.0020 -4.0818 3   77.5533 51  71510 30325 322      25 223        syn-C2H3C(O)NH2, v=0
  124621.1910  0.0013 -4.6508 3  238.1639 81  71510 303401327      391426        syn-C2H3C(O)NH2, v=0
  124640.3172  0.0128 -6.0929 3 1025.6573159  71510 303793346      783445        syn-C2H3C(O)NH2, v=0
  124640.3172  0.0128 -6.0929 3 1025.6573159  71510 303793347      783444        syn-C2H3C(O)NH2, v=0
  124651.4190  0.0009 -6.1375 3   61.7325 35  71510 3031711 7      1611 6        syn-C2H3C(O)NH2, v=0
  124651.4192  0.0009 -6.1375 3   61.7325 35  71510 3031711 6      1611 5        syn-C2H3C(O)NH2, v=0
  124654.7959  0.0027 -7.1610 3  222.8669 81  71510 30340 931      40 932        syn-C2H3C(O)NH2, v=0
  124670.7016  0.0585 -6.9768 3 1254.2352151  71510 303754926      764829        syn-C2H3C(O)NH2, v=0
  124670.7016  0.0585 -6.9768 3 1254.2352151  71510 303754927      764828        syn-C2H3C(O)NH2, v=0
  124696.0857  0.0020 -4.0812 3   77.5535 51  71510 30325 422      25 323        syn-C2H3C(O)NH2, v=0
  124697.6221  0.0029 -6.2422 3  213.0145 77  71510 303381226      39 931        syn-C2H3C(O)NH2, v=0
  124700.3370  0.0020 -7.1776 3   77.5533 51  71510 30325 422      25 223        syn-C2H3C(O)NH2, v=0
  124733.8312  0.0020 -3.9284 3  111.4059 59  71510 30329 524      29 425        syn-C2H3C(O)NH2, v=0
  124753.0169  0.0014 -4.9504 3  419.7046105  71510 303521934      512031        syn-C2H3C(O)NH2, v=0
  124754.8613  0.0014 -4.9504 3  419.7046105  71510 303521933      512032        syn-C2H3C(O)NH2, v=0
  124873.7311  0.0009 -6.0745 3   56.7953 35  71510 3031710 8      1610 7        syn-C2H3C(O)NH2, v=0
  124873.7414  0.0009 -6.0745 3   56.7953 35  71510 3031710 7      1610 6        syn-C2H3C(O)NH2, v=0
  124876.3116  0.0009 -5.7516 3    4.8028 15  71510 303 7 3 5       6 0 6        syn-C2H3C(O)NH2, v=0
  124885.9414  0.0122 -6.1292 3  742.8324113  71510 303563917      573820        syn-C2H3C(O)NH2, v=0
  124885.9414  0.0122 -6.1292 3  742.8324113  71510 303563918      573819        syn-C2H3C(O)NH2, v=0
  124946.5103  0.0009 -3.8244 3   38.6991 37  71510 30318 316      17 215        syn-C2H3C(O)NH2, v=0
  124947.4608  0.0013 -4.1899 3  513.3103121  71510 303601644      601545        syn-C2H3C(O)NH2, v=0
  125044.2238  0.0834 -7.1293 3 1273.0387193  71510 303962175      952472        syn-C2H3C(O)NH2, v=0
  125107.0479  0.0010 -4.2253 3   21.9732 27  71510 30313 410      12 3 9        syn-C2H3C(O)NH2, v=0
  125150.6230  0.0027 -5.7527 3  334.2273 71  71510 3033528 7      362710        syn-C2H3C(O)NH2, v=0
  125150.6230  0.0027 -5.7527 3  334.2273 71  71510 3033528 8      3627 9        syn-C2H3C(O)NH2, v=0
  125168.3156  0.0015 -5.0100 3  455.0196109  71510 303542035      532132        syn-C2H3C(O)NH2, v=0
  125168.9284  0.0015 -5.0100 3  455.0196109  71510 303542034      532133        syn-C2H3C(O)NH2, v=0
  125177.1393  0.0009 -6.0215 3   52.3406 35  71510 30317 9 9      16 9 8        syn-C2H3C(O)NH2, v=0
  125177.4756  0.0009 -6.0215 3   52.3407 35  71510 30317 9 8      16 9 7        syn-C2H3C(O)NH2, v=0
  125281.5144  0.0020 -7.1108 3   93.8530 55  71510 30327 423      27 424        syn-C2H3C(O)NH2, v=0
  125307.2345  0.0020 -3.9859 3   93.8521 55  71510 30327 423      27 324        syn-C2H3C(O)NH2, v=0
  125329.3548  0.0016 -4.2116 3  529.3317123  71510 303611645      611546        syn-C2H3C(O)NH2, v=0
  125369.4822  0.0156 -6.1940 3 1080.6091163  71510 303813447      803546        syn-C2H3C(O)NH2, v=0
  125369.4822  0.0156 -6.1940 3 1080.6091163  71510 303813448      803545        syn-C2H3C(O)NH2, v=0
  125376.7263  0.0009 -5.8916 3   34.0870 33  71510 30316 412      15 411        syn-C2H3C(O)NH2, v=0
  125454.1432  0.0022 -3.8701 3  158.4131 69  71510 30334 727      34 628        syn-C2H3C(O)NH2, v=0
  125482.5811  0.0512 -6.8689 3 1195.2726147  71510 303734825      744728        syn-C2H3C(O)NH2, v=0
  125482.5811  0.0512 -6.8689 3 1195.2726147  71510 303734826      744727        syn-C2H3C(O)NH2, v=0
  125502.1489  0.0735 -6.7963 3 1090.3322179  71510 303892070      882167        syn-C2H3C(O)NH2, v=0
  125504.1881  0.0033 -6.2539 3  222.8669 79  71510 303391227      40 932        syn-C2H3C(O)NH2, v=0
  125533.4317  0.0025 -3.9348 3  297.5305 93  71510 303461135      461036        syn-C2H3C(O)NH2, v=0
  125556.9083  0.0037 -6.2809 3  189.3346 73  71510 303361125      37 830        syn-C2H3C(O)NH2, v=0
  125566.2136  0.0025 -7.1150 3  189.3346 75  71510 30337 829      37 830        syn-C2H3C(O)NH2, v=0
  125570.7190  0.0024 -6.4759 3   82.7294 47  71510 30323 914      24 619        syn-C2H3C(O)NH2, v=0
  125607.8802  0.0009 -5.9762 3   48.3742 35  71510 30317 810      16 8 9        syn-C2H3C(O)NH2, v=0
  125615.6864  0.0009 -5.9762 3   48.3743 35  71510 30317 8 9      16 8 8        syn-C2H3C(O)NH2, v=0
  125629.2419  0.0016 -5.0725 3  491.7776113  71510 303562136      552233        syn-C2H3C(O)NH2, v=0
  125629.4429  0.0016 -5.0725 3  491.7776113  71510 303562135      552234        syn-C2H3C(O)NH2, v=0
  125634.3189  0.0101 -6.0628 3  697.6961109  71510 303543816      553719        syn-C2H3C(O)NH2, v=0
  125634.3189  0.0101 -6.0628 3  697.6961109  71510 303543817      553718        syn-C2H3C(O)NH2, v=0
  125669.6729  0.0019 -3.9835 3   93.8530 55  71510 30327 523      27 424        syn-C2H3C(O)NH2, v=0
  125684.2744  0.0010 -3.9805 3   41.2697 37  71510 30318 315      17 414        syn-C2H3C(O)NH2, v=0
  125689.2058  0.0052 -6.6953 3   75.9452 47  71510 30323 716      24 421        syn-C2H3C(O)NH2, v=0
  125695.3930  0.0019 -7.1082 3   93.8521 55  71510 30327 523      27 324        syn-C2H3C(O)NH2, v=0
  125753.3918  0.0008 -3.8421 3  112.3721 55  71510 303271018      27 919        syn-C2H3C(O)NH2, v=0
  125756.6325  0.0027 -6.1245 3  297.7222 97  71510 30348 741      49 644        syn-C2H3C(O)NH2, v=0
  125760.6333  0.0027 -6.1245 3  297.7221 97  71510 30348 841      49 544        syn-C2H3C(O)NH2, v=0
  125788.6487  0.0049 -6.8451 3   79.1203 53  71510 30326 224      27 127        syn-C2H3C(O)NH2, v=0
  125790.8152  0.0049 -6.8451 3   79.1203 53  71510 30326 324      27 027        syn-C2H3C(O)NH2, v=0
  125811.1528  0.0027 -5.7704 3  304.4411 67  71510 3033327 6      3426 9        syn-C2H3C(O)NH2, v=0
  125811.1528  0.0027 -5.7704 3  304.4411 67  71510 3033327 7      3426 8        syn-C2H3C(O)NH2, v=0
  125863.9702  0.0037 -6.1716 3  192.4204 79  71510 30339 534      40 437        syn-C2H3C(O)NH2, v=0
  125868.2452  0.0037 -6.1715 3  192.4204 79  71510 30339 634      40 337        syn-C2H3C(O)NH2, v=0
  125911.4770  0.0039 -6.3392 3  243.9519 81  71510 303401427      411130        syn-C2H3C(O)NH2, v=0
  125914.4992  0.0014 -4.6054 3  212.9739 77  71510 303381226      371325        syn-C2H3C(O)NH2, v=0
  125964.0708  0.0018 -3.8792 3  130.2074 63  71510 30331 725      31 626        syn-C2H3C(O)NH2, v=0
  125979.1232  0.0009 -3.8514 3  105.6464 53  71510 303261016      26 917        syn-C2H3C(O)NH2, v=0
  126016.4875  0.0019 -3.9200 3  111.4100 59  71510 30329 624      29 525        syn-C2H3C(O)NH2, v=0
  126022.2011  0.0016 -3.8530 3  150.2305 67  71510 30333 826      33 727        syn-C2H3C(O)NH2, v=0
  126042.5061  0.0105 -6.6663 3  764.8870153  71510 303761363      771266        syn-C2H3C(O)NH2, v=0
  126043.6296  0.0105 -6.6663 3  764.8870153  71510 303761463      771166        syn-C2H3C(O)NH2, v=0
  126106.6614  0.0188 -6.2982 3 1136.9913167  71510 303833548      823647        syn-C2H3C(O)NH2, v=0
  126106.6614  0.0188 -6.2982 3 1136.9913167  71510 303833549      823646        syn-C2H3C(O)NH2, v=0
  126128.4416  0.0017 -5.1382 3  529.9776117  71510 303582237      572334        syn-C2H3C(O)NH2, v=0
  126128.5068  0.0017 -5.1382 3  529.9776117  71510 303582236      572335        syn-C2H3C(O)NH2, v=0
  126138.9296  0.0019 -7.0755 3  111.4059 59  71510 30329 624      29 425        syn-C2H3C(O)NH2, v=0
  126217.7364  0.0009 -5.9368 3   44.9052 35  71510 30317 711      16 710        syn-C2H3C(O)NH2, v=0
  126220.5051  0.0025 -4.5187 3  138.3144 63  71510 30331 922      301021        syn-C2H3C(O)NH2, v=0
  126287.8049  0.0446 -6.7650 3 1137.7367143  71510 303714724      724627        syn-C2H3C(O)NH2, v=0
  126287.8049  0.0446 -6.7650 3 1137.7367143  71510 303714725      724626        syn-C2H3C(O)NH2, v=0
  126330.2191  0.0008 -4.3267 3   13.1196 21  71510 30310 4 6       9 3 7        syn-C2H3C(O)NH2, v=0
  126341.2505  0.0009 -5.9360 3   44.9084 35  71510 30317 710      16 7 9        syn-C2H3C(O)NH2, v=0
  126375.0966  0.0083 -6.0016 3  653.9959105  71510 303523715      533618        syn-C2H3C(O)NH2, v=0
  126375.0966  0.0083 -6.0016 3  653.9959105  71510 303523716      533617        syn-C2H3C(O)NH2, v=0
  126385.6124  0.0009 -5.8846 3   39.4296 35  71510 30317 513      16 512        syn-C2H3C(O)NH2, v=0
  126400.0932  0.0027 -6.2324 3  203.3679 75  71510 303371225      38 930        syn-C2H3C(O)NH2, v=0
  126448.5697  0.0017 -7.0687 3  130.1913 63  71510 30331 725      31 526        syn-C2H3C(O)NH2, v=0
  126460.5745  0.0027 -5.8054 3  276.0983 63  71510 3033126 5      3225 8        syn-C2H3C(O)NH2, v=0
  126460.5745  0.0027 -5.8054 3  276.0983 63  71510 3033126 6      3225 7        syn-C2H3C(O)NH2, v=0
  126568.3535  0.0031 -6.9727 3   44.1523 33  71510 30316 8 9      17 512        syn-C2H3C(O)NH2, v=0
  126601.4444  0.0010 -3.8261 3  184.7088 73  71510 303361027      36 928        syn-C2H3C(O)NH2, v=0
  126624.9829  0.0021 -7.1826 3   29.5856 27  71510 30313 7 6      14 411        syn-C2H3C(O)NH2, v=0
  126634.2134  0.0008 -5.8624 3   36.8275 35  71510 30317 314      16 313        syn-C2H3C(O)NH2, v=0
  126634.6404  0.0023 -6.7318 3   52.7859 37  71510 30318 810      19 515        syn-C2H3C(O)NH2, v=0
  126660.0834  0.0019 -5.2069 3  569.6190121  71510 303602338      592435        syn-C2H3C(O)NH2, v=0
  126660.1043  0.0019 -5.2069 3  569.6190121  71510 303602337      592436        syn-C2H3C(O)NH2, v=0
  126762.6302  0.0011 -5.4802 3   20.8362 25  71510 30312 5 7      12 210        syn-C2H3C(O)NH2, v=0
  126772.7910  0.0037 -6.2939 3  504.6470125  71510 303621052      63 955        syn-C2H3C(O)NH2, v=0
  126775.0303  0.0037 -6.2939 3  504.6470125  71510 303621152      63 855        syn-C2H3C(O)NH2, v=0
  126822.3997  0.0021 -4.4899 3   53.3456 45  71510 30322 121      22 022        syn-C2H3C(O)NH2, v=0
  126823.3941  0.0021 -4.4899 3   53.3456 45  71510 30322 221      22 122        syn-C2H3C(O)NH2, v=0
  126832.0222  0.0009 -5.9038 3   41.9407 35  71510 30317 612      16 611        syn-C2H3C(O)NH2, v=0
  126851.4362  0.0224 -6.4055 3 1194.8028171  71510 303853649      843748        syn-C2H3C(O)NH2, v=0
  126851.4362  0.0224 -6.4055 3 1194.8028171  71510 303853650      843747        syn-C2H3C(O)NH2, v=0
  126903.9418  0.0008 -3.8455 3  105.6125 53  71510 303261017      26 918        syn-C2H3C(O)NH2, v=0
  126920.4607  0.0011 -4.1731 3   25.3520 29  71510 30314 411      13 310        syn-C2H3C(O)NH2, v=0
  126989.9432  0.0013 -3.8342 3  171.4707 71  71510 30335 927      35 828        syn-C2H3C(O)NH2, v=0
  127039.6253  0.0031 -6.2445 3  259.0377 85  71510 303421329      431034        syn-C2H3C(O)NH2, v=0
  127086.3028  0.0387 -6.6652 3 1081.6285139  71510 303694623      704526        syn-C2H3C(O)NH2, v=0
  127086.3028  0.0387 -6.6652 3 1081.6285139  71510 303694624      704525        syn-C2H3C(O)NH2, v=0
  127098.2610  0.0026 -5.8631 3  249.1995 59  71510 3032925 4      3024 7        syn-C2H3C(O)NH2, v=0
  127098.2610  0.0026 -5.8631 3  249.1995 59  71510 3032925 5      3024 6        syn-C2H3C(O)NH2, v=0
  127101.1956  0.0042 -6.3325 3  158.4459 67  71510 303331023      34 728        syn-C2H3C(O)NH2, v=0
  127108.0721  0.0068 -5.9462 3  611.7329101  71510 303503614      513517        syn-C2H3C(O)NH2, v=0
  127108.0721  0.0068 -5.9462 3  611.7329101  71510 303503615      513516        syn-C2H3C(O)NH2, v=0
  127132.8153  0.0011 -5.6831 3   17.8429 23  71510 30311 5 6      11 2 9        syn-C2H3C(O)NH2, v=0
  127146.2566  0.0018 -4.0523 3  418.5013109  71510 303541539      541440        syn-C2H3C(O)NH2, v=0
  127165.6356  0.0016 -3.8492 3  222.8115 79  71510 303391227      391128        syn-C2H3C(O)NH2, v=0
  127219.5261  0.0021 -5.2786 3  610.7008125  71510 303622439      612536        syn-C2H3C(O)NH2, v=0
  127219.5327  0.0021 -5.2786 3  610.7008125  71510 303622438      612537        syn-C2H3C(O)NH2, v=0
  127265.4513  0.0024 -3.8945 3  258.8467 87  71510 303431033      43 934        syn-C2H3C(O)NH2, v=0
  127274.7541  0.0016 -4.6088 3  162.6856 69  71510 30334 926      331023        syn-C2H3C(O)NH2, v=0
  127432.6942  0.0023 -3.8590 3  189.2723 75  71510 30337 829      37 730        syn-C2H3C(O)NH2, v=0
  127507.5846  0.0008 -3.8541 3   99.1343 51  71510 303251015      25 916        syn-C2H3C(O)NH2, v=0
  127585.4021  0.0030 -4.4437 3   95.3796 53  71510 30326 719      25 818        syn-C2H3C(O)NH2, v=0
  127603.4485  0.0266 -6.5160 3 1254.0424175  71510 303873750      863849        syn-C2H3C(O)NH2, v=0
  127603.4485  0.0266 -6.5160 3 1254.0424175  71510 303873751      863848        syn-C2H3C(O)NH2, v=0
  127623.9635  0.0024 -6.2624 3  154.4342 65  71510 303321121      33 826        syn-C2H3C(O)NH2, v=0
  127663.2523  0.0014 -7.0804 3  150.1758 67  71510 30333 826      33 627        syn-C2H3C(O)NH2, v=0
  127696.5729  0.0077 -6.6826 3  587.7264127  71510 303632044      641747        syn-C2H3C(O)NH2, v=0
  127716.7293  0.0018 -3.9628 3  346.3672 99  71510 303491435      491336        syn-C2H3C(O)NH2, v=0
  127723.5161  0.0026 -5.9519 3  223.7450 55  71510 3032724 3      2823 6        syn-C2H3C(O)NH2, v=0
  127723.5161  0.0026 -5.9519 3  223.7450 55  71510 3032724 4      2823 5        syn-C2H3C(O)NH2, v=0
  127803.0462  0.0025 -5.3535 3  653.2223129  71510 303642540      632637        syn-C2H3C(O)NH2, v=0
  127803.0483  0.0025 -5.3535 3  653.2223129  71510 303642539      632638        syn-C2H3C(O)NH2, v=0
  127806.6451  0.0178 -6.8284 3  869.8411163  71510 303811467      821370        syn-C2H3C(O)NH2, v=0
  127807.3716  0.0178 -6.8284 3  869.8411163  71510 303811567      821270        syn-C2H3C(O)NH2, v=0
  127833.0200  0.0056 -5.8968 3  570.9077 97  71510 303483513      493416        syn-C2H3C(O)NH2, v=0
  127833.0200  0.0056 -5.8968 3  570.9077 97  71510 303483514      493415        syn-C2H3C(O)NH2, v=0
  127834.7168  0.1408 -7.2261 3 1321.3795197  71510 303982277      972374        syn-C2H3C(O)NH2, v=0
  127877.9955  0.0334 -6.5695 3 1026.9493135  71510 303674522      684425        syn-C2H3C(O)NH2, v=0
  127877.9955  0.0334 -6.5695 3 1026.9493135  71510 303674523      684424        syn-C2H3C(O)NH2, v=0
  127991.2343  0.0008 -3.8510 3   99.1167 51  71510 303251016      25 917        syn-C2H3C(O)NH2, v=0
  127995.8750  0.0016 -4.1539 3  497.5038119  71510 303591643      591544        syn-C2H3C(O)NH2, v=0
  128004.7995  0.0024 -3.8681 3  222.7552 81  71510 30340 931      40 832        syn-C2H3C(O)NH2, v=0
  128028.3271  0.0013 -6.9537 3    6.3485 15  71510 303 7 4 4       7 1 7        syn-C2H3C(O)NH2, v=0
  128041.5254  0.0010 -5.8955 3   41.9832 35  71510 30317 611      16 610        syn-C2H3C(O)NH2, v=0
  128150.6753  0.0017 -3.8925 3  281.1326 89  71510 303441331      441232        syn-C2H3C(O)NH2, v=0
  128194.3739  0.0035 -6.2604 3  269.9133 87  71510 303431330      441035        syn-C2H3C(O)NH2, v=0
  128248.3178  0.0026 -4.7294 3  180.4309 73  71510 30336 928      351025        syn-C2H3C(O)NH2, v=0
  128318.4723  0.0041 -6.3365 3  199.4560 73  71510 303361324      371027        syn-C2H3C(O)NH2, v=0
  128335.5696  0.0025 -6.0874 3  199.7353 51  71510 3032523 2      2622 5        syn-C2H3C(O)NH2, v=0
  128335.5696  0.0025 -6.0874 3  199.7353 51  71510 3032523 3      2622 4        syn-C2H3C(O)NH2, v=0
  128362.3915  0.0313 -6.6295 3 1314.7091179  71510 303893851      883950        syn-C2H3C(O)NH2, v=0
  128362.3915  0.0313 -6.6295 3 1314.7091179  71510 303893852      883949        syn-C2H3C(O)NH2, v=0
  128403.6454  0.0470 -6.8042 3 1122.6567181  71510 303902070      892367        syn-C2H3C(O)NH2, v=0
  128407.6292  0.0030 -5.4315 3  697.1825133  71510 303662641      652738        syn-C2H3C(O)NH2, v=0
  128407.6298  0.0030 -5.4315 3  697.1825133  71510 303662640      652739        syn-C2H3C(O)NH2, v=0
  128426.3635  0.0055 -6.9542 3   56.5208 41  71510 30320 614      21 319        syn-C2H3C(O)NH2, v=0
  128460.8091  0.0043 -6.2690 3  152.0478 71  71510 30335 431      36 334        syn-C2H3C(O)NH2, v=0
  128463.8156  0.0043 -6.2690 3  152.0478 71  71510 30335 531      36 234        syn-C2H3C(O)NH2, v=0
  128517.6073  0.0027 -6.1519 3  364.8624107  71510 30353 845      54 748        syn-C2H3C(O)NH2, v=0
  128520.3532  0.0027 -6.1519 3  364.8623107  71510 30353 945      54 648        syn-C2H3C(O)NH2, v=0
  128540.3794  0.0012 -5.3312 3   24.0259 27  71510 30313 5 8      13 211        syn-C2H3C(O)NH2, v=0
  128542.4868  0.0028 -6.2290 3  248.3674 83  71510 303411328      421033        syn-C2H3C(O)NH2, v=0
  128549.6891  0.0047 -5.8539 3  531.5211 93  71510 303463412      473315        syn-C2H3C(O)NH2, v=0
  128549.6891  0.0047 -5.8539 3  531.5211 93  71510 303463413      473314        syn-C2H3C(O)NH2, v=0
  128565.3155  0.0200 -3.8140 3  162.6856 67 -71510 303331122      331023        syn-C2H3C(O)NH2, v=0
  128587.3978  0.0200 -4.5552 3  189.2335 73 -71510 303361125      351224        syn-C2H3C(O)NH2, v=0
  128659.4023  0.0012 -4.1119 3   28.9647 31  71510 30315 412      14 311        syn-C2H3C(O)NH2, v=0
  128662.7932  0.0287 -6.4780 3  973.7000131  71510 303654421      664324        syn-C2H3C(O)NH2, v=0
  128662.7932  0.0287 -6.4780 3  973.7000131  71510 303654422      664323        syn-C2H3C(O)NH2, v=0
  128744.9833  0.0200 -3.8606 3   92.8929 49 -71510 303241014      24 915        syn-C2H3C(O)NH2, v=0
  128771.2073  0.0027 -4.1485 3  493.2085119  71510 303591544      591445        syn-C2H3C(O)NH2, v=0
  128857.1776  0.0066 -5.5156 3  447.7525115  71510 303571345      561442        syn-C2H3C(O)NH2, v=0
  128933.5721  0.0025 -6.3026 3  177.1707 47  71510 3032322 1      2421 4        syn-C2H3C(O)NH2, v=0
  128933.5721  0.0025 -6.3026 3  177.1707 47  71510 3032322 2      2421 3        syn-C2H3C(O)NH2, v=0
  128943.5139  0.0034 -6.2683 3  309.5377 93  71510 303461432      471137        syn-C2H3C(O)NH2, v=0
  128961.7178  0.0047 -6.3974 3  590.7208135  71510 303671156      681059        syn-C2H3C(O)NH2, v=0
  128963.1956  0.0047 -6.3974 3  590.7208135  71510 303671256      68 959        syn-C2H3C(O)NH2, v=0
  128987.5940  0.0008 -3.8591 3   92.8842 49  71510 303241015      24 916        syn-C2H3C(O)NH2, v=0
  128995.3091  0.0007 -4.0550 3   11.0225 15  71510 303 7 6 2       6 5 1        syn-C2H3C(O)NH2, v=0
  128995.8302  0.0007 -4.0550 3   11.0224 15  71510 303 7 6 1       6 5 2        syn-C2H3C(O)NH2, v=0
  129001.2936  0.0200 -4.1420 3   12.5969 19 -71510 303 9 5 5       8 4 4        syn-C2H3C(O)NH2, v=0
  129030.8125  0.0038 -5.5126 3  742.5806137  71510 303682742      672839        syn-C2H3C(O)NH2, v=0
  129030.8127  0.0038 -5.5126 3  742.5806137  71510 303682741      672840        syn-C2H3C(O)NH2, v=0
  129128.0024  0.0367 -6.7461 3 1376.8017183  71510 303913952      904051        syn-C2H3C(O)NH2, v=0
  129128.0024  0.0367 -6.7461 3 1376.8017183  71510 303913953      904050        syn-C2H3C(O)NH2, v=0
  129131.2230  0.0012 -5.9354 3   15.0568 21  71510 30310 5 5      10 2 8        syn-C2H3C(O)NH2, v=0
  129134.5524  0.0020 -4.6507 3  171.3992 71  71510 30335 927      341024        syn-C2H3C(O)NH2, v=0
  129145.1257  0.0036 -6.7127 3   66.2536 41  71510 30320 912      21 615        syn-C2H3C(O)NH2, v=0
  129154.3447  0.0021 -4.2052 3   67.6842 49  71510 30324 222      24 123        syn-C2H3C(O)NH2, v=0
  129162.3834  0.0020 -4.2051 3   67.6842 49  71510 30324 322      24 223        syn-C2H3C(O)NH2, v=0
  129182.5308  0.0038 -6.2677 3  232.9225 81  71510 303401228      41 933        syn-C2H3C(O)NH2, v=0
  129188.9640  0.0031 -6.1229 3  247.3138 89  71510 30344 638      45 541        syn-C2H3C(O)NH2, v=0
  129192.0558  0.0031 -6.1228 3  247.3138 89  71510 30344 738      45 441        syn-C2H3C(O)NH2, v=0
  129257.7997  0.0039 -5.8181 3  493.5739 89  71510 303443311      453214        syn-C2H3C(O)NH2, v=0
  129257.7997  0.0039 -5.8181 3  493.5739 89  71510 303443312      453213        syn-C2H3C(O)NH2, v=0
  129349.8780  0.0200 -4.5451 3  175.5354 71 -71510 303351026      341123        syn-C2H3C(O)NH2, v=0
  129351.7012  0.0200 -4.2184 3  545.5380125 -71510 303621646      621547        syn-C2H3C(O)NH2, v=0
  129398.8038  0.0200 -4.1401 3   12.5851 19 -71510 303 9 5 4       8 4 5        syn-C2H3C(O)NH2, v=0
  129440.5954  0.0245 -6.3910 3  921.8816127  71510 303634320      644223        syn-C2H3C(O)NH2, v=0
  129440.5954  0.0245 -6.3910 3  921.8816127  71510 303634321      644222        syn-C2H3C(O)NH2, v=0
  129458.9779  0.0289 -7.0091 3  981.4783173  71510 303861571      871474        syn-C2H3C(O)NH2, v=0
  129459.4457  0.0289 -7.0090 3  981.4783173  71510 303861671      871374        syn-C2H3C(O)NH2, v=0
  129498.9725  0.0935 -7.1954 3 1267.3868191  71510 303952372      942669        syn-C2H3C(O)NH2, v=0
  129516.5930  0.0024 -6.6941 3  156.0515 43  71510 3032121 0      2220 3        syn-C2H3C(O)NH2, v=0
  129516.5930  0.0024 -6.6941 3  156.0515 43  71510 3032121 1      2220 2        syn-C2H3C(O)NH2, v=0
  129551.6233  0.0021 -7.0499 3  137.8065 65  71510 30332 626      32 627        syn-C2H3C(O)NH2, v=0
  129670.5676  0.0048 -5.5968 3  789.4158141  71510 303702843      692940        syn-C2H3C(O)NH2, v=0
  129670.5677  0.0048 -5.5968 3  789.4158141  71510 303702842      692941        syn-C2H3C(O)NH2, v=0
  129763.9333  0.0200 -3.8705 3   86.9180 47 -71510 303231013      23 914        syn-C2H3C(O)NH2, v=0
  129786.2796  0.0200 -3.8168 3  193.9311 75 -71510 303371028      37 929        syn-C2H3C(O)NH2, v=0
  129826.2249  0.0008 -7.1814 3  154.0582 67  71510 30333 925      33 726        syn-C2H3C(O)NH2, v=0
  129829.8414  0.0020 -3.8680 3  137.7972 65  71510 30332 626      32 527        syn-C2H3C(O)NH2, v=0
  129833.3934  0.0024 -6.3505 3  112.2423 55  71510 303271017      28 722        syn-C2H3C(O)NH2, v=0
  129879.2829  0.0008 -5.8273 3   41.2697 37  71510 30318 415      17 414        syn-C2H3C(O)NH2, v=0
  129880.4739  0.0200 -3.8698 3   86.9138 47 -71510 303231014      23 915        syn-C2H3C(O)NH2, v=0
  129900.0563  0.0427 -6.8658 3 1440.3190187  71510 303934053      924152        syn-C2H3C(O)NH2, v=0
  129900.0563  0.0427 -6.8658 3 1440.3190187  71510 303934054      924151        syn-C2H3C(O)NH2, v=0
  129905.1703  0.0008 -7.1417 3  162.5978 69  71510 30334 926      34 727        syn-C2H3C(O)NH2, v=0
  129937.2227  0.0042 -6.3649 3  159.4369 65  71510 303321221      33 924        syn-C2H3C(O)NH2, v=0
  129957.0409  0.0035 -5.7901 3  457.0667 85  71510 303423210      433113        syn-C2H3C(O)NH2, v=0
  129957.0409  0.0035 -5.7901 3  457.0667 85  71510 303423211      433112        syn-C2H3C(O)NH2, v=0
  129972.6923  0.0049 -6.4176 3  130.2074 61  71510 30330 921      31 626        syn-C2H3C(O)NH2, v=0
  130072.6779  0.0029 -4.0776 3  443.4137113  71510 303561442      561343        syn-C2H3C(O)NH2, v=0
  130177.9450  0.0200 -3.7593 3   42.8669 39 -71510 30319 217      18 316        syn-C2H3C(O)NH2, v=0
  130210.4860  0.0031 -6.2480 3  297.8430 91  71510 303451431      461136        syn-C2H3C(O)NH2, v=0
  130211.2891  0.0208 -6.3085 3  871.4952123  71510 303614219      624122        syn-C2H3C(O)NH2, v=0
  130211.2891  0.0208 -6.3085 3  871.4952123  71510 303614220      624121        syn-C2H3C(O)NH2, v=0
  130276.2917  0.0025 -6.2249 3  193.9311 73  71510 303361224      37 929        syn-C2H3C(O)NH2, v=0
  130305.4850  0.0010 -3.5560 3   44.4504 43  71510 30321 021      20 120        syn-C2H3C(O)NH2, v=0
  130305.5159  0.0010 -5.7405 3   44.4504 43  71510 30321 121      20 120        syn-C2H3C(O)NH2, v=0
  130305.5508  0.0010 -5.7405 3   44.4504 43  71510 30321 021      20 020        syn-C2H3C(O)NH2, v=0
  130305.5818  0.0010 -3.5560 3   44.4504 43  71510 30321 121      20 020        syn-C2H3C(O)NH2, v=0
  130315.3696  0.0200 -3.6432 3   43.9289 41 -71510 30320 119      19 218        syn-C2H3C(O)NH2, v=0
  130319.4746  0.0009 -5.7686 3   43.9289 41  71510 30320 219      19 218        syn-C2H3C(O)NH2, v=0
  130323.5380  0.0009 -5.7685 3   43.9286 41  71510 30320 119      19 118        syn-C2H3C(O)NH2, v=0
  130325.2111  0.0060 -5.6840 3  837.6870145  71510 303722943      713042        syn-C2H3C(O)NH2, v=0
  130325.2111  0.0060 -5.6840 3  837.6870145  71510 303722944      713041        syn-C2H3C(O)NH2, v=0
  130327.6114  0.0200 -3.6432 3   43.9286 41 -71510 30320 219      19 118        syn-C2H3C(O)NH2, v=0
  130378.8573  0.0009 -5.7961 3   42.8669 39  71510 30319 317      18 316        syn-C2H3C(O)NH2, v=0
  130436.6854  0.0258 -7.1727 3  944.0419163  71510 303812358      822063        syn-C2H3C(O)NH2, v=0
  130460.1852  0.0038 -6.3114 3  364.5115101  71510 303501535      511240        syn-C2H3C(O)NH2, v=0
  130463.7772  0.0040 -6.5410 3   92.8349 49  71510 303241015      25 718        syn-C2H3C(O)NH2, v=0
  130483.0971  0.0039 -6.2876 3  321.4369 95  71510 303471433      481138        syn-C2H3C(O)NH2, v=0
  130495.9703  0.0047 -6.4576 3  116.1985 63  71510 30331 328      32 231        syn-C2H3C(O)NH2, v=0
  130497.9092  0.0047 -6.4576 3  116.1985 63  71510 30331 428      32 131        syn-C2H3C(O)NH2, v=0
  130543.6829  0.0009 -5.7949 3   42.8547 39  71510 30319 217      18 216        syn-C2H3C(O)NH2, v=0
  130566.7785  0.0275 -6.6412 3 1033.3034173  71510 303862066      852363        syn-C2H3C(O)NH2, v=0
  130614.0980  0.0200 -3.8838 3   81.2061 45 -71510 303221012      22 913        syn-C2H3C(O)NH2, v=0
  130647.0668  0.0031 -5.7709 3  422.0002 81  71510 3034031 9      413012        syn-C2H3C(O)NH2, v=0
  130647.0668  0.0031 -5.7709 3  422.0002 81  71510 303403110      413011        syn-C2H3C(O)NH2, v=0
  130647.8921  0.0012 -4.0435 3   32.7949 33  71510 30316 413      15 312        syn-C2H3C(O)NH2, v=0
  130667.5997  0.0200 -3.8835 3   81.2042 45 -71510 303221013      22 914        syn-C2H3C(O)NH2, v=0
  130678.3608  0.0495 -6.9885 3 1505.2598191  71510 303954154      944253        syn-C2H3C(O)NH2, v=0
  130678.3608  0.0495 -6.9885 3 1505.2598191  71510 303954155      944252        syn-C2H3C(O)NH2, v=0
  130679.8722  0.0755 -7.1358 3 1356.9625157  71510 303785127      795030        syn-C2H3C(O)NH2, v=0
  130679.8722  0.0755 -7.1358 3 1356.9625157  71510 303785128      795029        syn-C2H3C(O)NH2, v=0
  130685.8218  0.0042 -6.4301 3  123.8962 57  71510 303281118      29 821        syn-C2H3C(O)NH2, v=0
  130744.5994  0.0200 -3.7553 3   42.8547 39 -71510 30319 317      18 216        syn-C2H3C(O)NH2, v=0
  130754.7989  0.0016 -4.7505 3   11.6160 21  71510 30310 3 7       9 2 8        syn-C2H3C(O)NH2, v=0
  130839.3407  0.0020 -7.1439 3   83.3162 53  71510 30326 323      26 324        syn-C2H3C(O)NH2, v=0
  130841.5069  0.0020 -4.0515 3   83.3162 53  71510 30326 323      26 224        syn-C2H3C(O)NH2, v=0
  130887.3896  0.0020 -4.0512 3   83.3162 53  71510 30326 423      26 324        syn-C2H3C(O)NH2, v=0
  130889.5558  0.0020 -7.1435 3   83.3162 53  71510 30326 423      26 224        syn-C2H3C(O)NH2, v=0
  130974.7480  0.0176 -6.2306 3  822.5417119  71510 303594118      604021        syn-C2H3C(O)NH2, v=0
  130974.7480  0.0176 -6.2306 3  822.5417119  71510 303594119      604020        syn-C2H3C(O)NH2, v=0
  130993.3364  0.0075 -5.7744 3  887.3933149  71510 303743044      733143        syn-C2H3C(O)NH2, v=0
  130993.3364  0.0075 -5.7744 3  887.3933149  71510 303743045      733142        syn-C2H3C(O)NH2, v=0
  131002.9284  0.0449 -7.2075 3 1099.7912183  71510 303911675      921578        syn-C2H3C(O)NH2, v=0
  131003.2286  0.0449 -7.2075 3 1099.7912183  71510 303911775      921478        syn-C2H3C(O)NH2, v=0
  131013.3786  0.0070 -6.5224 3  683.4979145  71510 303721260      731163        syn-C2H3C(O)NH2, v=0
  131014.3467  0.0070 -6.5224 3  683.4979145  71510 303721360      731063        syn-C2H3C(O)NH2, v=0
  131084.2028  0.0031 -6.2086 3  438.7235117  71510 30358 949      59 852        syn-C2H3C(O)NH2, v=0
  131086.0594  0.0031 -6.2086 3  438.7235117  71510 303581049      59 752        syn-C2H3C(O)NH2, v=0
  131327.4930  0.0030 -5.7618 3  388.3751 77  71510 3033830 8      392911        syn-C2H3C(O)NH2, v=0
  131327.4930  0.0030 -5.7618 3  388.3751 77  71510 3033830 9      392910        syn-C2H3C(O)NH2, v=0
  131329.7298  0.0200 -3.9005 3   75.7548 43 -71510 303211011      21 912        syn-C2H3C(O)NH2, v=0
  131353.1117  0.0200 -3.9004 3   75.7540 43 -71510 303211012      21 913        syn-C2H3C(O)NH2, v=0
  131377.9253  0.0010 -6.8893 3  105.5055 37  71510 3031817 1      1717 0        syn-C2H3C(O)NH2, v=0
  131377.9253  0.0010 -6.8893 3  105.5055 37  71510 3031817 2      1717 1        syn-C2H3C(O)NH2, v=0
  131404.7166  0.0180 -7.0131 3  854.4255155  71510 303772255      781960        syn-C2H3C(O)NH2, v=0
  131448.4808  0.0010 -6.5842 3   97.7148 37  71510 3031816 2      1716 1        syn-C2H3C(O)NH2, v=0
  131448.4808  0.0010 -6.5842 3   97.7148 37  71510 3031816 3      1716 2        syn-C2H3C(O)NH2, v=0
  131457.6408  0.0034 -6.2870 3  351.7920 99  71510 303491534      501239        syn-C2H3C(O)NH2, v=0
  131462.7520  0.0570 -7.1144 3 1571.6228195  71510 303974255      964354        syn-C2H3C(O)NH2, v=0
  131462.7520  0.0570 -7.1144 3 1571.6228195  71510 303974256      964353        syn-C2H3C(O)NH2, v=0
  131499.9411  0.0666 -7.0225 3 1295.6338153  71510 303765026      774929        syn-C2H3C(O)NH2, v=0
  131499.9411  0.0666 -7.0225 3 1295.6338153  71510 303765027      774928        syn-C2H3C(O)NH2, v=0
  131531.3753  0.0020 -7.0452 3  118.3943 61  71510 30330 525      30 526        syn-C2H3C(O)NH2, v=0
  131532.3095  0.0010 -6.4052 3   90.3983 37  71510 3031815 3      1715 2        syn-C2H3C(O)NH2, v=0
  131532.3095  0.0010 -6.4052 3   90.3983 37  71510 3031815 4      1715 3        syn-C2H3C(O)NH2, v=0
  131598.9192  0.0020 -3.8969 3  118.3921 61  71510 30330 525      30 426        syn-C2H3C(O)NH2, v=0
  131631.8658  0.0042 -6.3721 3  423.9561109  71510 303541638      551343        syn-C2H3C(O)NH2, v=0
  131633.5146  0.0009 -6.2788 3   83.5566 37  71510 3031814 4      1714 3        syn-C2H3C(O)NH2, v=0
  131633.5146  0.0009 -6.2788 3   83.5566 37  71510 3031814 5      1714 4        syn-C2H3C(O)NH2, v=0
  131673.7616  0.0093 -5.8679 3  938.5339153  71510 303763145      753244        syn-C2H3C(O)NH2, v=0
  131673.7616  0.0093 -5.8679 3  938.5339153  71510 303763146      753243        syn-C2H3C(O)NH2, v=0
  131730.8310  0.0148 -6.1576 3  775.0220115  71510 303574017      583920        syn-C2H3C(O)NH2, v=0
  131730.8310  0.0148 -6.1576 3  775.0220115  71510 303574018      583919        syn-C2H3C(O)NH2, v=0
  131734.7005  0.0020 -7.0749 3  100.2253 57  71510 30328 424      28 425        syn-C2H3C(O)NH2, v=0
  131748.3396  0.0020 -3.9559 3  100.2248 57  71510 30328 424      28 325        syn-C2H3C(O)NH2, v=0
  131757.8988  0.0009 -6.1816 3   77.1906 37  71510 3031813 5      1713 4        syn-C2H3C(O)NH2, v=0
  131757.8988  0.0009 -6.1816 3   77.1906 37  71510 3031813 6      1713 5        syn-C2H3C(O)NH2, v=0
  131758.7933  0.0015 -4.2614 3  583.3314129  71510 303641747      641648        syn-C2H3C(O)NH2, v=0
  131808.2172  0.0010 -7.1045 3  171.3100 71  71510 30335 927      35 728        syn-C2H3C(O)NH2, v=0
  131832.6539  0.0042 -6.2960 3  198.5703 75  71510 303371126      38 831        syn-C2H3C(O)NH2, v=0
  131883.8888  0.0011 -5.8450 3   39.7531 35  71510 30317 512      16 511        syn-C2H3C(O)NH2, v=0
  131887.5889  0.0050 -6.8344 3   84.8815 55  71510 30327 225      28 128        syn-C2H3C(O)NH2, v=0
  131888.6853  0.0050 -6.8344 3   84.8815 55  71510 30327 325      28 028        syn-C2H3C(O)NH2, v=0
  131913.9086  0.0009 -6.1033 3   71.3013 37  71510 3031812 7      1712 6        syn-C2H3C(O)NH2, v=0
  131913.9087  0.0009 -6.1033 3   71.3013 37  71510 3031812 6      1712 5        syn-C2H3C(O)NH2, v=0
  131934.7777  0.0200 -3.9208 3   70.5618 41 -71510 303201010      20 911        syn-C2H3C(O)NH2, v=0
  131939.8803  0.0221 -7.1214 3  923.3246161  71510 303802357      812062        syn-C2H3C(O)NH2, v=0
  131944.4826  0.0200 -3.9208 3   70.5615 41 -71510 303201011      20 912        syn-C2H3C(O)NH2, v=0
  131948.7443  0.0016 -3.8297 3  158.4459 69  71510 30334 827      34 728        syn-C2H3C(O)NH2, v=0
  131954.1188  0.0019 -3.9546 3  100.2253 57  71510 30328 524      28 425        syn-C2H3C(O)NH2, v=0
  131967.7580  0.0019 -7.0735 3  100.2248 57  71510 30328 524      28 325        syn-C2H3C(O)NH2, v=0
  131997.8931  0.0029 -5.7643 3  356.1918 73  71510 3033629 7      372810        syn-C2H3C(O)NH2, v=0
  131997.8931  0.0029 -5.7643 3  356.1918 73  71510 3033629 8      3728 9        syn-C2H3C(O)NH2, v=0
  132114.2849  0.0009 -6.0385 3   65.8904 37  71510 3031811 8      1711 7        syn-C2H3C(O)NH2, v=0
  132114.2858  0.0009 -6.0385 3   65.8904 37  71510 3031811 7      1711 6        syn-C2H3C(O)NH2, v=0
  132150.5980  0.0014 -3.8160 3  180.3007 73  71510 30336 928      36 829        syn-C2H3C(O)NH2, v=0
  132156.6408  0.0013 -4.5408 3  198.2767 75  71510 303371127      361224        syn-C2H3C(O)NH2, v=0
  132170.3108  0.0125 -6.8665 3  769.2539147  71510 303732152      741857        syn-C2H3C(O)NH2, v=0
  132183.9735  0.0037 -6.1629 3  201.4147 81  71510 30340 535      41 438        syn-C2H3C(O)NH2, v=0
  132186.2529  0.0037 -6.1629 3  201.4147 81  71510 30340 635      41 338        syn-C2H3C(O)NH2, v=0
  132187.0112  0.0024 -6.5216 3   76.7969 45  71510 30322 913      23 618        syn-C2H3C(O)NH2, v=0
  132187.6789  0.0013 -6.2319 3   12.4921 19  71510 303 9 5 4       9 2 7        syn-C2H3C(O)NH2, v=0
  132205.5468  0.0011 -3.7946 3  154.2813 65  71510 303321121      321022        syn-C2H3C(O)NH2, v=0
  132225.5542  0.0008 -5.8092 3   41.0515 37  71510 30318 315      17 314        syn-C2H3C(O)NH2, v=0
  132240.9825  0.0018 -3.8529 3  137.8065 65  71510 30332 726      32 627        syn-C2H3C(O)NH2, v=0
  132243.3733  0.0027 -6.1177 3  308.9397 99  71510 30349 742      50 645        syn-C2H3C(O)NH2, v=0
  132245.5498  0.0027 -6.1176 3  308.9397 99  71510 30349 842      50 545        syn-C2H3C(O)NH2, v=0
  132313.2910  0.0585 -6.9131 3 1235.7297149  71510 303744925      754828        syn-C2H3C(O)NH2, v=0
  132313.2910  0.0585 -6.9131 3 1235.7297149  71510 303744926      754827        syn-C2H3C(O)NH2, v=0
  132328.4139  0.0038 -6.3443 3  410.2116107  71510 303531637      541342        syn-C2H3C(O)NH2, v=0
  132350.0046  0.0026 -6.2145 3  237.9060 81  71510 303401327      411032        syn-C2H3C(O)NH2, v=0
  132363.1927  0.0019 -3.8921 3  118.3943 61  71510 30330 625      30 526        syn-C2H3C(O)NH2, v=0
  132365.4880  0.0114 -5.9645 3  991.1076157  71510 303783246      773345        syn-C2H3C(O)NH2, v=0
  132365.4880  0.0114 -5.9645 3  991.1076157  71510 303783247      773344        syn-C2H3C(O)NH2, v=0
  132371.2190  0.0040 -4.9476 3  243.9519 85  71510 303421033      411130        syn-C2H3C(O)NH2, v=0
  132379.1224  0.0009 -5.9838 3   60.9606 37  71510 3031810 9      1710 8        syn-C2H3C(O)NH2, v=0
  132379.1566  0.0009 -5.9838 3   60.9606 37  71510 3031810 8      1710 7        syn-C2H3C(O)NH2, v=0
  132386.9983  0.0040 -6.2771 3  280.9913 89  71510 303441331      451036        syn-C2H3C(O)NH2, v=0
  132418.5794  0.0043 -6.3335 3  377.4346103  71510 303511536      521241        syn-C2H3C(O)NH2, v=0
  132428.6052  0.0032 -6.2715 3   14.4265 23  71510 30311 3 8      11 011        syn-C2H3C(O)NH2, v=0
  132430.7366  0.0019 -7.0398 3  118.3921 61  71510 30330 625      30 426        syn-C2H3C(O)NH2, v=0
  132446.7725  0.0009 -3.9452 3   65.6254 39  71510 3031910 9      19 910        syn-C2H3C(O)NH2, v=0
  132447.1473  0.0007 -3.7925 3  188.9318 73  71510 303361126      361027        syn-C2H3C(O)NH2, v=0
  132450.5733  0.0200 -3.9452 3   65.6252 39 -71510 303191010      19 911        syn-C2H3C(O)NH2, v=0
  132461.0627  0.0020 -4.2847 3  600.4030131  71510 303651748      651649        syn-C2H3C(O)NH2, v=0
  132468.5770  0.0029 -4.0088 3  396.1605107  71510 303531340      531241        syn-C2H3C(O)NH2, v=0
  132479.3810  0.0123 -6.0897 3  728.9371111  71510 303553916      563819        syn-C2H3C(O)NH2, v=0
  132479.3810  0.0123 -6.0897 3  728.9371111  71510 303553917      563818        syn-C2H3C(O)NH2, v=0
  132494.0215  0.0048 -6.4493 3  487.8684117  71510 303581741      591446        syn-C2H3C(O)NH2, v=0
  132519.2006  0.0017 -7.0322 3  137.7972 65  71510 30332 726      32 527        syn-C2H3C(O)NH2, v=0
  132538.4738  0.0064 -6.5647 3  517.4781119  71510 303591941      601644        syn-C2H3C(O)NH2, v=0
  132566.4522  0.0090 -5.7931 3  600.4030133  71510 303661552      651649        syn-C2H3C(O)NH2, v=0
  132611.2148  0.0740 -7.0202 3 1248.8497191  71510 303952174      942471        syn-C2H3C(O)NH2, v=0
  132646.6506  0.0007 -3.7958 3  198.2603 75  71510 303371127      371028        syn-C2H3C(O)NH2, v=0
  132657.7938  0.0028 -5.7809 3  325.4511 69  71510 3033428 6      3527 9        syn-C2H3C(O)NH2, v=0
  132657.7938  0.0028 -5.7809 3  325.4511 69  71510 3033428 7      3527 8        syn-C2H3C(O)NH2, v=0
  132712.1048  0.0402 -6.7270 3 1099.9483179  71510 303892069      882366        syn-C2H3C(O)NH2, v=0
  132717.8581  0.0088 -6.7332 3  688.5314139  71510 303692049      701754        syn-C2H3C(O)NH2, v=0
  132741.7457  0.0009 -5.9368 3   56.5161 37  71510 30318 910      17 9 9        syn-C2H3C(O)NH2, v=0
  132742.6975  0.0009 -5.9368 3   56.5161 37  71510 30318 9 9      17 9 8        syn-C2H3C(O)NH2, v=0
  132779.8051  0.0019 -5.3759 3    8.0630 19  71510 303 9 2 7       8 1 8        syn-C2H3C(O)NH2, v=0
  132804.1477  0.0007 -3.7879 3  179.8500 71  71510 303351125      351026        syn-C2H3C(O)NH2, v=0
  132837.1031  0.0009 -5.8224 3   38.2692 35  71510 30317 413      16 412        syn-C2H3C(O)NH2, v=0
  132860.2056  0.0043 -6.4186 3  473.0987115  71510 303571740      581445        syn-C2H3C(O)NH2, v=0
  132877.1538  0.0015 -5.2370 3   27.4065 29  71510 30314 5 9      14 212        syn-C2H3C(O)NH2, v=0
  132879.1608  0.0200 -3.9742 3   60.9439 37 -71510 3031810 8      18 9 9        syn-C2H3C(O)NH2, v=0
  132880.5555  0.0200 -3.9742 3   60.9439 37 -71510 3031810 9      18 910        syn-C2H3C(O)NH2, v=0
  132889.0434  0.0021 -4.4593 3   58.0963 47  71510 30323 122      23 023        syn-C2H3C(O)NH2, v=0
  132889.5327  0.0021 -4.4593 3   58.0963 47  71510 30323 222      23 123        syn-C2H3C(O)NH2, v=0
  132932.1081  0.0015 -7.0439 3  158.4131 69  71510 30334 827      34 628        syn-C2H3C(O)NH2, v=0
  132937.1840  0.0116 -6.6677 3  782.9715155  71510 303771364      781267        syn-C2H3C(O)NH2, v=0
  132937.8143  0.0116 -6.6677 3  782.9715155  71510 303771464      781167        syn-C2H3C(O)NH2, v=0
  133029.5128  0.0064 -6.6138 3  612.2622131  71510 303651946      661651        syn-C2H3C(O)NH2, v=0
  133067.6682  0.0139 -6.0642 3 1045.1135161  71510 303803347      793446        syn-C2H3C(O)NH2, v=0
  133067.6682  0.0139 -6.0642 3 1045.1135161  71510 303803348      793445        syn-C2H3C(O)NH2, v=0
  133076.7352  0.0057 -6.5420 3  556.2448125  71510 303621844      631549        syn-C2H3C(O)NH2, v=0
  133076.9430  0.0217 -7.0530 3  874.3190157  71510 303782256      791961        syn-C2H3C(O)NH2, v=0
  133084.8142  0.0051 -6.5086 3  540.4500123  71510 303611843      621548        syn-C2H3C(O)NH2, v=0
  133119.8602  0.0513 -6.8077 3 1177.2516145  71510 303724824      734727        syn-C2H3C(O)NH2, v=0
  133119.8602  0.0513 -6.8077 3 1177.2516145  71510 303724825      734726        syn-C2H3C(O)NH2, v=0
  133160.9616  0.0200 -4.5621 3  222.4866 79 -71510 303391228      381325        syn-C2H3C(O)NH2, v=0
  133175.4931  0.0011 -3.9710 3   36.8275 35  71510 30317 414      16 313        syn-C2H3C(O)NH2, v=0
  133220.2228  0.0102 -6.0272 3  684.2877107  71510 303533815      543718        syn-C2H3C(O)NH2, v=0
  133220.2228  0.0102 -6.0272 3  684.2877107  71510 303533816      543717        syn-C2H3C(O)NH2, v=0
  133229.6215  0.0012 -4.6843 3  303.8484 91  71510 303451531      441628        syn-C2H3C(O)NH2, v=0
  133229.9628  0.0012 -4.7339 3  333.8686 95  71510 303471632      461729        syn-C2H3C(O)NH2, v=0
  133242.6763  0.0200 -4.0087 3   56.5161 35 -71510 3031710 7      17 9 8        syn-C2H3C(O)NH2, v=0
  133243.1656  0.0009 -4.0087 3   56.5161 35  71510 3031710 8      17 9 9        syn-C2H3C(O)NH2, v=0
  133246.5353  0.0156 -6.9638 3  834.7330153  71510 303762254      771959        syn-C2H3C(O)NH2, v=0
  133256.1342  0.0009 -5.8959 3   52.5640 37  71510 30318 811      17 810        syn-C2H3C(O)NH2, v=0
  133275.0405  0.0009 -5.8958 3   52.5644 37  71510 30318 810      17 8 9        syn-C2H3C(O)NH2, v=0
  133275.7513  0.0024 -6.2685 3  146.2361 63  71510 303311120      32 825        syn-C2H3C(O)NH2, v=0
  133288.4066  0.0014 -3.8105 3  212.7279 77  71510 303381226      381127        syn-C2H3C(O)NH2, v=0
  133305.1340  0.0200 -4.6382 3  275.2766 87 -71510 303431430      421527        syn-C2H3C(O)NH2, v=0
  133306.6704  0.0028 -5.8150 3  296.1534 65  71510 3033227 5      3326 8        syn-C2H3C(O)NH2, v=0
  133306.6704  0.0028 -5.8150 3  296.1534 65  71510 3033227 6      3326 7        syn-C2H3C(O)NH2, v=0
  133317.7551  0.0200 -4.7333 3  333.8685 95 -71510 303471631      461730        syn-C2H3C(O)NH2, v=0
  133327.7688  0.0021 -7.0408 3  166.8627 71  71510 30335 728      35 729        syn-C2H3C(O)NH2, v=0
  133328.0246  0.0200 -4.7866 3  365.3358 99 -71510 303491733      481830        syn-C2H3C(O)NH2, v=0
  133359.2993  0.0200 -4.7864 3  365.3358 99 -71510 303491732      481831        syn-C2H3C(O)NH2, v=0
  133364.4974  0.0200 -4.5966 3  248.1550 83 -71510 303411329      401426        syn-C2H3C(O)NH2, v=0
  133387.9973  0.0149 -6.9052 3  788.1232149  71510 303742153      751858        syn-C2H3C(O)NH2, v=0
  133405.7247  0.0073 -6.6492 3  629.0820133  71510 303661947      671652        syn-C2H3C(O)NH2, v=0
  133421.7023  0.0028 -5.5873 3   22.0797 27  71510 30313 4 9      13 112        syn-C2H3C(O)NH2, v=0
  133470.0955  0.0200 -4.6827 3  303.8480 91 -71510 303451530      441629        syn-C2H3C(O)NH2, v=0
  133479.1226  0.0038 -6.2911 3  519.2997127  71510 303631053      64 956        syn-C2H3C(O)NH2, v=0
  133480.3632  0.0038 -6.2910 3  519.2997127  71510 303631153      64 856        syn-C2H3C(O)NH2, v=0
  133503.1094  0.0102 -6.7705 3  706.3761141  71510 303702050      711755        syn-C2H3C(O)NH2, v=0
  133517.9632  0.0200 -3.7973 3  207.8290 77 -71510 303381128      381029        syn-C2H3C(O)NH2, v=0
  133518.8675  0.0013 -4.8422 3  398.2488103  71510 303511834      501931        syn-C2H3C(O)NH2, v=0
  133528.5366  0.0009 -5.8173 3   43.6454 37  71510 30318 514      17 513        syn-C2H3C(O)NH2, v=0
  133529.7702  0.0013 -4.8421 3  398.2488103  71510 303511833      501932        syn-C2H3C(O)NH2, v=0
  133546.4246  0.0009 -4.0499 3   52.3407 33  71510 3031610 6      16 9 7        syn-C2H3C(O)NH2, v=0
  133546.5738  0.0009 -4.0499 3   52.3406 33  71510 3031610 7      16 9 8        syn-C2H3C(O)NH2, v=0
  133587.5985  0.0200 -3.7826 3  171.0210 69 -71510 303341124      341025        syn-C2H3C(O)NH2, v=0
  133621.6683  0.0200 -3.8751 3   45.6020 39 -71510 30319 316      18 415        syn-C2H3C(O)NH2, v=0
  133629.2111  0.0021 -4.4934 3  166.9418 69  71510 303341024      331123        syn-C2H3C(O)NH2, v=0
  133739.1621  0.0200 -3.8057 3  203.3679 77 -71510 303381029      38 930        syn-C2H3C(O)NH2, v=0
  133779.5802  0.0169 -6.1670 3 1100.5506165  71510 303823448      813547        syn-C2H3C(O)NH2, v=0
  133779.5802  0.0169 -6.1670 3 1100.5506165  71510 303823449      813546        syn-C2H3C(O)NH2, v=0
  133789.7848  0.0200 -4.9008 3  432.6067107 -71510 303531935      522032        syn-C2H3C(O)NH2, v=0
  133793.5261  0.0200 -4.9007 3  432.6067107 -71510 303531934      522033        syn-C2H3C(O)NH2, v=0
  133798.1836  0.0200 -4.0999 3   48.4164 31 -71510 3031510 5      15 9 6        syn-C2H3C(O)NH2, v=0
  133798.1836  0.0200 -4.0999 3   48.4164 31 -71510 3031510 6      15 9 7        syn-C2H3C(O)NH2, v=0
  133857.8929  0.0024 -6.8209 3   48.0994 35  71510 30317 8 9      18 514        syn-C2H3C(O)NH2, v=0
  133893.9775  0.0200 -6.1233 3  775.2569151  71510 303751759      741856        syn-C2H3C(O)NH2, v=0
  133907.0325  0.0020 -4.1062 3  481.9447117  71510 303581642      581543        syn-C2H3C(O)NH2, v=0
  133907.8584  0.0021 -3.8328 3  166.8433 71  71510 30335 728      35 629        syn-C2H3C(O)NH2, v=0
  133909.1684  0.0055 -6.5484 3  104.6268 55  71510 30327 819      28 524        syn-C2H3C(O)NH2, v=0
  133913.8291  0.0029 -6.2274 3  286.3565 89  71510 303441430      451135        syn-C2H3C(O)NH2, v=0
  133919.5789  0.0447 -6.7063 3 1120.2004141  71510 303704723      714626        syn-C2H3C(O)NH2, v=0
  133919.5789  0.0447 -6.7063 3 1120.2004141  71510 303704724      714625        syn-C2H3C(O)NH2, v=0
  133943.9428  0.0028 -5.8718 3  268.2992 61  71510 3033026 4      3125 7        syn-C2H3C(O)NH2, v=0
  133943.9428  0.0028 -5.8718 3  268.2992 61  71510 3033026 5      3125 6        syn-C2H3C(O)NH2, v=0
  133944.3870  0.0200 -4.6339 3  275.2755 87 -71510 303431429      421528        syn-C2H3C(O)NH2, v=0
  133948.5724  0.0056 -5.2957 3  372.9666105  71510 303521241      511338        syn-C2H3C(O)NH2, v=0
  133953.1616  0.0084 -5.9703 3  641.0748103  71510 303513714      523617        syn-C2H3C(O)NH2, v=0
  133953.1616  0.0084 -5.9703 3  641.0748103  71510 303513715      523616        syn-C2H3C(O)NH2, v=0
  133955.2766  0.0009 -5.8599 3   49.1154 37  71510 30318 712      17 711        syn-C2H3C(O)NH2, v=0
  134004.7322  0.0200 -4.1616 3   44.7423 29 -71510 3031410 4      14 9 5        syn-C2H3C(O)NH2, v=0
  134004.7322  0.0200 -4.1616 3   44.7423 29 -71510 3031410 5      14 9 6        syn-C2H3C(O)NH2, v=0
  134040.7720  0.0048 -6.3966 3  437.9034111  71510 303551639      561344        syn-C2H3C(O)NH2, v=0
  134127.7518  0.0200 -4.9623 3  468.4085111 -71510 303552036      542133        syn-C2H3C(O)NH2, v=0
  134129.0028  0.0200 -4.9623 3  468.4085111 -71510 303552035      542134        syn-C2H3C(O)NH2, v=0
  134172.2511  0.0200 -4.2403 3   41.3173 27 -71510 3031310 3      13 9 4        syn-C2H3C(O)NH2, v=0
  134172.2511  0.0200 -4.2403 3   41.3173 27 -71510 3031310 4      13 9 5        syn-C2H3C(O)NH2, v=0
  134188.8582  0.0591 -6.9642 3 1186.7183185  71510 303922270      912567        syn-C2H3C(O)NH2, v=0
  134210.4482  0.0009 -5.8583 3   49.1227 37  71510 30318 711      17 710        syn-C2H3C(O)NH2, v=0
  134304.3324  0.0297 -6.6401 3 1055.2631175  71510 303872067      862364        syn-C2H3C(O)NH2, v=0
  134306.2848  0.0200 -4.3460 3   38.1406 25 -71510 3031210 2      12 9 3        syn-C2H3C(O)NH2, v=0
  134306.2848  0.0200 -4.3460 3   38.1406 25 -71510 3031210 3      12 9 4        syn-C2H3C(O)NH2, v=0
  134330.1615  0.0109 -6.8195 3  750.5866145  71510 303722151      731856        syn-C2H3C(O)NH2, v=0
  134361.5755  0.0385 -6.7807 3 1108.6912179  71510 303892168      882465        syn-C2H3C(O)NH2, v=0
  134411.7146  0.0010 -4.5014 3   35.2114 23  71510 3031110 1      11 9 2        syn-C2H3C(O)NH2, v=0
  134411.7147  0.0010 -4.5014 3   35.2114 23  71510 3031110 2      11 9 3        syn-C2H3C(O)NH2, v=0
  134490.3363  0.0009 -5.8307 3   46.1714 37  71510 30318 613      17 612        syn-C2H3C(O)NH2, v=0
  134493.1130  0.0010 -4.7800 3   32.5289 21  71510 3031010 0      10 9 1        syn-C2H3C(O)NH2, v=0
  134493.1130  0.0010 -4.7800 3   32.5289 21  71510 3031010 1      10 9 2        syn-C2H3C(O)NH2, v=0
  134500.6070  0.0202 -6.2729 3 1157.4177169  71510 303843549      833648        syn-C2H3C(O)NH2, v=0
  134500.6070  0.0202 -6.2729 3 1157.4177169  71510 303843550      833647        syn-C2H3C(O)NH2, v=0
  134513.3448  0.0498 -6.4983 3  972.2164169  71510 303841966      832063        syn-C2H3C(O)NH2, v=0
  134521.4657  0.0016 -5.0268 3  505.6533115  71510 303572137      562234        syn-C2H3C(O)NH2, v=0
  134521.8653  0.0200 -5.0268 3  505.6533115 -71510 303572136      562235        syn-C2H3C(O)NH2, v=0
  134568.9702  0.0027 -5.9598 3  241.8889 57  71510 3032825 3      2924 6        syn-C2H3C(O)NH2, v=0
  134568.9702  0.0027 -5.9598 3  241.8889 57  71510 3032825 4      2924 5        syn-C2H3C(O)NH2, v=0
  134641.4882  0.0200 -4.2238 3  566.4701127 -71510 303631746      631647        syn-C2H3C(O)NH2, v=0
  134666.4697  0.0200 -3.7771 3  162.4498 67 -71510 303331123      331024        syn-C2H3C(O)NH2, v=0
  134677.9810  0.0069 -5.9196 3  599.2991 99  71510 303493613      503516        syn-C2H3C(O)NH2, v=0
  134677.9810  0.0069 -5.9196 3  599.2991 99  71510 303493614      503515        syn-C2H3C(O)NH2, v=0
  134691.2606  0.0043 -6.2604 3  160.0315 73  71510 30336 432      37 335        syn-C2H3C(O)NH2, v=0
  134692.8377  0.0043 -6.2604 3  160.0315 73  71510 30336 532      37 235        syn-C2H3C(O)NH2, v=0
  134712.3686  0.0388 -6.6091 3 1064.5774137  71510 303684622      694525        syn-C2H3C(O)NH2, v=0
  134712.3686  0.0388 -6.6091 3 1064.5774137  71510 303684623      694524        syn-C2H3C(O)NH2, v=0
  134740.1349  0.0195 -6.8322 3  889.1348165  71510 303821468      831371        syn-C2H3C(O)NH2, v=0
  134740.5432  0.0195 -6.8322 3  889.1348165  71510 303821568      831271        syn-C2H3C(O)NH2, v=0
  134844.0833  0.0342 -6.6707 3 1077.4808177  71510 303882068      872365        syn-C2H3C(O)NH2, v=0
  134845.6215  0.0020 -3.9990 3  404.2819107  71510 303531538      531439        syn-C2H3C(O)NH2, v=0
  134858.4818  0.0026 -7.1538 3  269.9133 89  71510 303441034      441035        syn-C2H3C(O)NH2, v=0
  134931.1916  0.0030 -4.4240 3  119.3954 59  71510 30329 821      28 920        syn-C2H3C(O)NH2, v=0
  134961.8151  0.0017 -5.0944 3  544.3403119  71510 303592238      582335        syn-C2H3C(O)NH2, v=0
  134961.9523  0.0017 -5.0944 3  544.3403119  71510 303592237      582336        syn-C2H3C(O)NH2, v=0
  135002.2288  0.0013 -4.5854 3  248.1519 83  71510 303411328      401427        syn-C2H3C(O)NH2, v=0
  135023.9438  0.0032 -6.2612 3  339.2800 97  71510 303481533      491238        syn-C2H3C(O)NH2, v=0
  135068.3591  0.0028 -6.1472 3  377.2922109  71510 30354 846      55 749        syn-C2H3C(O)NH2, v=0
  135069.8604  0.0028 -6.1472 3  377.2922109  71510 30354 946      55 649        syn-C2H3C(O)NH2, v=0
  135076.9341  0.0010 -3.7814 3  146.1760 63  71510 303311120      311021        syn-C2H3C(O)NH2, v=0
  135134.4011  0.0027 -3.9457 3  351.4617101  71510 303501238      501139        syn-C2H3C(O)NH2, v=0
  135148.7579  0.0009 -3.7967 3  217.6307 79  71510 303391129      391030        syn-C2H3C(O)NH2, v=0
  135173.9988  0.0077 -6.6888 3  670.8896137  71510 303682048      691753        syn-C2H3C(O)NH2, v=0
  135180.3330  0.0012 -7.0694 3  180.1997 73  71510 30336 928      36 729        syn-C2H3C(O)NH2, v=0
  135181.0469  0.0027 -6.0947 3  216.9230 53  71510 3032624 2      2723 5        syn-C2H3C(O)NH2, v=0
  135181.0469  0.0027 -6.0947 3  216.9230 53  71510 3032624 3      2723 4        syn-C2H3C(O)NH2, v=0
  135226.0947  0.0044 -6.3065 3  333.5377 97  71510 303481434      491139        syn-C2H3C(O)NH2, v=0
  135230.2197  0.0241 -6.3819 3 1215.7139173  71510 303863650      853749        syn-C2H3C(O)NH2, v=0
  135230.2197  0.0241 -6.3819 3 1215.7139173  71510 303863651      853748        syn-C2H3C(O)NH2, v=0
  135266.5829  0.0021 -4.1762 3   73.0413 51  71510 30325 223      25 124        syn-C2H3C(O)NH2, v=0
  135270.7161  0.0021 -4.1762 3   73.0413 51  71510 30325 323      25 224        syn-C2H3C(O)NH2, v=0
  135317.9973  0.0029 -4.3038 3   79.8045 49  71510 30324 618      23 717        syn-C2H3C(O)NH2, v=0
  135383.1472  0.0055 -6.4757 3  502.8399119  71510 303591742      601447        syn-C2H3C(O)NH2, v=0
  135394.4409  0.0057 -5.8753 3  558.9615 95  71510 303473512      483415        syn-C2H3C(O)NH2, v=0
  135394.4409  0.0057 -5.8753 3  558.9615 95  71510 303473513      483414        syn-C2H3C(O)NH2, v=0
  135420.0381  0.0047 -5.1025 3  305.0206 95  71510 303471137      461234        syn-C2H3C(O)NH2, v=0
  135441.5065  0.0019 -5.1650 3  584.4685123  71510 303612339      602436        syn-C2H3C(O)NH2, v=0
  135441.5510  0.0019 -5.1650 3  584.4685123  71510 303612338      602437        syn-C2H3C(O)NH2, v=0
  135498.1409  0.0335 -6.5162 3 1010.3835133  71510 303664521      674424        syn-C2H3C(O)NH2, v=0
  135498.1409  0.0335 -6.5162 3 1010.3835133  71510 303664522      674423        syn-C2H3C(O)NH2, v=0
  135568.6921  0.0016 -6.7697 3    8.0630 17  71510 303 8 4 5       8 1 8        syn-C2H3C(O)NH2, v=0
  135577.8725  0.0031 -6.1162 3  257.5205 91  71510 30345 639      46 542        syn-C2H3C(O)NH2, v=0
  135579.5338  0.0031 -6.1162 3  257.5205 91  71510 30345 739      46 442        syn-C2H3C(O)NH2, v=0
  135627.0137  0.1038 -6.9136 3 1191.1944187  71510 303932173      922270        syn-C2H3C(O)NH2, v=0
  135631.0840  0.0016 -3.8442 3  269.6652 87  71510 303431330      431231        syn-C2H3C(O)NH2, v=0
  135651.0426  0.0015 -4.0321 3   52.7859 41  71510 30320 416      19 515        syn-C2H3C(O)NH2, v=0
  135672.1083  0.0022 -7.0555 3  198.5703 77  71510 30338 830      38 831        syn-C2H3C(O)NH2, v=0
  135719.3903  0.0050 -6.3968 3  606.5848137  71510 303681157      691060        syn-C2H3C(O)NH2, v=0
  135720.2115  0.0050 -6.3968 3  606.5848137  71510 303681257      69 960        syn-C2H3C(O)NH2, v=0
  135727.0202  0.0035 -6.3138 3  396.6737105  71510 303521636      531341        syn-C2H3C(O)NH2, v=0
  135758.9990  0.0057 -6.5723 3  595.6462129  71510 303641945      651650        syn-C2H3C(O)NH2, v=0
  135759.2083  0.0013 -6.5727 3   10.1633 17  71510 303 8 5 3       8 2 6        syn-C2H3C(O)NH2, v=0
  135768.4015  0.0007 -4.1026 3   14.8312 21  71510 30310 5 6       9 4 5        syn-C2H3C(O)NH2, v=0
  135779.3993  0.0026 -6.3095 3  193.4018 49  71510 3032423 1      2522 4        syn-C2H3C(O)NH2, v=0
  135779.3993  0.0026 -6.3095 3  193.4018 49  71510 3032423 2      2522 3        syn-C2H3C(O)NH2, v=0
  135869.6105  0.0018 -3.9093 3  333.5162 97  71510 303481434      481335        syn-C2H3C(O)NH2, v=0
  135920.6813  0.0008 -3.7722 3  154.1401 65  71510 303321122      321023        syn-C2H3C(O)NH2, v=0
  135954.7415  0.0022 -5.2386 3  626.0372127  71510 303632440      622537        syn-C2H3C(O)NH2, v=0
  135954.7558  0.0022 -5.2386 3  626.0372127  71510 303632439      622538        syn-C2H3C(O)NH2, v=0
  135967.9638  0.0285 -6.4939 3 1275.4379177  71510 303883751      873850        syn-C2H3C(O)NH2, v=0
  135967.9638  0.0285 -6.4939 3 1275.4379177  71510 303883752      873849        syn-C2H3C(O)NH2, v=0
  136001.4336  0.0049 -6.3532 3  166.8627 69  71510 303341024      35 729        syn-C2H3C(O)NH2, v=0
  136012.2068  0.0024 -6.2210 3  184.7088 71  71510 303351223      36 928        syn-C2H3C(O)NH2, v=0
  136062.3588  0.0039 -6.3839 3  458.5348113  71510 303561739      571444        syn-C2H3C(O)NH2, v=0
  136063.4279  0.0046 -6.4704 3  524.8601121  71510 303601842      611547        syn-C2H3C(O)NH2, v=0
  136102.2747  0.0048 -5.8382 3  520.0626 91  71510 303453411      463314        syn-C2H3C(O)NH2, v=0
  136102.2747  0.0048 -5.8382 3  520.0626 91  71510 303453412      463313        syn-C2H3C(O)NH2, v=0
  136114.5170  0.0043 -6.2850 3  243.1793 83  71510 303411229      42 934        syn-C2H3C(O)NH2, v=0
  136188.5549  0.0374 -7.1265 3  892.2608157  71510 303782455      792158        syn-C2H3C(O)NH2, v=0
  136213.5370  0.0009 -5.7703 3   45.6020 39  71510 30319 416      18 415        syn-C2H3C(O)NH2, v=0
  136274.8974  0.0007 -4.0108 3   12.7328 17  71510 303 8 6 3       7 5 2        syn-C2H3C(O)NH2, v=0
  136276.7972  0.0288 -6.4276 3  957.6198129  71510 303644420      654323        syn-C2H3C(O)NH2, v=0
  136276.7972  0.0288 -6.4276 3  957.6198129  71510 303644421      654322        syn-C2H3C(O)NH2, v=0
  136278.0334  0.0007 -4.0108 3   12.7327 17  71510 303 8 6 2       7 5 3        syn-C2H3C(O)NH2, v=0
  136279.8278  0.0024 -7.0933 3  232.9225 83  71510 30341 932      41 933        syn-C2H3C(O)NH2, v=0
  136338.7694  0.0009 -3.6931 3   47.2159 41  71510 30320 218      19 317        syn-C2H3C(O)NH2, v=0
  136363.1834  0.0025 -6.7007 3  171.3257 45  71510 3032222 0      2321 3        syn-C2H3C(O)NH2, v=0
  136363.1834  0.0025 -6.7007 3  171.3257 45  71510 3032222 1      2321 2        syn-C2H3C(O)NH2, v=0
  136364.7932  0.0010 -3.5042 3   48.7969 45  71510 30322 022      21 121        syn-C2H3C(O)NH2, v=0
  136364.8076  0.0010 -5.6899 3   48.7969 45  71510 30322 122      21 121        syn-C2H3C(O)NH2, v=0
  136364.8241  0.0010 -5.6899 3   48.7969 45  71510 30322 022      21 021        syn-C2H3C(O)NH2, v=0
  136364.8386  0.0010 -3.5042 3   48.7969 45  71510 30322 122      21 021        syn-C2H3C(O)NH2, v=0
  136374.3408  0.0009 -3.5866 3   48.2758 43  71510 30321 120      20 219        syn-C2H3C(O)NH2, v=0
  136376.3802  0.0009 -5.7166 3   48.2758 43  71510 30321 220      20 219        syn-C2H3C(O)NH2, v=0
  136378.4352  0.0009 -5.7166 3   48.2757 43  71510 30321 120      20 119        syn-C2H3C(O)NH2, v=0
  136380.4746  0.0009 -3.5865 3   48.2757 43  71510 30321 220      20 119        syn-C2H3C(O)NH2, v=0
  136398.5369  0.0012 -4.5182 3  184.3820 73  71510 303361027      351124        syn-C2H3C(O)NH2, v=0
  136420.5626  0.0010 -3.8979 3   41.0515 37  71510 30318 415      17 314        syn-C2H3C(O)NH2, v=0
  136427.3724  0.0314 -7.0153 3 1001.9805175  71510 303871572      881475        syn-C2H3C(O)NH2, v=0
  136427.6358  0.0314 -7.0153 3 1001.9805175  71510 303871672      881375        syn-C2H3C(O)NH2, v=0
  136447.4632  0.0009 -5.7427 3   47.2159 41  71510 30320 318      19 317        syn-C2H3C(O)NH2, v=0
  136473.9965  0.0066 -6.5698 3  572.2407127  71510 303631845      641550        syn-C2H3C(O)NH2, v=0
  136496.8768  0.0027 -5.3153 3  669.0454131  71510 303652541      642638        syn-C2H3C(O)NH2, v=0
  136496.8814  0.0027 -5.3153 3  669.0454131  71510 303652540      642639        syn-C2H3C(O)NH2, v=0
  136539.6784  0.0009 -5.7421 3   47.2092 41  71510 30320 218      19 217        syn-C2H3C(O)NH2, v=0
  136549.6499  0.0010 -5.8173 3   46.2542 37  71510 30318 612      17 611        syn-C2H3C(O)NH2, v=0
  136614.6192  0.0198 -7.0614 3  902.8123159  71510 303792356      802061        syn-C2H3C(O)NH2, v=0
  136648.3722  0.0009 -3.6910 3   47.2092 41  71510 30320 318      19 217        syn-C2H3C(O)NH2, v=0
  136648.9604  0.0047 -6.4488 3  123.1718 65  71510 30332 329      33 232        syn-C2H3C(O)NH2, v=0
  136649.9582  0.0047 -6.4488 3  123.1718 65  71510 30332 429      33 132        syn-C2H3C(O)NH2, v=0
  136713.4484  0.0335 -6.6090 3 1336.5887181  71510 303903852      893951        syn-C2H3C(O)NH2, v=0
  136713.4484  0.0335 -6.6090 3 1336.5887181  71510 303903853      893950        syn-C2H3C(O)NH2, v=0
  136718.8566  0.0025 -6.3774 3  105.2881 53  71510 303261016      27 721        syn-C2H3C(O)NH2, v=0
  136781.9271  0.0007 -4.0985 3   14.8016 21  71510 30310 5 5       9 4 6        syn-C2H3C(O)NH2, v=0
  136801.1873  0.0041 -5.8089 3  482.6033 87  71510 303433310      443213        syn-C2H3C(O)NH2, v=0
  136801.1873  0.0041 -5.8089 3  482.6033 87  71510 303433311      443212        syn-C2H3C(O)NH2, v=0
  136802.0627  0.0021 -3.8195 3  198.5326 77  71510 30338 830      38 731        syn-C2H3C(O)NH2, v=0
  136804.1372  0.0011 -4.3124 3   15.5495 23  71510 30311 4 7      10 3 8        syn-C2H3C(O)NH2, v=0
  136842.8823  0.0032 -4.2118 3  561.9055127  71510 303631647      631548        syn-C2H3C(O)NH2, v=0
  136859.2825  0.0056 -6.4658 3  451.6916111  71510 303551838      561541        syn-C2H3C(O)NH2, v=0
  136921.9841  0.0030 -4.2933 3  617.6548133  71510 303661749      661650        syn-C2H3C(O)NH2, v=0
  136986.7504  0.0020 -7.0090 3  145.6064 67  71510 30333 627      33 628        syn-C2H3C(O)NH2, v=0
  137042.5182  0.0020 -7.1125 3   89.2809 55  71510 30327 324      27 325        syn-C2H3C(O)NH2, v=0
  137043.6144  0.0020 -4.0238 3   89.2808 55  71510 30327 324      27 225        syn-C2H3C(O)NH2, v=0
  137048.2268  0.0247 -6.3436 3  906.2873125  71510 303624319      634222        syn-C2H3C(O)NH2, v=0
  137048.2268  0.0247 -6.3436 3  906.2873125  71510 303624320      634221        syn-C2H3C(O)NH2, v=0
  137064.1622  0.0033 -5.3951 3  713.4922135  71510 303672642      662739        syn-C2H3C(O)NH2, v=0
  137064.1636  0.0033 -5.3951 3  713.4922135  71510 303672641      662740        syn-C2H3C(O)NH2, v=0
  137068.2383  0.0020 -4.0236 3   89.2809 55  71510 30327 424      27 325        syn-C2H3C(O)NH2, v=0
  137069.3346  0.0020 -7.1124 3   89.2808 55  71510 30327 424      27 225        syn-C2H3C(O)NH2, v=0
  137144.5120  0.0019 -3.8374 3  145.6011 67  71510 30333 627      33 528        syn-C2H3C(O)NH2, v=0
  137161.8746  0.0015 -4.5344 3  222.4781 79  71510 303391227      381326        syn-C2H3C(O)NH2, v=0
  137249.6677  0.0008 -3.7684 3  146.0945 63  71510 303311121      311022        syn-C2H3C(O)NH2, v=0
  137330.9039  0.0025 -3.8920 3  309.3331 95  71510 303471136      471037        syn-C2H3C(O)NH2, v=0
  137337.3907  0.0086 -6.6781 3  646.1020135  71510 303671948      681653        syn-C2H3C(O)NH2, v=0
  137353.0050  0.0009 -3.7732 3  138.3597 61  71510 303301119      301020        syn-C2H3C(O)NH2, v=0
  137466.3367  0.0391 -6.7272 3 1399.1650185  71510 303923953      914052        syn-C2H3C(O)NH2, v=0
  137466.3367  0.0391 -6.7272 3 1399.1650185  71510 303923954      914051        syn-C2H3C(O)NH2, v=0
  137490.8515  0.0036 -5.7884 3  446.5840 83  71510 3034132 9      423112        syn-C2H3C(O)NH2, v=0
  137490.8515  0.0036 -5.7884 3  446.5840 83  71510 303413210      423111        syn-C2H3C(O)NH2, v=0
  137589.0144  0.0010 -3.7939 3  227.6586 81  71510 303401130      401031        syn-C2H3C(O)NH2, v=0
  137653.5409  0.0042 -5.4779 3  759.3768139  71510 303692743      682840        syn-C2H3C(O)NH2, v=0
  137653.5414  0.0042 -5.4779 3  759.3768139  71510 303692742      682841        syn-C2H3C(O)NH2, v=0
  137694.3006  0.0033 -6.2061 3  452.3654119  71510 30359 950      60 853        syn-C2H3C(O)NH2, v=0
  137695.3201  0.0033 -6.2061 3  452.3654119  71510 303591050      60 753        syn-C2H3C(O)NH2, v=0
  137745.3279  0.0049 -6.3541 3  390.5585105  71510 303521537      531242        syn-C2H3C(O)NH2, v=0
  137798.3541  0.0011 -5.5916 3    6.3279 17  71510 303 8 3 6       7 0 7        syn-C2H3C(O)NH2, v=0
  137800.9198  0.0015 -3.7975 3  189.3346 75  71510 30337 929      37 830        syn-C2H3C(O)NH2, v=0
  137802.6288  0.0009 -7.0791 3    2.8389 11  71510 303 5 4 2       4 1 3        syn-C2H3C(O)NH2, v=0
  137812.3069  0.0210 -6.2642 3  856.3870121  71510 303604218      614121        syn-C2H3C(O)NH2, v=0
  137812.3069  0.0210 -6.2642 3  856.3870121  71510 303604219      614120        syn-C2H3C(O)NH2, v=0
  137816.7026  0.0009 -5.7588 3   45.4621 39  71510 30319 316      18 315        syn-C2H3C(O)NH2, v=0
  137817.8371  0.0077 -6.5242 3  700.5724147  71510 303731261      741164        syn-C2H3C(O)NH2, v=0
  137818.3765  0.0077 -6.5242 3  700.5724147  71510 303731361      741064        syn-C2H3C(O)NH2, v=0
  137980.0026  0.0050 -6.8253 3   90.8448 57  71510 30328 226      29 129        syn-C2H3C(O)NH2, v=0
  137980.5541  0.0050 -6.8253 3   90.8448 57  71510 30328 326      29 029        syn-C2H3C(O)NH2, v=0
  137993.9048  0.0123 -6.8002 3  724.4200143  71510 303712051      721756        syn-C2H3C(O)NH2, v=0
  138109.6095  0.0020 -7.0426 3  106.7991 59  71510 30329 425      29 426        syn-C2H3C(O)NH2, v=0
  138116.7810  0.0020 -3.9288 3  106.7988 59  71510 30329 425      29 326        syn-C2H3C(O)NH2, v=0
  138132.3646  0.0025 -6.2021 3  227.6586 79  71510 303391326      401031        syn-C2H3C(O)NH2, v=0
  138137.1539  0.0139 -6.9070 3  815.2464151  71510 303752253      761958        syn-C2H3C(O)NH2, v=0
  138146.0429  0.0017 -3.8074 3  166.8627 71  71510 30335 828      35 729        syn-C2H3C(O)NH2, v=0
  138170.9053  0.0033 -5.7780 3  412.0056 79  71510 3033931 8      403011        syn-C2H3C(O)NH2, v=0
  138170.9053  0.0033 -5.7780 3  412.0056 79  71510 3033931 9      403010        syn-C2H3C(O)NH2, v=0
  138226.3384  0.0454 -6.8485 3 1463.1657189  71510 303944054      934153        syn-C2H3C(O)NH2, v=0
  138226.3384  0.0454 -6.8485 3 1463.1657189  71510 303944055      934152        syn-C2H3C(O)NH2, v=0
  138232.0516  0.0020 -3.9281 3  106.7991 59  71510 30329 525      29 426        syn-C2H3C(O)NH2, v=0
  138239.2230  0.0020 -7.0419 3  106.7988 59  71510 30329 525      29 326        syn-C2H3C(O)NH2, v=0
  138249.6377  0.0019 -7.0103 3  125.5798 63  71510 30331 526      31 527        syn-C2H3C(O)NH2, v=0
  138262.5002  0.0052 -5.5638 3  806.6983143  71510 303712844      702941        syn-C2H3C(O)NH2, v=0
  138262.5003  0.0052 -5.5638 3  806.6983143  71510 303712843      702942        syn-C2H3C(O)NH2, v=0
  138286.5131  0.0019 -3.8693 3  125.5785 63  71510 30331 526      31 427        syn-C2H3C(O)NH2, v=0
  138320.8682  0.0755 -7.0720 3 1337.7354155  71510 303775126      785029        syn-C2H3C(O)NH2, v=0
  138320.8682  0.0755 -7.0720 3 1337.7354155  71510 303775127      785028        syn-C2H3C(O)NH2, v=0
  138360.5062  0.0022 -3.8263 3  232.8531 83  71510 30341 932      41 833        syn-C2H3C(O)NH2, v=0
  138392.2581  0.0013 -3.7931 3  213.0145 79  71510 303391030      39 931        syn-C2H3C(O)NH2, v=0
  138396.2759  0.0013 -3.7787 3  202.9678 75  71510 303371225      371126        syn-C2H3C(O)NH2, v=0
  138461.1758  0.0182 -6.9353 3  807.1906151  71510 303752154      761859        syn-C2H3C(O)NH2, v=0
  138481.2096  0.0036 -6.1562 3  210.6106 83  71510 30341 536      42 439        syn-C2H3C(O)NH2, v=0
  138482.4172  0.0036 -6.1562 3  210.6106 83  71510 30341 636      42 339        syn-C2H3C(O)NH2, v=0
  138508.9341  0.0023 -3.8513 3  269.7915 89  71510 303441034      44 935        syn-C2H3C(O)NH2, v=0
  138513.3383  0.0061 -6.7406 3   81.7129 49  71510 30324 717      25 422        syn-C2H3C(O)NH2, v=0
  138534.1376  0.0020 -4.3466 3  657.8120137  71510 303681850      681751        syn-C2H3C(O)NH2, v=0
  138568.9003  0.0177 -6.1898 3  807.9199117  71510 303584117      594020        syn-C2H3C(O)NH2, v=0
  138568.9003  0.0177 -6.1898 3  807.9199117  71510 303584118      594019        syn-C2H3C(O)NH2, v=0
  138576.4165  0.0008 -3.7660 3  138.3144 61  71510 303301120      301021        syn-C2H3C(O)NH2, v=0
  138627.8016  0.0018 -3.8286 3  145.6064 67  71510 30333 727      33 628        syn-C2H3C(O)NH2, v=0
  138663.4382  0.0033 -4.1291 3  508.6850121  71510 303601545      601446        syn-C2H3C(O)NH2, v=0
  138665.2866  0.0010 -6.8683 3  118.1501 39  71510 3031918 1      1818 0        syn-C2H3C(O)NH2, v=0
  138665.2866  0.0010 -6.8683 3  118.1501 39  71510 3031918 2      1818 1        syn-C2H3C(O)NH2, v=0
  138697.9029  0.0027 -6.1131 3  320.3587101  71510 30350 743      51 646        syn-C2H3C(O)NH2, v=0
  138699.0798  0.0027 -6.1131 3  320.3587101  71510 30350 843      51 546        syn-C2H3C(O)NH2, v=0
  138726.1324  0.0016 -7.0100 3  166.8433 71  71510 30335 828      35 629        syn-C2H3C(O)NH2, v=0
  138734.1367  0.0019 -3.8666 3  125.5798 63  71510 30331 626      31 527        syn-C2H3C(O)NH2, v=0
  138735.4883  0.0010 -6.5616 3  109.8878 39  71510 3031917 2      1817 1        syn-C2H3C(O)NH2, v=0
  138735.4883  0.0010 -6.5616 3  109.8878 39  71510 3031917 3      1817 2        syn-C2H3C(O)NH2, v=0
  138754.3374  0.0272 -7.0832 3  894.4097159  71510 303792257      801962        syn-C2H3C(O)NH2, v=0
  138771.0120  0.0019 -7.0073 3  125.5785 63  71510 30331 626      31 427        syn-C2H3C(O)NH2, v=0
  138783.3223  0.0023 -4.1528 3   65.6187 45  71510 30322 517      21 616        syn-C2H3C(O)NH2, v=0
  138785.5632  0.0018 -6.9987 3  145.6011 67  71510 30333 727      33 528        syn-C2H3C(O)NH2, v=0
  138817.8630  0.0010 -6.3810 3  102.0995 39  71510 3031916 3      1816 2        syn-C2H3C(O)NH2, v=0
  138817.8630  0.0010 -6.3810 3  102.0995 39  71510 3031916 4      1816 3        syn-C2H3C(O)NH2, v=0
  138840.9482  0.0031 -5.7794 3  378.8687 75  71510 3033730 7      382910        syn-C2H3C(O)NH2, v=0
  138840.9482  0.0031 -5.7794 3  378.8687 75  71510 3033730 8      3829 9        syn-C2H3C(O)NH2, v=0
  138853.7262  0.0644 -6.9251 3 1224.8829189  71510 303942173      932470        syn-C2H3C(O)NH2, v=0
  138888.9576  0.0066 -5.6528 3  855.4557147  71510 303732944      723043        syn-C2H3C(O)NH2, v=0
  138888.9576  0.0066 -5.6528 3  855.4557147  71510 303732945      723042        syn-C2H3C(O)NH2, v=0
  138915.9217  0.0010 -6.2528 3   94.7858 39  71510 3031915 4      1815 3        syn-C2H3C(O)NH2, v=0
  138915.9217  0.0010 -6.2528 3   94.7858 39  71510 3031915 5      1815 4        syn-C2H3C(O)NH2, v=0
  138953.3762  0.0022 -4.4309 3   63.0492 49  71510 30324 123      24 024        syn-C2H3C(O)NH2, v=0
  138953.6156  0.0022 -4.4309 3   63.0492 49  71510 30324 223      24 124        syn-C2H3C(O)NH2, v=0
  138993.2034  0.0524 -6.9729 3 1528.5895193  71510 303964155      954254        syn-C2H3C(O)NH2, v=0
  138993.2034  0.0524 -6.9729 3 1528.5895193  71510 303964156      954253        syn-C2H3C(O)NH2, v=0
  139034.5179  0.0010 -6.1539 3   87.9475 39  71510 3031914 5      1814 4        syn-C2H3C(O)NH2, v=0
  139034.5179  0.0010 -6.1539 3   87.9475 39  71510 3031914 6      1814 5        syn-C2H3C(O)NH2, v=0
  139135.8469  0.0666 -6.9611 3 1276.8906151  71510 303755025      764928        syn-C2H3C(O)NH2, v=0
  139135.8469  0.0666 -6.9611 3 1276.8906151  71510 303755026      764927        syn-C2H3C(O)NH2, v=0
  139180.5300  0.0010 -6.0739 3   81.5855 39  71510 3031913 6      1813 5        syn-C2H3C(O)NH2, v=0
  139180.5300  0.0010 -6.0739 3   81.5855 39  71510 3031913 7      1813 6        syn-C2H3C(O)NH2, v=0
  139183.3604  0.0200 -3.7693 3  130.8244 59 -71510 303291118      291019        syn-C2H3C(O)NH2, v=0
  139317.8549  0.0149 -6.1204 3  760.8867113  71510 303564016      573919        syn-C2H3C(O)NH2, v=0
  139317.8549  0.0149 -6.1204 3  760.8867113  71510 303564017      573918        syn-C2H3C(O)NH2, v=0
  139364.0025  0.0009 -6.0073 3   75.7014 39  71510 3031912 8      1812 7        syn-C2H3C(O)NH2, v=0
  139364.0026  0.0009 -6.0073 3   75.7014 39  71510 3031912 7      1812 6        syn-C2H3C(O)NH2, v=0
  139377.5004  0.0013 -6.9682 3    8.0837 15  71510 303 7 5 2       7 2 5        syn-C2H3C(O)NH2, v=0
  139416.6030  0.0096 -6.7660 3  732.1262143  71510 303712150      721855        syn-C2H3C(O)NH2, v=0
  139500.5381  0.0030 -5.7949 3  347.1737 71  71510 3033529 6      3628 9        syn-C2H3C(O)NH2, v=0
  139500.5381  0.0030 -5.7949 3  347.1737 71  71510 3033529 7      3628 8        syn-C2H3C(O)NH2, v=0
  139531.1752  0.0082 -5.7449 3  905.6479151  71510 303753045      743144        syn-C2H3C(O)NH2, v=0
  139531.1752  0.0082 -5.7449 3  905.6479151  71510 303753046      743143        syn-C2H3C(O)NH2, v=0
  139579.3676  0.0028 -4.3714 3  675.9330139  71510 303691851      691752        syn-C2H3C(O)NH2, v=0
  139600.1597  0.0009 -5.9509 3   70.2973 39  71510 3031911 9      1811 8        syn-C2H3C(O)NH2, v=0
  139600.1629  0.0009 -5.9509 3   70.2973 39  71510 3031911 8      1811 7        syn-C2H3C(O)NH2, v=0
  139667.4004  0.0013 -7.0362 3  189.2723 75  71510 30337 929      37 730        syn-C2H3C(O)NH2, v=0
  139708.0807  0.0027 -6.2077 3  275.0832 87  71510 303431429      441134        syn-C2H3C(O)NH2, v=0
  139766.7161  0.0602 -7.1003 3 1595.4352197  71510 303984256      974355        syn-C2H3C(O)NH2, v=0
  139766.7161  0.0602 -7.1003 3 1595.4352197  71510 303984257      974354        syn-C2H3C(O)NH2, v=0
  139768.8364  0.0008 -5.7627 3   42.7001 37  71510 30318 414      17 413        syn-C2H3C(O)NH2, v=0
  139784.1407  0.0128 -6.6719 3  801.2559157  71510 303781365      791268        syn-C2H3C(O)NH2, v=0
  139784.4927  0.0128 -6.6719 3  801.2559157  71510 303781465      791168        syn-C2H3C(O)NH2, v=0
  139810.0219  0.0025 -6.5795 3   71.0912 43  71510 30321 912      22 617        syn-C2H3C(O)NH2, v=0
  139847.4360  0.0200 -3.7654 3  130.8001 59 -71510 303291119      291020        syn-C2H3C(O)NH2, v=0
  139913.1752  0.0009 -5.9023 3   65.3763 39  71510 303191010      1810 9        syn-C2H3C(O)NH2, v=0
  139913.2799  0.0009 -5.9023 3   65.3763 39  71510 3031910 9      1810 8        syn-C2H3C(O)NH2, v=0
  139943.9265  0.0586 -6.8541 3 1217.4708147  71510 303734924      744827        syn-C2H3C(O)NH2, v=0
  139943.9265  0.0586 -6.8541 3 1217.4708147  71510 303734925      744826        syn-C2H3C(O)NH2, v=0
  139982.3030  0.0055 -6.4185 3  452.0507113  71510 303561640      571345        syn-C2H3C(O)NH2, v=0
  140012.3139  0.0046 -6.2960 3  292.2697 91  71510 303451332      461037        syn-C2H3C(O)NH2, v=0
  140059.0017  0.0124 -6.0564 3  715.2886109  71510 303543915      553818        syn-C2H3C(O)NH2, v=0
  140059.0017  0.0124 -6.0564 3  715.2886109  71510 303543916      553817        syn-C2H3C(O)NH2, v=0
  140064.0152  0.0021 -5.1941 3   30.9775 31  71510 30315 510      15 213        syn-C2H3C(O)NH2, v=0
  140143.9276  0.0040 -6.2908 3  534.1531129  71510 303641054      65 957        syn-C2H3C(O)NH2, v=0
  140144.6113  0.0040 -6.2908 3  534.1531129  71510 303641154      65 857        syn-C2H3C(O)NH2, v=0
  140149.1867  0.0029 -5.8279 3  316.9213 67  71510 3033328 5      3427 8        syn-C2H3C(O)NH2, v=0
  140149.1867  0.0029 -5.8279 3  316.9213 67  71510 3033328 6      3427 7        syn-C2H3C(O)NH2, v=0
  140187.6934  0.0102 -5.8401 3  957.2742155  71510 303773146      763245        syn-C2H3C(O)NH2, v=0
  140187.6934  0.0102 -5.8401 3  957.2742155  71510 303773147      763244        syn-C2H3C(O)NH2, v=0
  140343.1492  0.0009 -5.8599 3   60.9439 39  71510 30319 911      18 910        syn-C2H3C(O)NH2, v=0
  140345.6569  0.0009 -5.8599 3   60.9439 39  71510 30319 910      18 9 9        syn-C2H3C(O)NH2, v=0
  140385.8229  0.0025 -6.2810 3  138.2585 61  71510 303301119      31 824        syn-C2H3C(O)NH2, v=0
  140408.5454  0.0010 -3.8267 3   45.4621 39  71510 30319 416      18 315        syn-C2H3C(O)NH2, v=0
  140435.1245  0.0068 -6.6390 3  653.4558135  71510 303672047      681752        syn-C2H3C(O)NH2, v=0
  140442.6216  0.0034 -4.7932 3  233.2214 83  71510 303411032      401129        syn-C2H3C(O)NH2, v=0
  140448.9846  0.0029 -7.0889 3   39.7531 31  71510 30315 8 8      16 511        syn-C2H3C(O)NH2, v=0
  140498.2930  0.0009 -5.7562 3   48.0994 39  71510 30319 515      18 514        syn-C2H3C(O)NH2, v=0
  140562.3775  0.0023 -4.1744 3  549.8527125  71510 303621745      621646        syn-C2H3C(O)NH2, v=0
  140618.9495  0.0010 -5.7686 3   44.1523 37  71510 30318 513      17 512        syn-C2H3C(O)NH2, v=0
  140624.4921  0.0048 -6.3866 3  390.3700103  71510 303511735      521438        syn-C2H3C(O)NH2, v=0
  140682.2608  0.0008 -3.7688 3  123.5638 57  71510 303281117      281018        syn-C2H3C(O)NH2, v=0
  140745.0377  0.0513 -6.7512 3 1159.4771143  71510 303714823      724726        syn-C2H3C(O)NH2, v=0
  140745.0377  0.0513 -6.7512 3 1159.4771143  71510 303714824      724725        syn-C2H3C(O)NH2, v=0
  140786.3566  0.0029 -5.8838 3  288.1120 63  71510 3033127 4      3226 7        syn-C2H3C(O)NH2, v=0
  140786.3566  0.0029 -5.8838 3  288.1120 63  71510 3033127 5      3226 6        syn-C2H3C(O)NH2, v=0
  140792.1533  0.0103 -5.9981 3  671.1262105  71510 303523814      533717        syn-C2H3C(O)NH2, v=0
  140792.1533  0.0103 -5.9981 3  671.1262105  71510 303523815      533716        syn-C2H3C(O)NH2, v=0
  140798.1176  0.0030 -6.2351 3  326.9804 95  71510 303471532      481237        syn-C2H3C(O)NH2, v=0
  140845.9541  0.0200 -3.7889 3  237.9060 83 -71510 303411131      411032        syn-C2H3C(O)NH2, v=0
  140857.0338  0.0012 -4.4959 3  207.5842 77  71510 303381128      371225        syn-C2H3C(O)NH2, v=0
  140857.2791  0.0125 -5.9383 3 1010.3334159  71510 303793247      783346        syn-C2H3C(O)NH2, v=0
  140857.2791  0.0125 -5.9383 3 1010.3334159  71510 303793248      783345        syn-C2H3C(O)NH2, v=0
  140895.8495  0.0200 -3.7865 3   50.1456 41 -71510 30320 317      19 416        syn-C2H3C(O)NH2, v=0
  140905.2792  0.0043 -6.2536 3  168.2170 75  71510 30337 433      38 336        syn-C2H3C(O)NH2, v=0
  140906.1014  0.0043 -6.2536 3  168.2170 75  71510 30337 533      38 236        syn-C2H3C(O)NH2, v=0
  140910.7890  0.0075 -5.5417 3  513.3103123  71510 303611448      601545        syn-C2H3C(O)NH2, v=0
  140949.9381  0.0009 -5.8224 3   57.0090 39  71510 30319 812      18 811        syn-C2H3C(O)NH2, v=0
  140992.9509  0.0009 -5.8221 3   57.0100 39  71510 30319 811      18 810        syn-C2H3C(O)NH2, v=0
  141029.8498  0.0200 -3.7668 3  123.5512 57 -71510 303281118      281019        syn-C2H3C(O)NH2, v=0
  141172.5286  0.0051 -6.5264 3  579.2392127  71510 303631944      641649        syn-C2H3C(O)NH2, v=0
  141222.9508  0.0021 -4.3075 3  639.8970135  71510 303671849      671750        syn-C2H3C(O)NH2, v=0
  141318.2803  0.0200 -4.4757 3  198.2539 75 -71510 303371126      361225        syn-C2H3C(O)NH2, v=0
  141371.0007  0.0021 -4.1495 3   78.6005 53  71510 30326 224      26 125        syn-C2H3C(O)NH2, v=0
  141373.1098  0.0021 -4.1495 3   78.6005 53  71510 30326 324      26 225        syn-C2H3C(O)NH2, v=0
  141411.4566  0.0028 -5.9710 3  260.7461 59  71510 3032926 3      3025 6        syn-C2H3C(O)NH2, v=0
  141411.4566  0.0028 -5.9710 3  260.7461 59  71510 3032926 4      3025 5        syn-C2H3C(O)NH2, v=0
  141445.5025  0.0056 -6.4484 3  137.8065 63  71510 30331 922      32 627        syn-C2H3C(O)NH2, v=0
  141451.3237  0.0033 -6.2820 3  383.3474103  71510 303511635      521340        syn-C2H3C(O)NH2, v=0
  141494.8519  0.0020 -6.9972 3  175.4799 73  71510 30336 729      36 730        syn-C2H3C(O)NH2, v=0
  141517.1025  0.0086 -5.9459 3  628.4005101  71510 303503713      513616        syn-C2H3C(O)NH2, v=0
  141517.1025  0.0086 -5.9459 3  628.4005101  71510 303503714      513615        syn-C2H3C(O)NH2, v=0
  141538.3550  0.0049 -6.3182 3  208.0067 77  71510 303381127      39 832        syn-C2H3C(O)NH2, v=0
  141538.8856  0.0152 -6.0397 3 1064.8246163  71510 303813348      803447        syn-C2H3C(O)NH2, v=0
  141538.8856  0.0152 -6.0397 3 1064.8246163  71510 303813349      803446        syn-C2H3C(O)NH2, v=0
  141539.1031  0.0448 -6.6524 3 1102.9108139  71510 303694722      704625        syn-C2H3C(O)NH2, v=0
  141539.1031  0.0448 -6.6524 3 1102.9108139  71510 303694723      704624        syn-C2H3C(O)NH2, v=0
  141567.6693  0.0033 -4.0485 3  458.0004115  71510 303571443      571344        syn-C2H3C(O)NH2, v=0
  141584.5484  0.0029 -6.1448 3  389.9233111  71510 30355 847      56 750        syn-C2H3C(O)NH2, v=0
  141585.3646  0.0029 -6.1448 3  389.9233111  71510 30355 947      56 650        syn-C2H3C(O)NH2, v=0
  141605.8606  0.0042 -6.4288 3  509.4799119  71510 303591841      601546        syn-C2H3C(O)NH2, v=0
  141625.5673  0.0213 -6.8388 3  908.6282167  71510 303831469      841372        syn-C2H3C(O)NH2, v=0
  141625.7958  0.0213 -6.8388 3  908.6282167  71510 303831569      841272        syn-C2H3C(O)NH2, v=0
  141708.8694  0.0037 -6.3470 3  444.1816111  71510 303551738      561443        syn-C2H3C(O)NH2, v=0
  141712.6023  0.0232 -6.9581 3  805.2613149  71510 303742352      752055        syn-C2H3C(O)NH2, v=0
  141722.0268  0.0009 -5.7892 3   53.5837 39  71510 30319 713      18 712        syn-C2H3C(O)NH2, v=0
  141727.9368  0.0372 -6.7482 3 1131.4154181  71510 303902169      892466        syn-C2H3C(O)NH2, v=0
  141770.7430  0.0024 -6.9292 3   43.6454 33  71510 30316 8 8      17 513        syn-C2H3C(O)NH2, v=0
  141772.9224  0.0027 -4.4099 3  146.0945 65  71510 30332 923      311022        syn-C2H3C(O)NH2, v=0
  141824.9441  0.0023 -4.0507 3  466.6646115  71510 303571641      571542        syn-C2H3C(O)NH2, v=0
  141832.3634  0.0019 -3.8020 3  175.4687 73  71510 30336 729      36 630        syn-C2H3C(O)NH2, v=0
  141895.8783  0.0008 -7.1037 3  203.0959 77  71510 303381029      38 830        syn-C2H3C(O)NH2, v=0
  141931.5009  0.0200 -3.7714 3  116.5731 55 -71510 303271116      271017        syn-C2H3C(O)NH2, v=0
  141940.6170  0.0030 -6.1116 3  267.9287 93  71510 30346 640      47 543        syn-C2H3C(O)NH2, v=0
  141941.5043  0.0030 -6.1116 3  267.9287 93  71510 30346 740      47 443        syn-C2H3C(O)NH2, v=0
  141968.4030  0.0063 -6.4984 3  518.0106121  71510 303601743      611448        syn-C2H3C(O)NH2, v=0
  142020.9881  0.0009 -7.1371 3  193.5230 75  71510 303371028      37 829        syn-C2H3C(O)NH2, v=0
  142023.8390  0.0028 -6.1051 3  234.8243 55  71510 3032725 2      2824 5        syn-C2H3C(O)NH2, v=0
  142023.8390  0.0028 -6.1051 3  234.8243 55  71510 3032725 3      2824 4        syn-C2H3C(O)NH2, v=0
  142030.2934  0.0014 -4.5127 3  193.5227 75  71510 303371028      361125        syn-C2H3C(O)NH2, v=0
  142077.0589  0.0009 -5.7639 3   50.6575 39  71510 30319 614      18 613        syn-C2H3C(O)NH2, v=0
  142077.6805  0.0200 -4.0707 3   17.3335 23 -71510 30311 5 7      10 4 6        syn-C2H3C(O)NH2, v=0
  142106.8449  0.0200 -3.7704 3  116.5668 55 -71510 303271117      271018        syn-C2H3C(O)NH2, v=0
  142218.8484  0.0010 -5.7862 3   53.5994 39  71510 30319 712      18 711        syn-C2H3C(O)NH2, v=0
  142231.6205  0.0183 -6.1441 3 1120.7467167  71510 303833449      823548        syn-C2H3C(O)NH2, v=0
  142231.6205  0.0183 -6.1441 3 1120.7467167  71510 303833450      823547        syn-C2H3C(O)NH2, v=0
  142233.6196  0.0071 -5.9003 3  587.1122 97  71510 303483612      493515        syn-C2H3C(O)NH2, v=0
  142233.6196  0.0071 -5.9003 3  587.1122 97  71510 303483613      493514        syn-C2H3C(O)NH2, v=0
  142315.9900  0.0014 -3.8010 3  258.5281 85  71510 303421329      421230        syn-C2H3C(O)NH2, v=0
  142326.0359  0.0389 -6.5579 3 1047.7729135  71510 303674621      684524        syn-C2H3C(O)NH2, v=0
  142326.0359  0.0389 -6.5579 3 1047.7729135  71510 303674622      684523        syn-C2H3C(O)NH2, v=0
  142423.9339  0.0200 -3.4556 3   53.3456 47 -71510 30323 023      22 122        syn-C2H3C(O)NH2, v=0
  142423.9463  0.0010 -5.6424 3   53.3456 47  71510 30323 123      22 122        syn-C2H3C(O)NH2, v=0
  142423.9540  0.0010 -5.6424 3   53.3456 47  71510 30323 023      22 022        syn-C2H3C(O)NH2, v=0
  142423.9339  0.0200 -3.4556 3   53.3456 47 -71510 30323 123      22 022        syn-C2H3C(O)NH2, v=0
  142432.2268  0.0200 -3.5336 3   52.8249 45 -71510 30322 121      21 220        syn-C2H3C(O)NH2, v=0
  142433.2171  0.0010 -5.6679 3   52.8249 45  71510 30322 221      21 220        syn-C2H3C(O)NH2, v=0
  142434.2476  0.0010 -5.6679 3   52.8248 45  71510 30322 121      21 120        syn-C2H3C(O)NH2, v=0
  142434.4049  0.0054 -6.3989 3  622.6492139  71510 303691158      701061        syn-C2H3C(O)NH2, v=0
  142434.8589  0.0054 -6.3989 3  622.6492139  71510 303691258      70 961        syn-C2H3C(O)NH2, v=0
  142435.2674  0.0200 -3.5336 3   52.8248 45 -71510 30322 221      21 120        syn-C2H3C(O)NH2, v=0
  142448.1203  0.0200 -3.6323 3   51.7673 43 -71510 30321 219      20 318        syn-C2H3C(O)NH2, v=0
  142449.2340  0.0009 -5.7177 3   50.1456 41  71510 30320 417      19 416        syn-C2H3C(O)NH2, v=0
  142506.1467  0.0009 -5.6927 3   51.7673 43  71510 30321 319      20 318        syn-C2H3C(O)NH2, v=0
  142520.2986  0.0200 -3.7539 3  193.5227 73 -71510 303361224      361125        syn-C2H3C(O)NH2, v=0
  142556.8077  0.0009 -5.6923 3   51.7637 43  71510 30321 219      20 218        syn-C2H3C(O)NH2, v=0
  142614.8164  0.0200 -3.6312 3   51.7637 43 -71510 30321 319      20 218        syn-C2H3C(O)NH2, v=0
  142622.7968  0.0027 -6.3193 3  210.3468 51  71510 3032524 1      2623 4        syn-C2H3C(O)NH2, v=0
  142622.7968  0.0027 -6.3193 3  210.3468 51  71510 3032524 2      2623 3        syn-C2H3C(O)NH2, v=0
  142638.6344  0.0200 -4.5098 3  232.2662 81 -71510 303401229      391326        syn-C2H3C(O)NH2, v=0
  142703.9135  0.0200 -4.7375 3  377.5275101 -71510 303501734      491831        syn-C2H3C(O)NH2, v=0
  142737.1206  0.0013 -4.6829 3  345.5752 97  71510 303481633      471730        syn-C2H3C(O)NH2, v=0
  142764.0012  0.0013 -4.7371 3  377.5274101  71510 303501733      491832        syn-C2H3C(O)NH2, v=0
  142776.9481  0.0014 -4.7951 3  410.9260105  71510 303521835      511932        syn-C2H3C(O)NH2, v=0
  142791.3627  0.0048 -6.4417 3  130.3472 67  71510 30333 330      34 233        syn-C2H3C(O)NH2, v=0
  142791.8731  0.0048 -6.4417 3  130.3472 67  71510 30333 430      34 133        syn-C2H3C(O)NH2, v=0
  142798.2654  0.0014 -4.7950 3  410.9260105  71510 303521834      511933        syn-C2H3C(O)NH2, v=0
  142870.3998  0.0200 -4.6315 3  315.0707 93 -71510 303461532      451629        syn-C2H3C(O)NH2, v=0
  142902.4190  0.0013 -4.6818 3  345.5750 97  71510 303481632      471731        syn-C2H3C(O)NH2, v=0
  142934.7199  0.0219 -6.2516 3 1178.0985171  71510 303853550      843649        syn-C2H3C(O)NH2, v=0
  142934.7199  0.0219 -6.2516 3 1178.0985171  71510 303853551      843648        syn-C2H3C(O)NH2, v=0
  142941.4509  0.0059 -5.8618 3  547.2620 93  71510 303463511      473414        syn-C2H3C(O)NH2, v=0
  142941.4509  0.0059 -5.8618 3  547.2620 93  71510 303463512      473413        syn-C2H3C(O)NH2, v=0
  142945.3262  0.0014 -4.8557 3  445.7698109  71510 303541936      532033        syn-C2H3C(O)NH2, v=0
  142952.7448  0.0014 -4.8556 3  445.7698109  71510 303541935      532034        syn-C2H3C(O)NH2, v=0
  142987.8874  0.0200 -3.7769 3  109.8486 53 -71510 303261115      261016        syn-C2H3C(O)NH2, v=0
  143049.3125  0.0200 -4.5839 3  286.0157 89 -71510 303441431      431528        syn-C2H3C(O)NH2, v=0
  143073.0477  0.0200 -3.7764 3  109.8455 53 -71510 303261116      261017        syn-C2H3C(O)NH2, v=0
  143104.9062  0.0012 -4.5420 3  258.4127 85  71510 303421330      411427        syn-C2H3C(O)NH2, v=0
  143105.7394  0.0337 -6.4678 3  994.0643131  71510 303654520      664423        syn-C2H3C(O)NH2, v=0
  143105.7394  0.0337 -6.4678 3  994.0643131  71510 303654521      664422        syn-C2H3C(O)NH2, v=0
  143163.9826  0.0200 -3.8950 3   13.6187 15 -71510 303 7 7 1       6 6 0        syn-C2H3C(O)NH2, v=0
  143163.9826  0.0200 -3.8950 3   13.6187 15 -71510 303 7 7 0       6 6 1        syn-C2H3C(O)NH2, v=0
  143181.9874  0.0200 -3.7656 3  232.2481 81 -71510 303401229      401130        syn-C2H3C(O)NH2, v=0
  143194.6657  0.0200 -4.9191 3  482.0577113 -71510 303562037      552134        syn-C2H3C(O)NH2, v=0
  143197.2494  0.0200 -4.9191 3  482.0577113 -71510 303562036      552135        syn-C2H3C(O)NH2, v=0
  143207.5625  0.0026 -6.7102 3  187.3139 47  71510 3032323 0      2422 3        syn-C2H3C(O)NH2, v=0
  143207.5625  0.0026 -6.7102 3  187.3139 47  71510 3032323 1      2422 2        syn-C2H3C(O)NH2, v=0
  143224.2774  0.0021 -7.0839 3   95.4474 57  71510 30328 325      28 326        syn-C2H3C(O)NH2, v=0
  143224.3206  0.0064 -7.0172 3   61.4762 43  71510 30321 615      22 320        syn-C2H3C(O)NH2, v=0
  143224.8288  0.0021 -3.9984 3   95.4473 57  71510 30328 325      28 226        syn-C2H3C(O)NH2, v=0
  143237.9166  0.0021 -3.9983 3   95.4474 57  71510 30328 425      28 326        syn-C2H3C(O)NH2, v=0
  143238.4680  0.0021 -7.0838 3   95.4473 57  71510 30328 425      28 226        syn-C2H3C(O)NH2, v=0
  143306.7223  0.0024 -6.2219 3  175.7066 69  71510 303341222      35 927        syn-C2H3C(O)NH2, v=0
  143313.1131  0.0013 -4.6287 3  315.0700 93  71510 303461531      451630        syn-C2H3C(O)NH2, v=0
  143347.5125  0.0340 -7.0243 3 1022.6819177  71510 303881573      891476        syn-C2H3C(O)NH2, v=0
  143347.6602  0.0340 -7.0243 3 1022.6819177  71510 303881673      891376        syn-C2H3C(O)NH2, v=0
  143351.7404  0.0009 -6.5433 3    4.1212 13  71510 303 6 4 3       5 1 4        syn-C2H3C(O)NH2, v=0
  143364.6946  0.0200 -3.7728 3  242.6042 83 -71510 303411230      411131        syn-C2H3C(O)NH2, v=0
  143366.0189  0.0551 -6.8465 3 1201.1470187  71510 303932172      922469        syn-C2H3C(O)NH2, v=0
  143396.6174  0.0021 -3.9428 3  390.3700105  71510 303521537      521438        syn-C2H3C(O)NH2, v=0
  143487.6777  0.0009 -5.7107 3   50.0592 41  71510 30320 317      19 316        syn-C2H3C(O)NH2, v=0
  143511.5902  0.0016 -4.9855 3  519.7888117  71510 303582138      572235        syn-C2H3C(O)NH2, v=0
  143512.4462  0.0200 -4.9855 3  519.7888117 -71510 303582137      572236        syn-C2H3C(O)NH2, v=0
  143528.5722  0.0200 -3.9688 3   14.6918 19 -71510 303 9 6 4       8 5 3        syn-C2H3C(O)NH2, v=0
  143542.1651  0.0200 -3.9687 3   14.6914 19 -71510 303 9 6 3       8 5 4        syn-C2H3C(O)NH2, v=0
  143578.5733  0.0050 -6.3266 3  345.8381 99  71510 303491435      501140        syn-C2H3C(O)NH2, v=0
  143586.9802  0.0200 -3.7571 3  222.1388 79 -71510 303391228      391129        syn-C2H3C(O)NH2, v=0
  143640.3163  0.0050 -5.8311 3  508.8508 89  71510 303443410      453313        syn-C2H3C(O)NH2, v=0
  143640.3163  0.0050 -5.8311 3  508.8508 89  71510 303443411      453312        syn-C2H3C(O)NH2, v=0
  143647.5278  0.0259 -6.3621 3 1236.8791175  71510 303873651      863750        syn-C2H3C(O)NH2, v=0
  143647.5278  0.0259 -6.3621 3 1236.8791175  71510 303873652      863749        syn-C2H3C(O)NH2, v=0
  143650.1881  0.0200 -3.7796 3  222.8669 81 -71510 303401031      40 932        syn-C2H3C(O)NH2, v=0
  143680.9355  0.0010 -7.0723 3  212.8381 79  71510 303391030      39 831        syn-C2H3C(O)NH2, v=0
  143730.0097  0.0076 -6.5930 3  588.4347129  71510 303641846      651551        syn-C2H3C(O)NH2, v=0
  143795.3648  0.0041 -6.3282 3  333.5162 95  71510 303471632      481335        syn-C2H3C(O)NH2, v=0
  143828.8367  0.0015 -3.7793 3  198.5703 77  71510 30338 930      38 831        syn-C2H3C(O)NH2, v=0
  143866.4871  0.0123 -5.8490 3  675.9330141  71510 303701655      691752        syn-C2H3C(O)NH2, v=0
  143867.3341  0.0200 -3.8574 3  320.9904 95 -71510 303471433      471334        syn-C2H3C(O)NH2, v=0
  143878.1057  0.0290 -6.3823 3  941.7863127  71510 303634419      644322        syn-C2H3C(O)NH2, v=0
  143878.1057  0.0290 -6.3823 3  941.7863127  71510 303634420      644321        syn-C2H3C(O)NH2, v=0
  143884.9156  0.0018 -5.0549 3  558.9622121  71510 303602239      592336        syn-C2H3C(O)NH2, v=0
  143885.1998  0.0018 -5.0549 3  558.9622121  71510 303602238      592337        syn-C2H3C(O)NH2, v=0
  143890.6757  0.0200 -3.7851 3  103.3874 51 -71510 303251114      251015        syn-C2H3C(O)NH2, v=0
  143930.4189  0.0200 -3.7848 3  103.3860 51 -71510 303251115      251016        syn-C2H3C(O)NH2, v=0
  144011.3299  0.0183 -6.9955 3  882.5109157  71510 303782355      792060        syn-C2H3C(O)NH2, v=0
  144066.7900  0.0051 -6.8177 3   97.0102 59  71510 30329 227      30 130        syn-C2H3C(O)NH2, v=0
  144067.0658  0.0051 -6.8177 3   97.0102 59  71510 30329 327      30 030        syn-C2H3C(O)NH2, v=0
  144088.9816  0.0019 -6.9741 3  153.6068 69  71510 30334 628      34 629        syn-C2H3C(O)NH2, v=0
  144177.4326  0.0019 -3.8113 3  153.6039 69  71510 30334 628      34 529        syn-C2H3C(O)NH2, v=0
  144196.0877  0.0013 -4.5766 3  286.0135 89  71510 303441430      431529        syn-C2H3C(O)NH2, v=0
  144248.6639  0.0009 -3.7781 3  253.2002 85  71510 303421231      421132        syn-C2H3C(O)NH2, v=0
  144267.9185  0.0034 -6.2059 3  466.2083121  71510 30360 951      61 854        syn-C2H3C(O)NH2, v=0
  144268.4753  0.0034 -6.2059 3  466.2083121  71510 303601051      61 754        syn-C2H3C(O)NH2, v=0
  144305.6522  0.0020 -5.1273 3  599.5768125  71510 303622340      612437        syn-C2H3C(O)NH2, v=0
  144305.7455  0.0020 -5.1273 3  599.5768125  71510 303622339      612438        syn-C2H3C(O)NH2, v=0
  144329.9063  0.0043 -5.8094 3  471.8792 85  71510 3034233 9      433212        syn-C2H3C(O)NH2, v=0
  144329.9063  0.0043 -5.8094 3  471.8792 85  71510 303423310      433211        syn-C2H3C(O)NH2, v=0
  144363.7323  0.0007 -4.0627 3   17.2682 23  71510 30311 5 6      10 4 7        syn-C2H3C(O)NH2, v=0
  144369.4796  0.0306 -6.4758 3 1297.0873179  71510 303893752      883851        syn-C2H3C(O)NH2, v=0
  144369.4796  0.0306 -6.4758 3 1297.0873179  71510 303893753      883850        syn-C2H3C(O)NH2, v=0
  144409.4399  0.0031 -4.2955 3  101.9030 55  71510 30327 720      26 819        syn-C2H3C(O)NH2, v=0
  144429.5432  0.0020 -7.0135 3  113.5744 61  71510 30330 426      30 427        syn-C2H3C(O)NH2, v=0
  144433.2847  0.0020 -3.9042 3  113.5743 61  71510 30330 426      30 327        syn-C2H3C(O)NH2, v=0
  144449.4559  0.0200 -3.7477 3  212.2827 77 -71510 303381227      381128        syn-C2H3C(O)NH2, v=0
  144493.6623  0.0044 -4.3818 3  694.2291141  71510 303701852      701753        syn-C2H3C(O)NH2, v=0
  144497.0871  0.0020 -3.9039 3  113.5744 61  71510 30330 526      30 427        syn-C2H3C(O)NH2, v=0
  144499.5203  0.0018 -6.6420 3    9.9816 19  71510 303 9 4 6       9 1 9        syn-C2H3C(O)NH2, v=0
  144500.8286  0.0020 -7.0131 3  113.5743 61  71510 30330 526      30 327        syn-C2H3C(O)NH2, v=0
  144518.6769  0.0034 -6.7788 3   60.8046 39  71510 30319 911      20 614        syn-C2H3C(O)NH2, v=0
  144524.5869  0.0017 -3.7865 3  175.4799 73  71510 30336 829      36 730        syn-C2H3C(O)NH2, v=0
  144578.7629  0.0085 -6.5286 3  717.8472149  71510 303741262      751165        syn-C2H3C(O)NH2, v=0
  144579.0619  0.0085 -6.5286 3  717.8472149  71510 303741362      751065        syn-C2H3C(O)NH2, v=0
  144643.0152  0.0248 -6.3014 3  890.9397123  71510 303614318      624221        syn-C2H3C(O)NH2, v=0
  144643.0152  0.0248 -6.3014 3  890.9397123  71510 303614319      624220        syn-C2H3C(O)NH2, v=0
  144653.4267  0.0316 -6.2061 3  860.7341159  71510 303791862      781959        syn-C2H3C(O)NH2, v=0
  144667.3321  0.0200 -3.7960 3   97.1874 49 -71510 303241113      241014        syn-C2H3C(O)NH2, v=0
  144685.1136  0.0200 -3.7959 3   97.1867 49 -71510 303241114      241015        syn-C2H3C(O)NH2, v=0
  144695.3148  0.0026 -6.4135 3   98.5609 51  71510 303251015      26 720        syn-C2H3C(O)NH2, v=0
  144712.3006  0.0031 -3.9735 3  409.8648109  71510 303541341      541242        syn-C2H3C(O)NH2, v=0
  144758.2199  0.0036 -6.1515 3  220.0084 85  71510 30342 537      43 440        syn-C2H3C(O)NH2, v=0
  144758.8560  0.0036 -6.1515 3  220.0084 85  71510 30342 637      43 340        syn-C2H3C(O)NH2, v=0
  144766.5897  0.0200 -5.2028 3  641.6318129 -71510 303642441      632538        syn-C2H3C(O)NH2, v=0
  144766.5897  0.0200 -5.2028 3  641.6318129 -71510 303642440      632539        syn-C2H3C(O)NH2, v=0
  144828.8795  0.0019 -6.9794 3  132.9663 65  71510 30332 527      32 528        syn-C2H3C(O)NH2, v=0
  144840.4620  0.0020 -7.0075 3  208.0067 79  71510 30339 831      39 832        syn-C2H3C(O)NH2, v=0
  144848.8229  0.0019 -3.8447 3  132.9656 65  71510 30332 527      32 428        syn-C2H3C(O)NH2, v=0
  144862.0983  0.0016 -6.9787 3  175.4687 73  71510 30336 829      36 630        syn-C2H3C(O)NH2, v=0
  144884.4041  0.0200 -3.7820 3  248.3674 85 -71510 303421132      421033        syn-C2H3C(O)NH2, v=0
  144920.5570  0.0200 -4.2890 3  635.0629135 -71510 303671750      671651        syn-C2H3C(O)NH2, v=0
  144929.8331  0.0733 -6.6061 3 1067.6140177  71510 303882069      872166        syn-C2H3C(O)NH2, v=0
  144958.7911  0.0014 -7.0050 3  198.5326 77  71510 30338 930      38 731        syn-C2H3C(O)NH2, v=0
  145009.8799  0.0038 -5.7977 3  436.3479 81  71510 3034032 8      413111        syn-C2H3C(O)NH2, v=0
  145009.8799  0.0038 -5.7977 3  436.3479 81  71510 3034032 9      413110        syn-C2H3C(O)NH2, v=0
  145015.7364  0.0023 -4.4047 3   68.2041 51  71510 30325 124      25 025        syn-C2H3C(O)NH2, v=0
  145015.8529  0.0023 -4.4047 3   68.2041 51  71510 30325 224      25 125        syn-C2H3C(O)NH2, v=0
  145041.0754  0.0200 -3.7587 3   50.0592 41 -71510 30320 417      19 316        syn-C2H3C(O)NH2, v=0
  145072.3454  0.0018 -3.8062 3  153.6068 69  71510 30334 728      34 629        syn-C2H3C(O)NH2, v=0
  145100.0876  0.0358 -6.5925 3 1358.7218183  71510 303913853      903952        syn-C2H3C(O)NH2, v=0
  145100.0876  0.0358 -6.5925 3 1358.7218183  71510 303913854      903951        syn-C2H3C(O)NH2, v=0
  145107.0976  0.0019 -3.8433 3  132.9663 65  71510 30332 627      32 528        syn-C2H3C(O)NH2, v=0
  145123.4157  0.0028 -6.1106 3  331.9791103  71510 30351 744      52 647        syn-C2H3C(O)NH2, v=0
  145124.0485  0.0028 -6.1106 3  331.9791103  71510 30351 844      52 547        syn-C2H3C(O)NH2, v=0
  145127.0410  0.0019 -6.9778 3  132.9656 65  71510 30332 627      32 428        syn-C2H3C(O)NH2, v=0
  145133.6843  0.0852 -7.1251 3 1380.5397157  71510 303785226      795129        syn-C2H3C(O)NH2, v=0
  145133.6843  0.0852 -7.1251 3 1380.5397157  71510 303785227      795128        syn-C2H3C(O)NH2, v=0
  145160.7964  0.0018 -6.9682 3  153.6039 69  71510 30334 728      34 529        syn-C2H3C(O)NH2, v=0
  145262.1013  0.0029 -5.2812 3  685.1263133  71510 303662542      652639        syn-C2H3C(O)NH2, v=0
  145262.1110  0.0029 -5.2812 3  685.1263133  71510 303662541      652640        syn-C2H3C(O)NH2, v=0
  145279.5442  0.0026 -4.4448 3  736.7485145  71510 303721953      721854        syn-C2H3C(O)NH2, v=0
  145289.4108  0.0103 -6.7016 3  663.3192137  71510 303681949      691654        syn-C2H3C(O)NH2, v=0
  145311.6292  0.0028 -4.6716 3  222.8115 81  71510 303401031      391128        syn-C2H3C(O)NH2, v=0
  145323.6017  0.0402 -6.7530 3 1154.4046183  71510 303912170      902467        syn-C2H3C(O)NH2, v=0
  145334.3321  0.0011 -5.7436 3   50.8090 39  71510 30319 613      18 612        syn-C2H3C(O)NH2, v=0
  145337.7116  0.0200 -3.8099 3   91.2464 47 -71510 303231112      231013        syn-C2H3C(O)NH2, v=0
  145345.3121  0.0200 -3.8099 3   91.2462 47 -71510 303231113      231014        syn-C2H3C(O)NH2, v=0
  145400.3350  0.0211 -6.2254 3  841.5255119  71510 303594217      604120        syn-C2H3C(O)NH2, v=0
  145400.3350  0.0211 -6.2254 3  841.5255119  71510 303594218      604119        syn-C2H3C(O)NH2, v=0
  145514.2415  0.0019 -3.7874 3  207.9842 79  71510 30339 831      39 732        syn-C2H3C(O)NH2, v=0
  145574.7850  0.0025 -6.1932 3  217.6307 77  71510 303381325      391030        syn-C2H3C(O)NH2, v=0
  145636.3375  0.0200 -3.7380 3  202.6850 75 -71510 303371226      371127        syn-C2H3C(O)NH2, v=0
  145640.3250  0.0126 -6.8452 3  795.9718149  71510 303742252      751957        syn-C2H3C(O)NH2, v=0
  145679.8612  0.0034 -5.7978 3  402.2575 77  71510 3033831 7      393010        syn-C2H3C(O)NH2, v=0
  145679.8612  0.0034 -5.7978 3  402.2575 77  71510 3033831 8      3930 9        syn-C2H3C(O)NH2, v=0
  145690.5681  0.0466 -6.7877 3 1177.6513185  71510 303922171      912468        syn-C2H3C(O)NH2, v=0
  145735.3326  0.0017 -4.5335 3  202.9678 77  71510 303381029      371126        syn-C2H3C(O)NH2, v=0
  145770.6625  0.0517 -6.8951 3 1210.2004187  71510 303932271      922568        syn-C2H3C(O)NH2, v=0
  145787.4528  0.0036 -5.3627 3  730.0594137  71510 303682643      672740        syn-C2H3C(O)NH2, v=0
  145787.4559  0.0036 -5.3627 3  730.0594137  71510 303682642      672741        syn-C2H3C(O)NH2, v=0
  145800.0740  0.0790 -7.0839 3 1291.6210193  71510 303962373      952670        syn-C2H3C(O)NH2, v=0
  145809.3049  0.0200 -3.7352 3  184.3820 71 -71510 303351223      351124        syn-C2H3C(O)NH2, v=0
  145838.9304  0.0417 -6.7122 3 1421.7816187  71510 303933954      924053        syn-C2H3C(O)NH2, v=0
  145838.9304  0.0417 -6.7122 3 1421.7816187  71510 303933955      924052        syn-C2H3C(O)NH2, v=0
  145852.6462  0.1426 -7.0456 3 1296.4844195  71510 303972276      962373        syn-C2H3C(O)NH2, v=0
  145916.7075  0.0200 -3.8269 3   85.5630 45 -71510 303221111      221012        syn-C2H3C(O)NH2, v=0
  145918.2089  0.0200 -3.7814 3  264.0289 87 -71510 303431232      431133        syn-C2H3C(O)NH2, v=0
  145919.8039  0.0200 -3.8268 3   85.5628 45 -71510 303221112      221013        syn-C2H3C(O)NH2, v=0
  145950.4475  0.0755 -7.0125 3 1318.7547153  71510 303765125      775028        syn-C2H3C(O)NH2, v=0
  145950.4475  0.0755 -7.0125 3 1318.7547153  71510 303765126      775027        syn-C2H3C(O)NH2, v=0
  145951.3800  0.0011 -6.8513 3  131.5095 41  71510 3032019 1      1919 0        syn-C2H3C(O)NH2, v=0
  145951.3800  0.0011 -6.8513 3  131.5095 41  71510 3032019 2      1919 1        syn-C2H3C(O)NH2, v=0
  145954.0824  0.0014 -4.5238 3  258.4068 85  71510 303421329      411428        syn-C2H3C(O)NH2, v=0
  146021.3849  0.0011 -6.5430 3  122.7755 41  71510 3032018 2      1918 1        syn-C2H3C(O)NH2, v=0
  146021.3849  0.0011 -6.5430 3  122.7755 41  71510 3032018 3      1918 2        syn-C2H3C(O)NH2, v=0
  146041.4191  0.0200 -3.9000 3   57.6990 43 -71510 30321 417      20 516        syn-C2H3C(O)NH2, v=0
  146102.6171  0.0010 -6.3608 3  114.5155 41  71510 3032017 3      1917 2        syn-C2H3C(O)NH2, v=0
  146102.6171  0.0010 -6.3608 3  114.5155 41  71510 3032017 4      1917 3        syn-C2H3C(O)NH2, v=0
  146149.9179  0.0179 -6.1546 3  793.5447115  71510 303574116      584019        syn-C2H3C(O)NH2, v=0
  146149.9179  0.0179 -6.1546 3  793.5447115  71510 303574117      584018        syn-C2H3C(O)NH2, v=0
  146162.8682  0.0008 -5.7110 3   47.3623 39  71510 30319 415      18 414        syn-C2H3C(O)NH2, v=0
  146198.1146  0.0010 -6.2310 3  106.7299 41  71510 3032016 4      1916 3        syn-C2H3C(O)NH2, v=0
  146198.1146  0.0010 -6.2310 3  106.7299 41  71510 3032016 5      1916 4        syn-C2H3C(O)NH2, v=0
  146311.9933  0.0010 -6.1304 3   99.4195 41  71510 3032015 5      1915 4        syn-C2H3C(O)NH2, v=0
  146311.9933  0.0010 -6.1304 3   99.4195 41  71510 3032015 6      1915 5        syn-C2H3C(O)NH2, v=0
  146327.8942  0.0038 -6.2923 3  281.1326 87  71510 303431529      441232        syn-C2H3C(O)NH2, v=0
  146338.9226  0.0046 -5.4473 3  776.4302141  71510 303702744      692841        syn-C2H3C(O)NH2, v=0
  146338.9236  0.0046 -5.4473 3  776.4302141  71510 303702743      692842        syn-C2H3C(O)NH2, v=0
  146339.4365  0.0032 -5.8122 3  369.6087 73  71510 3033630 6      3729 9        syn-C2H3C(O)NH2, v=0
  146339.4365  0.0032 -5.8122 3  369.6087 73  71510 3033630 7      3729 8        syn-C2H3C(O)NH2, v=0
  146416.1055  0.0200 -3.8473 3   80.1355 43 -71510 303211110      211011        syn-C2H3C(O)NH2, v=0
  146417.3081  0.0200 -3.8473 3   80.1354 43 -71510 303211111      211012        syn-C2H3C(O)NH2, v=0
  146449.9534  0.0010 -6.0488 3   92.5852 41  71510 3032014 6      1914 5        syn-C2H3C(O)NH2, v=0
  146449.9534  0.0010 -6.0488 3   92.5852 41  71510 3032014 7      1914 6        syn-C2H3C(O)NH2, v=0
  146585.6431  0.0482 -6.8350 3 1486.2655191  71510 303954055      944154        syn-C2H3C(O)NH2, v=0
  146585.6431  0.0482 -6.8350 3 1486.2655191  71510 303954056      944153        syn-C2H3C(O)NH2, v=0
  146586.9026  0.0142 -6.6786 3  819.7403159  71510 303791366      801269        syn-C2H3C(O)NH2, v=0
  146587.0983  0.0142 -6.6786 3  819.7403159  71510 303791466      801169        syn-C2H3C(O)NH2, v=0
  146620.0937  0.0010 -5.9805 3   86.2281 41  71510 3032013 7      1913 6        syn-C2H3C(O)NH2, v=0
  146620.0937  0.0010 -5.9805 3   86.2281 41  71510 3032013 8      1913 7        syn-C2H3C(O)NH2, v=0
  146661.9095  0.0050 -6.3081 3  253.6360 85  71510 303421230      43 935        syn-C2H3C(O)NH2, v=0
  146665.4879  0.0151 -6.8236 3  742.6602145  71510 303722052      731757        syn-C2H3C(O)NH2, v=0
  146688.3778  0.0042 -4.4711 3  755.9176147  71510 303731954      731855        syn-C2H3C(O)NH2, v=0
  146748.6755  0.0021 -7.0388 3  243.1793 85  71510 30342 933      42 934        syn-C2H3C(O)NH2, v=0
  146760.1992  0.0667 -6.9040 3 1258.3938149  71510 303745024      754927        syn-C2H3C(O)NH2, v=0
  146760.1992  0.0667 -6.9040 3 1258.3938149  71510 303745025      754926        syn-C2H3C(O)NH2, v=0
  146770.7001  0.0043 -6.2929 3  549.2073131  71510 303651055      66 958        syn-C2H3C(O)NH2, v=0
  146771.0750  0.0043 -6.2929 3  549.2073131  71510 303651155      66 858        syn-C2H3C(O)NH2, v=0
  146808.7293  0.0141 -6.8059 3  722.7089141  71510 303702249      711952        syn-C2H3C(O)NH2, v=0
  146834.2859  0.0010 -5.9224 3   80.3501 41  71510 3032012 9      1912 8        syn-C2H3C(O)NH2, v=0
  146834.2862  0.0010 -5.9224 3   80.3501 41  71510 3032012 8      1912 7        syn-C2H3C(O)NH2, v=0
  146845.5627  0.0009 -3.8716 3   74.9627 41  71510 3032011 9      201010        syn-C2H3C(O)NH2, v=0
  146845.9979  0.0009 -3.8716 3   74.9627 41  71510 303201110      201011        syn-C2H3C(O)NH2, v=0
  146856.0330  0.0056 -6.3749 3  403.8813107  71510 303531538      541243        syn-C2H3C(O)NH2, v=0
  146891.6012  0.0151 -6.0891 3  746.9982111  71510 303554015      563918        syn-C2H3C(O)NH2, v=0
  146891.6012  0.0151 -6.0891 3  746.9982111  71510 303554016      563917        syn-C2H3C(O)NH2, v=0
  146906.7915  0.0023 -7.0912 3  280.9913 91  71510 303451035      451036        syn-C2H3C(O)NH2, v=0
  146913.4280  0.0058 -5.5349 3  824.2376145  71510 303722845      712942        syn-C2H3C(O)NH2, v=0
  146913.4283  0.0058 -5.5349 3  824.2376145  71510 303722844      712943        syn-C2H3C(O)NH2, v=0
  146954.2472  0.0063 -5.3074 3  433.0015113  71510 303561344      551441        syn-C2H3C(O)NH2, v=0
  146983.0425  0.0022 -4.5853 3  212.7279 79  71510 303391030      381127        syn-C2H3C(O)NH2, v=0
  146988.1511  0.0031 -5.8441 3  338.4019 69  71510 3033429 5      3528 8        syn-C2H3C(O)NH2, v=0
  146988.1511  0.0031 -5.8441 3  338.4019 69  71510 3033429 6      3528 7        syn-C2H3C(O)NH2, v=0
  147000.1853  0.0011 -7.0425 3  222.7552 81  71510 303401031      40 832        syn-C2H3C(O)NH2, v=0
  147006.7744  0.0087 -6.7085 3  713.8788141  71510 303702149      711854        syn-C2H3C(O)NH2, v=0
  147023.7012  0.0200 -3.7287 3  193.3497 73 -71510 303361225      361126        syn-C2H3C(O)NH2, v=0
  147104.7611  0.0042 -6.2485 3  176.6045 77  71510 30338 434      39 337        syn-C2H3C(O)NH2, v=0
  147105.1872  0.0042 -6.2485 3  176.6045 77  71510 30338 534      39 237        syn-C2H3C(O)NH2, v=0
  147110.6260  0.0010 -5.8722 3   74.9538 41  71510 303201110      1911 9        syn-C2H3C(O)NH2, v=0
  147110.6366  0.0010 -5.8722 3   74.9538 41  71510 3032011 9      1911 8        syn-C2H3C(O)NH2, v=0
  147122.6074  0.0027 -4.2565 3  622.2220133  71510 303661848      661749        syn-C2H3C(O)NH2, v=0
  147213.3385  0.0200 -3.9004 3   70.0433 39 -71510 3031911 8      1910 9        syn-C2H3C(O)NH2, v=0
  147213.3385  0.0200 -3.9004 3   70.0433 39 -71510 3031911 9      191010        syn-C2H3C(O)NH2, v=0
  147257.8097  0.0039 -4.1952 3  578.4194129  71510 303641648      641549        syn-C2H3C(O)NH2, v=0
  147264.8657  0.0026 -6.1905 3  264.0289 85  71510 303421428      431133        syn-C2H3C(O)NH2, v=0
  147286.7775  0.0037 -6.5723 3   86.3332 47  71510 303231014      24 717        syn-C2H3C(O)NH2, v=0
  147290.2528  0.0009 -5.7007 3   52.7859 41  71510 30320 516      19 515        syn-C2H3C(O)NH2, v=0
  147339.9096  0.0556 -6.9609 3 1552.1721195  71510 303974156      964255        syn-C2H3C(O)NH2, v=0
  147339.9096  0.0556 -6.9609 3 1552.1721195  71510 303974157      964254        syn-C2H3C(O)NH2, v=0
  147352.2205  0.0028 -3.9074 3  364.2943103  71510 303511239      511140        syn-C2H3C(O)NH2, v=0
  147469.0158  0.0022 -4.1249 3   84.3618 55  71510 30327 225      27 126        syn-C2H3C(O)NH2, v=0
  147470.0845  0.0022 -4.1249 3   84.3618 55  71510 30327 325      27 226        syn-C2H3C(O)NH2, v=0
  147478.0480  0.0010 -5.8283 3   70.0433 41  71510 303201011      191010        syn-C2H3C(O)NH2, v=0
  147478.3455  0.0010 -5.8283 3   70.0433 41  71510 303201010      1910 9        syn-C2H3C(O)NH2, v=0
  147495.0657  0.0042 -4.9211 3  292.9230 93  71510 303461136      451233        syn-C2H3C(O)NH2, v=0
  147508.4194  0.0073 -5.6255 3  873.4808149  71510 303742946      733043        syn-C2H3C(O)NH2, v=0
  147508.4195  0.0073 -5.6255 3  873.4808149  71510 303742945      733044        syn-C2H3C(O)NH2, v=0
  147516.0872  0.0020 -4.7692 3   13.9233 23  71510 30311 3 8      10 2 9        syn-C2H3C(O)NH2, v=0
  147526.3965  0.0200 -3.9347 3   65.3763 37 -71510 3031811 7      1810 8        syn-C2H3C(O)NH2, v=0
  147526.3965  0.0200 -3.9347 3   65.3763 37 -71510 3031811 8      1810 9        syn-C2H3C(O)NH2, v=0
  147562.8711  0.0587 -6.7995 3 1199.4582145  71510 303724923      734826        syn-C2H3C(O)NH2, v=0
  147562.8711  0.0587 -6.7995 3 1199.4582145  71510 303724924      734825        syn-C2H3C(O)NH2, v=0
  147625.2049  0.0126 -6.0293 3  701.8868107  71510 303533914      543817        syn-C2H3C(O)NH2, v=0
  147625.2049  0.0126 -6.0293 3  701.8868107  71510 303533915      543816        syn-C2H3C(O)NH2, v=0
  147625.5062  0.0030 -5.8989 3  308.6377 65  71510 3033228 4      3327 7        syn-C2H3C(O)NH2, v=0
  147625.5062  0.0030 -5.8989 3  308.6377 65  71510 3033228 5      3327 6        syn-C2H3C(O)NH2, v=0
  147689.7435  0.0200 -4.0468 3   20.1128 25 -71510 30312 5 8      11 4 7        syn-C2H3C(O)NH2, v=0
  147703.7547  0.0200 -3.7103 3   54.8972 43 -71510 30321 318      20 417        syn-C2H3C(O)NH2, v=0
  147748.1247  0.0028 -4.4044 3  717.7806143  71510 303711952      711853        syn-C2H3C(O)NH2, v=0
  147784.3056  0.0064 -6.5927 3  111.4100 57  71510 30328 820      29 525        syn-C2H3C(O)NH2, v=0
  147791.2798  0.0200 -3.9758 3   60.9606 35 -71510 3031711 6      1710 7        syn-C2H3C(O)NH2, v=0
  147791.2798  0.0200 -3.9758 3   60.9606 35 -71510 3031711 7      1710 8        syn-C2H3C(O)NH2, v=0
  147874.2467  0.0229 -6.9584 3  826.4536153  71510 303762155      771860        syn-C2H3C(O)NH2, v=0
  147961.5736  0.0200 -3.7645 3  247.7196 83 -71510 303411328      411229        syn-C2H3C(O)NH2, v=0
  147984.1459  0.0010 -5.7895 3   65.6252 41  71510 30320 912      19 911        syn-C2H3C(O)NH2, v=0
  147990.3466  0.0010 -5.7895 3   65.6254 41  71510 30320 911      19 910        syn-C2H3C(O)NH2, v=0
  148013.5941  0.0200 -4.0255 3   56.7953 33 -71510 3031611 5      1610 6        syn-C2H3C(O)NH2, v=0
  148013.5941  0.0200 -4.0255 3   56.7953 33 -71510 3031611 6      1610 7        syn-C2H3C(O)NH2, v=0
  148019.4199  0.0020 -3.7920 3  243.1369 85  71510 30342 933      42 834        syn-C2H3C(O)NH2, v=0
  148069.3460  0.0030 -6.1445 3  402.7557113  71510 30356 848      57 751        syn-C2H3C(O)NH2, v=0
  148069.7873  0.0030 -6.1445 3  402.7557113  71510 30356 948      57 651        syn-C2H3C(O)NH2, v=0
  148091.8068  0.0062 -6.5861 3  636.2359133  71510 303662046      671751        syn-C2H3C(O)NH2, v=0
  148101.4558  0.0637 -7.0898 3 1619.5003199  71510 303994257      984356        syn-C2H3C(O)NH2, v=0
  148101.4558  0.0637 -7.0898 3 1619.5003199  71510 303994258      984355        syn-C2H3C(O)NH2, v=0
  148121.7723  0.0091 -5.7193 3  924.1587153  71510 303763046      753145        syn-C2H3C(O)NH2, v=0
  148121.7723  0.0091 -5.7193 3  924.1587153  71510 303763047      753144        syn-C2H3C(O)NH2, v=0
  148171.4352  0.0038 -6.2810 3  233.2214 79  71510 303391426      401129        syn-C2H3C(O)NH2, v=0
  148190.5387  0.0026 -6.6507 3   65.6187 41  71510 30320 911      21 616        syn-C2H3C(O)NH2, v=0
  148198.5319  0.0200 -4.0871 3   52.8794 31 -71510 3031511 4      1510 5        syn-C2H3C(O)NH2, v=0
  148198.5319  0.0200 -4.0871 3   52.8794 31 -71510 3031511 5      1510 6        syn-C2H3C(O)NH2, v=0
  148250.9557  0.0030 -5.9852 3  280.3166 61  71510 3033027 3      3126 6        syn-C2H3C(O)NH2, v=0
  148250.9557  0.0030 -5.9852 3  280.3166 61  71510 3033027 4      3126 5        syn-C2H3C(O)NH2, v=0
  148279.8558  0.0030 -6.1089 3  278.5386 95  71510 30347 641      48 544        syn-C2H3C(O)NH2, v=0
  148280.3271  0.0030 -6.1089 3  278.5386 95  71510 30347 741      48 444        syn-C2H3C(O)NH2, v=0
  148350.5302  0.0105 -5.9757 3  658.2114103  71510 303513813      523716        syn-C2H3C(O)NH2, v=0
  148350.5302  0.0105 -5.9757 3  658.2114103  71510 303513814      523715        syn-C2H3C(O)NH2, v=0
  148350.7350  0.0200 -4.1658 3   49.2122 29 -71510 3031411 3      1410 4        syn-C2H3C(O)NH2, v=0
  148350.7350  0.0200 -4.1658 3   49.2122 29 -71510 3031411 4      1410 5        syn-C2H3C(O)NH2, v=0
  148358.3868  0.0515 -6.6992 3 1141.9492141  71510 303704822      714725        syn-C2H3C(O)NH2, v=0
  148358.3868  0.0515 -6.6992 3 1141.9492141  71510 303704823      714724        syn-C2H3C(O)NH2, v=0
  148419.0676  0.0200 -3.7824 3  275.0832 89 -71510 303441233      441134        syn-C2H3C(O)NH2, v=0
  148426.1538  0.0035 -5.6396 3   25.2187 29  71510 30314 410      14 113        syn-C2H3C(O)NH2, v=0
  148426.8671  0.0056 -6.3842 3  175.4799 71  71510 303351025      36 730        syn-C2H3C(O)NH2, v=0
  148438.2348  0.0028 -6.2104 3  314.8990 93  71510 303461531      471236        syn-C2H3C(O)NH2, v=0
  148441.4378  0.0200 -3.7215 3  175.5354 69 -71510 303341222      341123        syn-C2H3C(O)NH2, v=0
  148466.3196  0.0233 -6.8479 3  928.3213169  71510 303841470      851373        syn-C2H3C(O)NH2, v=0
  148466.4469  0.0233 -6.8479 3  928.3213169  71510 303841570      851273        syn-C2H3C(O)NH2, v=0
  148474.5735  0.0200 -4.2717 3   45.7928 27 -71510 3031311 2      1310 3        syn-C2H3C(O)NH2, v=0
  148474.5735  0.0200 -4.2717 3   45.7928 27 -71510 3031311 3      1310 4        syn-C2H3C(O)NH2, v=0
  148482.9057  0.0200 -3.4099 3   58.0963 49 -71510 30324 024      23 123        syn-C2H3C(O)NH2, v=0
  148482.9196  0.0010 -5.5977 3   58.0963 49  71510 30324 124      23 123        syn-C2H3C(O)NH2, v=0
  148482.9232  0.0010 -5.5977 3   58.0963 49  71510 30324 024      23 023        syn-C2H3C(O)NH2, v=0
  148482.9057  0.0200 -3.4099 3   58.0963 49 -71510 30324 124      23 023        syn-C2H3C(O)NH2, v=0
  148489.5864  0.0200 -3.4840 3   57.5759 47 -71510 30323 122      22 221        syn-C2H3C(O)NH2, v=0
  148490.0848  0.0010 -5.6221 3   57.5759 47  71510 30323 222      22 221        syn-C2H3C(O)NH2, v=0
  148490.5977  0.0010 -5.6221 3   57.5759 47  71510 30323 122      22 121        syn-C2H3C(O)NH2, v=0
  148491.0973  0.0200 -3.4840 3   57.5759 47 -71510 30323 222      22 121        syn-C2H3C(O)NH2, v=0
  148505.9644  0.0200 -3.7202 3  184.2799 71 -71510 303351224      351125        syn-C2H3C(O)NH2, v=0
  148513.6517  0.0024 -4.4007 3  175.4770 71  71510 303351025      341124        syn-C2H3C(O)NH2, v=0
  148529.0981  0.0200 -3.5761 3   56.5208 45 -71510 30322 220      21 319        syn-C2H3C(O)NH2, v=0
  148559.7400  0.0009 -5.6457 3   56.5208 45  71510 30322 320      21 319        syn-C2H3C(O)NH2, v=0
  148573.8099  0.0010 -4.4276 3   42.6206 25  71510 3031211 1      1210 2        syn-C2H3C(O)NH2, v=0
  148573.8099  0.0010 -4.4276 3   42.6206 25  71510 3031211 2      1210 3        syn-C2H3C(O)NH2, v=0
  148587.1452  0.0009 -5.6455 3   56.5188 45  71510 30322 220      21 219        syn-C2H3C(O)NH2, v=0
  148611.9609  0.0009 -5.6688 3   54.8972 43  71510 30321 418      20 417        syn-C2H3C(O)NH2, v=0
  148617.7587  0.0200 -3.5755 3   56.5188 45 -71510 30322 320      21 219        syn-C2H3C(O)NH2, v=0
  148652.1255  0.0010 -4.7069 3   39.6949 23  71510 3031111 0      1110 1        syn-C2H3C(O)NH2, v=0
  148652.1255  0.0010 -4.7069 3   39.6949 23  71510 3031111 1      1110 2        syn-C2H3C(O)NH2, v=0
  148667.2286  0.0200 -4.1169 3  533.5122123 -71510 303611744      611645        syn-C2H3C(O)NH2, v=0
  148673.4128  0.0025 -6.3008 3  130.5079 59  71510 303291118      30 823        syn-C2H3C(O)NH2, v=0
  148689.5600  0.0010 -5.7547 3   61.7105 41  71510 30320 813      19 812        syn-C2H3C(O)NH2, v=0
  148751.7043  0.0112 -5.8161 3  976.2704157  71510 303783147      773246        syn-C2H3C(O)NH2, v=0
  148751.7043  0.0112 -5.8161 3  976.2704157  71510 303783148      773245        syn-C2H3C(O)NH2, v=0
  148782.0001  0.0010 -5.7542 3   61.7130 41  71510 30320 812      19 811        syn-C2H3C(O)NH2, v=0
  148843.3938  0.0012 -4.4646 3  217.1739 79  71510 303391129      381226        syn-C2H3C(O)NH2, v=0
  148863.9038  0.0029 -6.1185 3  253.4390 57  71510 3032826 2      2925 5        syn-C2H3C(O)NH2, v=0
  148863.9038  0.0029 -6.1185 3  253.4390 57  71510 3032826 3      2925 4        syn-C2H3C(O)NH2, v=0
  148874.1387  0.0047 -6.4783 3  563.0470125  71510 303621943      631648        syn-C2H3C(O)NH2, v=0
  148918.6590  0.0040 -6.4343 3  116.3395 55  71510 303271117      28 820        syn-C2H3C(O)NH2, v=0
  148924.4475  0.0048 -6.4361 3  137.7246 69  71510 30334 331      35 234        syn-C2H3C(O)NH2, v=0
  148924.7071  0.0048 -6.4361 3  137.7246 69  71510 30334 431      35 134        syn-C2H3C(O)NH2, v=0
  148929.2333  0.0347 -7.1058 3  914.6950161  71510 303802258      811963        syn-C2H3C(O)NH2, v=0
  148937.0945  0.0014 -4.3157 3   18.2090 25  71510 30312 4 8      11 3 9        syn-C2H3C(O)NH2, v=0
  148943.7217  0.0024 -3.8536 3  321.3057 97  71510 303481137      481038        syn-C2H3C(O)NH2, v=0
  149035.7667  0.0010 -5.7006 3   48.8429 39  71510 30319 514      18 513        syn-C2H3C(O)NH2, v=0
  149067.3582  0.0087 -5.9286 3  615.9728 99  71510 303493712      503615        syn-C2H3C(O)NH2, v=0
  149067.3582  0.0087 -5.9286 3  615.9728 99  71510 303493713      503614        syn-C2H3C(O)NH2, v=0
  149110.1403  0.0059 -6.4033 3  638.9141141  71510 303701159      711062        syn-C2H3C(O)NH2, v=0
  149110.3901  0.0059 -6.4033 3  638.9141141  71510 303701259      71 962        syn-C2H3C(O)NH2, v=0
  149145.8673  0.0031 -6.2508 3  370.2386101  71510 303501634      511339        syn-C2H3C(O)NH2, v=0
  149146.1601  0.0018 -6.9611 3  184.2974 75  71510 30337 730      37 731        syn-C2H3C(O)NH2, v=0
  149146.6613  0.0449 -6.6031 3 1085.8677137  71510 303684721      694624        syn-C2H3C(O)NH2, v=0
  149146.6613  0.0449 -6.6031 3 1085.8677137  71510 303684722      694623        syn-C2H3C(O)NH2, v=0
  149190.1627  0.0021 -3.8145 3  280.9151 91  71510 303451035      45 936        syn-C2H3C(O)NH2, v=0
  149249.7209  0.0009 -6.1081 3    5.6406 15  71510 303 7 4 4       6 1 5        syn-C2H3C(O)NH2, v=0
  149257.1606  0.0009 -5.6647 3   54.8454 43  71510 30321 318      20 317        syn-C2H3C(O)NH2, v=0
  149266.8694  0.0039 -6.2975 3  189.7845 71  71510 303351323      361026        syn-C2H3C(O)NH2, v=0
  149329.6371  0.0040 -6.3859 3  494.3156117  71510 303581840      591545        syn-C2H3C(O)NH2, v=0
  149336.8676  0.0200 -4.4661 3  232.2503 81 -71510 303401228      391327        syn-C2H3C(O)NH2, v=0
  149340.1346  0.0018 -3.7764 3  184.2909 75  71510 30337 730      37 631        syn-C2H3C(O)NH2, v=0
  149389.5165  0.0021 -7.0576 3  101.8157 59  71510 30329 326      29 327        syn-C2H3C(O)NH2, v=0
  149389.7923  0.0021 -3.9751 3  101.8157 59  71510 30329 326      29 227        syn-C2H3C(O)NH2, v=0
  149396.6879  0.0021 -3.9751 3  101.8157 59  71510 30329 426      29 327        syn-C2H3C(O)NH2, v=0
  149396.7108  0.0136 -5.9159 3 1029.8148161  71510 303803248      793347        syn-C2H3C(O)NH2, v=0
  149396.7108  0.0136 -5.9159 3 1029.8148161  71510 303803249      793346        syn-C2H3C(O)NH2, v=0
  149396.9637  0.0021 -7.0576 3  101.8157 59  71510 30329 426      29 227        syn-C2H3C(O)NH2, v=0
  149401.9903  0.0200 -3.7658 3  232.9225 83 -71510 303411032      41 933        syn-C2H3C(O)NH2, v=0
  149429.1468  0.0865 -7.0606 3 1331.5329197  71510 303982276      972573        syn-C2H3C(O)NH2, v=0
  149430.7653  0.0035 -6.3097 3  430.0451109  71510 303541737      551442        syn-C2H3C(O)NH2, v=0
  149463.7026  0.0029 -6.3320 3  228.0054 53  71510 3032625 1      2724 4        syn-C2H3C(O)NH2, v=0
  149463.7026  0.0029 -6.3320 3  228.0054 53  71510 3032625 2      2724 3        syn-C2H3C(O)NH2, v=0
  149473.4260  0.0052 -5.0971 3  359.5256103  71510 303511240      501337        syn-C2H3C(O)NH2, v=0
  149500.0295  0.0010 -5.7241 3   58.3110 41  71510 30320 714      19 713        syn-C2H3C(O)NH2, v=0
  149544.1105  0.0040 -6.3463 3  150.8236 63  71510 303311220      32 923        syn-C2H3C(O)NH2, v=0
  149555.4649  0.0009 -5.7029 3   55.3967 41  71510 30320 615      19 614        syn-C2H3C(O)NH2, v=0
  149632.3204  0.0200 -3.7737 3  259.0377 87 -71510 303431133      431034        syn-C2H3C(O)NH2, v=0
  149775.4473  0.0073 -5.8886 3  575.1718 95  71510 303473611      483514        syn-C2H3C(O)NH2, v=0
  149775.4473  0.0073 -5.8886 3  575.1718 95  71510 303473612      483513        syn-C2H3C(O)NH2, v=0
  149879.8577  0.0063 -6.4397 3  466.3959115  71510 303571641      581346        syn-C2H3C(O)NH2, v=0
  149927.5999  0.0391 -6.5114 3 1031.2148133  71510 303664620      674523        syn-C2H3C(O)NH2, v=0
  149927.5999  0.0391 -6.5114 3 1031.2148133  71510 303664621      674522        syn-C2H3C(O)NH2, v=0
  150000.4372  0.0200 -3.7129 3  175.4770 69 -71510 303341223      341124        syn-C2H3C(O)NH2, v=0
  150049.6520  0.0028 -6.7224 3  204.0162 49  71510 3032424 0      2523 3        syn-C2H3C(O)NH2, v=0
  150049.6520  0.0028 -6.7224 3  204.0162 49  71510 3032424 1      2523 2        syn-C2H3C(O)NH2, v=0
  150055.5152  0.0165 -6.0188 3 1084.7910165  71510 303823349      813448        syn-C2H3C(O)NH2, v=0
  150055.5152  0.0165 -6.0188 3 1084.7910165  71510 303823350      813447        syn-C2H3C(O)NH2, v=0
  150129.1394  0.0015 -3.7620 3  208.0067 79  71510 30339 931      39 832        syn-C2H3C(O)NH2, v=0
  150148.6568  0.0052 -6.8114 3  103.3776 61  71510 30330 228      31 131        syn-C2H3C(O)NH2, v=0
  150148.7940  0.0052 -6.8114 3  103.3776 61  71510 30330 328      31 031        syn-C2H3C(O)NH2, v=0
  150150.0929  0.0025 -7.0589 3   39.4296 31  71510 30315 8 7      16 512        syn-C2H3C(O)NH2, v=0
  150165.3551  0.0200 -3.6948 3   54.8454 43 -71510 30321 418      20 317        syn-C2H3C(O)NH2, v=0
  150222.6335  0.0369 -7.0358 3 1043.5827179  71510 303891574      901477        syn-C2H3C(O)NH2, v=0
  150222.7159  0.0369 -7.0358 3 1043.5827179  71510 303891674      901377        syn-C2H3C(O)NH2, v=0
  150265.3471  0.0028 -5.1955 3   34.7408 33  71510 30316 511      16 214        syn-C2H3C(O)NH2, v=0
  150413.2039  0.0010 -5.7188 3   58.3434 41  71510 30320 713      19 712        syn-C2H3C(O)NH2, v=0
  150458.0792  0.0200 -3.8579 3   15.3253 17 -71510 303 8 7 2       7 6 1        syn-C2H3C(O)NH2, v=0
  150458.0792  0.0200 -3.8579 3   15.3253 17 -71510 303 8 7 1       7 6 2        syn-C2H3C(O)NH2, v=0
  150462.7786  0.0037 -6.3338 3   16.9543 25  71510 30312 3 9      12 012        syn-C2H3C(O)NH2, v=0
  150474.5316  0.0061 -5.8566 3  535.8091 91  71510 303453510      463413        syn-C2H3C(O)NH2, v=0
  150474.5316  0.0061 -5.8566 3  535.8091 91  71510 303453511      463412        syn-C2H3C(O)NH2, v=0
  150576.3307  0.0200 -3.7119 3  166.9741 67 -71510 303331221      331122        syn-C2H3C(O)NH2, v=0
  150661.2520  0.0037 -4.1034 3  524.3061123  71510 303611546      611447        syn-C2H3C(O)NH2, v=0
  150701.0976  0.0338 -6.4243 3  977.9917129  71510 303644519      654422        syn-C2H3C(O)NH2, v=0
  150701.0976  0.0338 -6.4243 3  977.9917129  71510 303644520      654421        syn-C2H3C(O)NH2, v=0
  150709.5914  0.0020 -6.9870 3  120.5514 63  71510 30331 427      31 428        syn-C2H3C(O)NH2, v=0
  150711.5296  0.0020 -3.8820 3  120.5513 63  71510 30331 427      31 328        syn-C2H3C(O)NH2, v=0
  150727.0285  0.0198 -6.1248 3 1141.1978169  71510 303843450      833549        syn-C2H3C(O)NH2, v=0
  150727.0285  0.0198 -6.1248 3 1141.1978169  71510 303843451      833548        syn-C2H3C(O)NH2, v=0
  150735.8065  0.0200 -3.9296 3   16.9014 21 -71510 30310 6 5       9 5 4        syn-C2H3C(O)NH2, v=0
  150746.3149  0.0024 -3.9918 3  451.6916113  71510 303561640      561541        syn-C2H3C(O)NH2, v=0
  150746.4667  0.0020 -3.8818 3  120.5514 63  71510 30331 527      31 428        syn-C2H3C(O)NH2, v=0
  150748.4049  0.0020 -6.9868 3  120.5513 63  71510 30331 527      31 328        syn-C2H3C(O)NH2, v=0
  150783.1784  0.0200 -3.9294 3   16.9000 21 -71510 30310 6 4       9 5 5        syn-C2H3C(O)NH2, v=0
  150802.9189  0.0015 -6.9761 3  207.9842 79  71510 30339 931      39 732        syn-C2H3C(O)NH2, v=0
  150808.1805  0.0036 -6.2078 3  480.2521123  71510 30361 952      62 855        syn-C2H3C(O)NH2, v=0
  150808.4831  0.0036 -6.2078 3  480.2521123  71510 303611052      62 755        syn-C2H3C(O)NH2, v=0
  150958.3397  0.0018 -6.9439 3  161.8079 71  71510 30335 629      35 630        syn-C2H3C(O)NH2, v=0
  151007.4254  0.0018 -3.7887 3  161.8062 71  71510 30335 629      35 530        syn-C2H3C(O)NH2, v=0
  151012.6406  0.0016 -3.7672 3  184.2974 75  71510 30337 830      37 731        syn-C2H3C(O)NH2, v=0
  151017.1163  0.0036 -6.1484 3  229.6079 87  71510 30343 538      44 441        syn-C2H3C(O)NH2, v=0
  151017.4495  0.0036 -6.1484 3  229.6079 87  71510 30343 638      44 341        syn-C2H3C(O)NH2, v=0
  151076.3781  0.0023 -4.3804 3   73.5612 53  71510 30326 125      26 026        syn-C2H3C(O)NH2, v=0
  151076.4345  0.0023 -4.3804 3   73.5612 53  71510 30326 225      26 126        syn-C2H3C(O)NH2, v=0
  151102.5768  0.0200 -3.8102 3  308.7985 93 -71510 303461432      461333        syn-C2H3C(O)NH2, v=0
  151164.3186  0.0051 -5.8335 3  497.8855 87  71510 3034334 9      443312        syn-C2H3C(O)NH2, v=0
  151164.3186  0.0051 -5.8335 3  497.8855 87  71510 303433410      443311        syn-C2H3C(O)NH2, v=0
  151206.6152  0.0016 -6.9502 3  184.2909 75  71510 30337 830      37 631        syn-C2H3C(O)NH2, v=0
  151213.4026  0.0028 -4.1425 3   85.8130 51  71510 30325 619      24 718        syn-C2H3C(O)NH2, v=0
  151299.4183  0.0093 -6.5353 3  735.3222151  71510 303751263      761166        syn-C2H3C(O)NH2, v=0
  151299.5834  0.0093 -6.5353 3  735.3222151  71510 303751363      761066        syn-C2H3C(O)NH2, v=0
  151311.2222  0.0019 -6.9519 3  140.5539 67  71510 30333 528      33 529        syn-C2H3C(O)NH2, v=0
  151321.9160  0.0019 -3.8229 3  140.5536 67  71510 30333 528      33 429        syn-C2H3C(O)NH2, v=0
  151410.3184  0.0236 -6.2339 3 1199.0341173  71510 303863551      853650        syn-C2H3C(O)NH2, v=0
  151410.3184  0.0236 -6.2339 3 1199.0341173  71510 303863552      853649        syn-C2H3C(O)NH2, v=0
  151433.7485  0.0052 -6.3195 3  303.7472 93  71510 303461333      471038        syn-C2H3C(O)NH2, v=0
  151447.9608  0.0200 -3.7072 3  166.9418 67 -71510 303331222      331123        syn-C2H3C(O)NH2, v=0
  151453.1854  0.0091 -6.6702 3  644.6077133  71510 303662146      671849        syn-C2H3C(O)NH2, v=0
  151467.0382  0.0291 -6.3419 3  926.1993125  71510 303624418      634321        syn-C2H3C(O)NH2, v=0
  151467.0382  0.0291 -6.3419 3  926.1993125  71510 303624419      634320        syn-C2H3C(O)NH2, v=0
  151468.9838  0.0019 -3.8221 3  140.5539 67  71510 30333 628      33 529        syn-C2H3C(O)NH2, v=0
  151479.6776  0.0018 -6.9510 3  140.5536 67  71510 30333 628      33 429        syn-C2H3C(O)NH2, v=0
  151482.6666  0.0013 -7.0144 3  232.8531 83  71510 303411032      41 833        syn-C2H3C(O)NH2, v=0
  151522.6311  0.0028 -6.1101 3  343.8010105  71510 30352 745      53 648        syn-C2H3C(O)NH2, v=0
  151522.9696  0.0028 -6.1101 3  343.8010105  71510 30352 845      53 548        syn-C2H3C(O)NH2, v=0
  151538.4292  0.0017 -3.7858 3  161.8079 71  71510 30335 729      35 630        syn-C2H3C(O)NH2, v=0
  151587.5149  0.0017 -6.9405 3  161.8062 71  71510 30335 729      35 530        syn-C2H3C(O)NH2, v=0
  151753.6989  0.0200 -3.7813 3  286.3565 91 -71510 303451234      451135        syn-C2H3C(O)NH2, v=0
  151804.4286  0.0247 -7.0858 3  952.3812163  71510 303812457      822162        syn-C2H3C(O)NH2, v=0
  151844.4867  0.0044 -5.8205 3  461.4016 83  71510 3034133 8      423211        syn-C2H3C(O)NH2, v=0
  151844.4867  0.0044 -5.8205 3  461.4016 83  71510 3034133 9      423210        syn-C2H3C(O)NH2, v=0
  151860.6802  0.0200 -4.4663 3  242.3208 83 -71510 303411230      401327        syn-C2H3C(O)NH2, v=0
  151866.8986  0.0025 -6.2286 3  166.9310 67  71510 303331221      34 926        syn-C2H3C(O)NH2, v=0
  151891.3027  0.0019 -3.8875 3  376.7851103  71510 303511536      511437        syn-C2H3C(O)NH2, v=0
  151926.9277  0.0014 -5.4803 3    8.0519 19  71510 303 9 3 7       8 0 8        syn-C2H3C(O)NH2, v=0
  152000.2420  0.0036 -4.5558 3  820.1366153  71510 303762056      761957        syn-C2H3C(O)NH2, v=0
  152068.9820  0.0070 -4.4833 3  775.2569149  71510 303741955      741856        syn-C2H3C(O)NH2, v=0
  152080.9110  0.0031 -4.2949 3  126.6813 61  71510 30330 822      29 921        syn-C2H3C(O)NH2, v=0
  152083.8251  0.0009 -5.6657 3   52.2378 41  71510 30320 416      19 415        syn-C2H3C(O)NH2, v=0
  152104.5835  0.0279 -6.3460 3 1258.2988177  71510 303883652      873751        syn-C2H3C(O)NH2, v=0
  152104.5835  0.0279 -6.3460 3 1258.2988177  71510 303883653      873750        syn-C2H3C(O)NH2, v=0
  152150.2245  0.0022 -5.3586 3    9.9816 21  71510 30310 2 8       9 1 9        syn-C2H3C(O)NH2, v=0
  152176.3987  0.0014 -4.7522 3  423.8659107  71510 303531836      521933        syn-C2H3C(O)NH2, v=0
  152217.3092  0.0014 -4.7520 3  423.8659107  71510 303531835      521934        syn-C2H3C(O)NH2, v=0
  152225.2929  0.0250 -6.2644 3  875.8386121  71510 303604317      614220        syn-C2H3C(O)NH2, v=0
  152225.2929  0.0250 -6.2644 3  875.8386121  71510 303604318      614219        syn-C2H3C(O)NH2, v=0
  152228.2918  0.0200 -4.8147 3  459.1948111 -71510 303551937      542034        syn-C2H3C(O)NH2, v=0
  152235.3629  0.0200 -4.6927 3  389.9827103 -71510 303511735      501832        syn-C2H3C(O)NH2, v=0
  152241.1615  0.0020 -3.9965 3   71.0912 47  71510 30323 518      22 617        syn-C2H3C(O)NH2, v=0
  152242.7308  0.0200 -4.8146 3  459.1948111 -71510 303551936      542035        syn-C2H3C(O)NH2, v=0
  152335.3503  0.0200 -4.0340 3   19.9832 25 -71510 30312 5 7      11 4 8        syn-C2H3C(O)NH2, v=0
  152338.8983  0.0200 -3.7057 3  158.6912 65 -71510 303321220      321121        syn-C2H3C(O)NH2, v=0
  152348.4571  0.0200 -4.6921 3  389.9826103 -71510 303511734      501833        syn-C2H3C(O)NH2, v=0
  152369.6024  0.0008 -4.0303 3   23.1770 27  71510 30313 5 9      12 4 8        syn-C2H3C(O)NH2, v=0
  152376.5724  0.0200 -4.8800 3  495.9681115 -71510 303572038      562135        syn-C2H3C(O)NH2, v=0
  152381.6392  0.0200 -4.8800 3  495.9681115 -71510 303572037      562136        syn-C2H3C(O)NH2, v=0
  152409.7448  0.0200 -4.6363 3  357.5466 99 -71510 303491634      481731        syn-C2H3C(O)NH2, v=0
  152514.6829  0.0039 -5.8194 3  426.3581 79  71510 3033932 7      403110        syn-C2H3C(O)NH2, v=0
  152514.6829  0.0039 -5.8194 3  426.3581 79  71510 3033932 8      4031 9        syn-C2H3C(O)NH2, v=0
  152528.9962  0.0013 -7.0720 3    7.6449 15  71510 303 7 5 3       7 2 6        syn-C2H3C(O)NH2, v=0
  152569.4622  0.0200 -3.7348 3  237.2316 81 -71510 303401327      401228        syn-C2H3C(O)NH2, v=0
  152606.0313  0.0200 -4.9482 3  534.1848119 -71510 303592139      582236        syn-C2H3C(O)NH2, v=0
  152607.7579  0.0017 -4.9482 3  534.1848119  71510 303592138      582237        syn-C2H3C(O)NH2, v=0
  152671.8777  0.0200 -4.5833 3  326.5592 95 -71510 303471533      461630        syn-C2H3C(O)NH2, v=0
  152679.2180  0.0073 -6.5197 3  533.3784123  71510 303611744      621449        syn-C2H3C(O)NH2, v=0
  152714.6364  0.0200 -4.6345 3  357.5461 99 -71510 303491633      481732        syn-C2H3C(O)NH2, v=0
  152757.2683  0.0853 -7.0674 3 1361.3215155  71510 303775225      785128        syn-C2H3C(O)NH2, v=0
  152757.2683  0.0853 -7.0674 3 1361.3215155  71510 303775226      785127        syn-C2H3C(O)NH2, v=0
  152809.1328  0.0328 -6.4612 3 1318.9908181  71510 303903753      893852        syn-C2H3C(O)NH2, v=0
  152809.1328  0.0328 -6.4612 3 1318.9908181  71510 303903754      893851        syn-C2H3C(O)NH2, v=0
  152810.5686  0.0200 -3.7031 3  158.6739 65 -71510 303321221      321122        syn-C2H3C(O)NH2, v=0
  152844.8788  0.0200 -4.4940 3  268.9411 87 -71510 303431331      421428        syn-C2H3C(O)NH2, v=0
  152903.2647  0.0018 -5.0194 3  573.8439123  71510 303612240      602337        syn-C2H3C(O)NH2, v=0
  152903.8454  0.0200 -5.0194 3  573.8439123 -71510 303612239      602338        syn-C2H3C(O)NH2, v=0
  152912.1180  0.0200 -4.5350 3  297.0228 91 -71510 303451432      441529        syn-C2H3C(O)NH2, v=0
  152975.7198  0.0213 -6.1920 3  826.9106117  71510 303584216      594119        syn-C2H3C(O)NH2, v=0
  152975.7198  0.0213 -6.1920 3  826.9106117  71510 303584217      594118        syn-C2H3C(O)NH2, v=0
  152993.4049  0.0088 -5.5858 3  583.3314131  71510 303651551      641648        syn-C2H3C(O)NH2, v=0
  153005.4811  0.0064 -4.3797 3  712.6769143  71510 303711853      711754        syn-C2H3C(O)NH2, v=0
  153029.7679  0.0494 -6.8702 3 1233.9538189  71510 303942272      932569        syn-C2H3C(O)NH2, v=0
  153174.5201  0.0036 -5.8325 3  392.7557 75  71510 3033731 6      3830 9        syn-C2H3C(O)NH2, v=0
  153174.5201  0.0036 -5.8325 3  392.7557 75  71510 3033731 7      3830 8        syn-C2H3C(O)NH2, v=0
  153236.1277  0.0011 -6.8381 3  145.5834 43  71510 3032120 1      2020 0        syn-C2H3C(O)NH2, v=0
  153236.1277  0.0011 -6.8381 3  145.5834 43  71510 3032120 2      2020 1        syn-C2H3C(O)NH2, v=0
  153257.2984  0.0021 -5.0936 3  614.9444127  71510 303632341      622438        syn-C2H3C(O)NH2, v=0
  153257.4909  0.0021 -5.0936 3  614.9444127  71510 303632340      622439        syn-C2H3C(O)NH2, v=0
  153260.8841  0.0018 -6.9686 3  217.6430 81  71510 30340 832      40 833        syn-C2H3C(O)NH2, v=0
  153291.2716  0.0042 -6.2449 3  185.1939 79  71510 30339 435      40 338        syn-C2H3C(O)NH2, v=0
  153291.4913  0.0042 -6.2449 3  185.1939 79  71510 30339 535      40 238        syn-C2H3C(O)NH2, v=0
  153306.0721  0.0011 -6.5282 3  136.3779 43  71510 3032119 2      2019 1        syn-C2H3C(O)NH2, v=0
  153306.0721  0.0011 -6.5282 3  136.3779 43  71510 3032119 3      2019 2        syn-C2H3C(O)NH2, v=0
  153348.6167  0.0156 -6.6877 3  838.4246161  71510 303801367      811270        syn-C2H3C(O)NH2, v=0
  153348.7249  0.0156 -6.6877 3  838.4246161  71510 303801467      811170        syn-C2H3C(O)NH2, v=0
  153362.5017  0.0045 -6.2971 3  564.4622133  71510 303661056      67 959        syn-C2H3C(O)NH2, v=0
  153362.7062  0.0045 -6.2971 3  564.4622133  71510 303661156      67 859        syn-C2H3C(O)NH2, v=0
  153386.4228  0.0011 -6.3445 3  127.6463 43  71510 3032118 3      2018 2        syn-C2H3C(O)NH2, v=0
  153386.4228  0.0011 -6.3445 3  127.6463 43  71510 3032118 4      2018 3        syn-C2H3C(O)NH2, v=0
  153469.2914  0.0200 -4.5786 3  326.5577 95 -71510 303471532      461631        syn-C2H3C(O)NH2, v=0
  153479.8331  0.0011 -6.2131 3  119.3889 43  71510 3032117 4      2017 3        syn-C2H3C(O)NH2, v=0
  153479.8331  0.0011 -6.2131 3  119.3889 43  71510 3032117 5      2017 4        syn-C2H3C(O)NH2, v=0
  153501.4819  0.0027 -6.4598 3   92.0671 49  71510 303241014      25 719        syn-C2H3C(O)NH2, v=0
  153523.3686  0.0383 -6.5794 3 1381.1090185  71510 303923854      913953        syn-C2H3C(O)NH2, v=0
  153523.3686  0.0383 -6.5794 3 1381.1090185  71510 303923855      913952        syn-C2H3C(O)NH2, v=0
  153561.6466  0.0022 -4.1022 3   90.3251 57  71510 30328 226      28 127        syn-C2H3C(O)NH2, v=0
  153562.1847  0.0022 -4.1022 3   90.3251 57  71510 30328 326      28 227        syn-C2H3C(O)NH2, v=0
  153568.8505  0.0756 -6.9572 3 1300.0201151  71510 303755124      765027        syn-C2H3C(O)NH2, v=0
  153568.8505  0.0756 -6.9572 3 1300.0201151  71510 303755125      765026        syn-C2H3C(O)NH2, v=0
  153589.8358  0.0010 -6.1109 3  111.6066 43  71510 3032116 5      2016 4        syn-C2H3C(O)NH2, v=0
  153589.8358  0.0010 -6.1109 3  111.6066 43  71510 3032116 6      2016 5        syn-C2H3C(O)NH2, v=0
  153597.0277  0.0036 -4.3518 3  699.0489141  71510 303701951      701852        syn-C2H3C(O)NH2, v=0
  153657.3142  0.0018 -3.7615 3  217.6297 81  71510 30340 832      40 733        syn-C2H3C(O)NH2, v=0
  153659.3852  0.0200 -5.1707 3  657.4853131 -71510 303652442      642539        syn-C2H3C(O)NH2, v=0
  153659.3852  0.0200 -5.1707 3  657.4853131 -71510 303652441      642540        syn-C2H3C(O)NH2, v=0
  153706.0706  0.0171 -6.9268 3  862.4277155  71510 303772354      782059        syn-C2H3C(O)NH2, v=0
  153718.1620  0.0180 -6.1250 3  779.4161113  71510 303564115      574018        syn-C2H3C(O)NH2, v=0
  153718.1620  0.0180 -6.1250 3  779.4161113  71510 303564116      574017        syn-C2H3C(O)NH2, v=0
  153721.2251  0.0010 -6.0277 3  104.3000 43  71510 3032115 6      2015 5        syn-C2H3C(O)NH2, v=0
  153721.2251  0.0010 -6.0277 3  104.3000 43  71510 3032115 7      2015 6        syn-C2H3C(O)NH2, v=0
  153747.6841  0.0200 -3.7588 3  280.0339 89 -71510 303441332      441233        syn-C2H3C(O)NH2, v=0
  153791.4382  0.0065 -4.5836 3  840.3527155  71510 303772057      771958        syn-C2H3C(O)NH2, v=0
  153820.2963  0.0200 -3.7023 3  150.6817 63 -71510 303311219      311120        syn-C2H3C(O)NH2, v=0
  153823.5742  0.0034 -5.8633 3  360.5948 71  71510 3033530 5      3629 8        syn-C2H3C(O)NH2, v=0
  153823.5742  0.0034 -5.8633 3  360.5948 71  71510 3033530 6      3629 7        syn-C2H3C(O)NH2, v=0
  153880.6540  0.0010 -5.9579 3   97.4702 43  71510 3032114 7      2014 6        syn-C2H3C(O)NH2, v=0
  153880.6540  0.0010 -5.9579 3   97.4702 43  71510 3032114 8      2014 7        syn-C2H3C(O)NH2, v=0
  153911.3365  0.0009 -5.6500 3   57.6990 43  71510 30321 517      20 516        syn-C2H3C(O)NH2, v=0
  153922.0844  0.0200 -3.7695 3  291.4185 91 -71510 303451333      451234        syn-C2H3C(O)NH2, v=0
  154067.3556  0.0200 -3.7010 3  150.6727 63 -71510 303311220      311121        syn-C2H3C(O)NH2, v=0
  154077.6037  0.0010 -5.8981 3   91.1188 43  71510 3032113 8      2013 7        syn-C2H3C(O)NH2, v=0
  154077.6037  0.0010 -5.8981 3   91.1188 43  71510 3032113 9      2013 8        syn-C2H3C(O)NH2, v=0
  154102.3842  0.0032 -5.2509 3  701.4657135  71510 303672543      662640        syn-C2H3C(O)NH2, v=0
  154102.4047  0.0032 -5.2509 3  701.4657135  71510 303672542      662641        syn-C2H3C(O)NH2, v=0
  154145.9928  0.0739 -6.9805 3 1306.7703195  71510 303972275      962572        syn-C2H3C(O)NH2, v=0
  154191.5187  0.0200 -3.7466 3  268.8962 87 -71510 303431331      431232        syn-C2H3C(O)NH2, v=0
  154203.9318  0.0200 -3.6434 3   59.8544 45 -71510 30322 319      21 418        syn-C2H3C(O)NH2, v=0
  154223.9844  0.0040 -4.5140 3  800.1169151  71510 303752055      751956        syn-C2H3C(O)NH2, v=0
  154246.7731  0.0444 -6.7007 3 1444.6520189  71510 303943955      934054        syn-C2H3C(O)NH2, v=0
  154246.7731  0.0444 -6.7007 3 1444.6520189  71510 303943956      934053        syn-C2H3C(O)NH2, v=0
  154269.8750  0.0035 -4.0171 3  472.7366117  71510 303581444      581345        syn-C2H3C(O)NH2, v=0
  154325.4663  0.0012 -5.6742 3   55.6569 41  71510 30320 614      19 613        syn-C2H3C(O)NH2, v=0
  154326.0353  0.0010 -5.8463 3   85.2480 43  71510 303211210      2012 9        syn-C2H3C(O)NH2, v=0
  154326.0363  0.0010 -5.8463 3   85.2480 43  71510 3032112 9      2012 8        syn-C2H3C(O)NH2, v=0
  154372.2950  0.0025 -6.1891 3  207.8290 75  71510 303371324      381029        syn-C2H3C(O)NH2, v=0
  154373.2474  0.0668 -6.8511 3 1240.1432147  71510 303735023      744926        syn-C2H3C(O)NH2, v=0
  154373.2474  0.0668 -6.8511 3 1240.1432147  71510 303735024      744925        syn-C2H3C(O)NH2, v=0
  154452.4467  0.0152 -6.0637 3  733.3561109  71510 303544014      553917        syn-C2H3C(O)NH2, v=0
  154452.4467  0.0152 -6.0637 3  733.3561109  71510 303544015      553916        syn-C2H3C(O)NH2, v=0
  154461.3818  0.0032 -5.9170 3  329.8761 67  71510 3033329 4      3428 7        syn-C2H3C(O)NH2, v=0
  154461.3818  0.0032 -5.9170 3  329.8761 67  71510 3033329 5      3428 6        syn-C2H3C(O)NH2, v=0
  154475.9463  0.0069 -6.8000 3   87.6822 51  71510 30325 718      26 423        syn-C2H3C(O)NH2, v=0
  154525.4923  0.0031 -6.1462 3  415.7892115  71510 30357 849      58 752        syn-C2H3C(O)NH2, v=0
  154525.7298  0.0031 -6.1461 3  415.7892115  71510 30357 949      58 652        syn-C2H3C(O)NH2, v=0
  154541.7070  0.0200 -3.3669 3   63.0492 51 -71510 30325 025      24 124        syn-C2H3C(O)NH2, v=0
  154541.7156  0.0010 -5.5556 3   63.0492 51  71510 30325 125      24 124        syn-C2H3C(O)NH2, v=0
  154541.7173  0.0010 -5.5556 3   63.0492 51  71510 30325 025      24 024        syn-C2H3C(O)NH2, v=0
  154541.7070  0.0200 -3.3669 3   63.0492 51 -71510 30325 125      24 024        syn-C2H3C(O)NH2, v=0
  154546.7438  0.0200 -3.4375 3   62.5290 49 -71510 30324 123      23 222        syn-C2H3C(O)NH2, v=0
  154547.0025  0.0010 -5.5790 3   62.5290 49  71510 30324 223      23 222        syn-C2H3C(O)NH2, v=0
  154547.2561  0.0010 -5.5790 3   62.5290 49  71510 30324 123      23 122        syn-C2H3C(O)NH2, v=0
  154547.5136  0.0200 -3.4375 3   62.5290 49 -71510 30324 223      23 122        syn-C2H3C(O)NH2, v=0
  154566.0670  0.0012 -5.1322 3   36.8275 33  71510 30316 610      16 313        syn-C2H3C(O)NH2, v=0
  154580.7473  0.0040 -5.3341 3  746.8847139  71510 303692644      682741        syn-C2H3C(O)NH2, v=0
  154580.7539  0.0040 -5.3341 3  746.8847139  71510 303692643      682742        syn-C2H3C(O)NH2, v=0
  154595.0691  0.0200 -3.5239 3   61.4762 47 -71510 30323 221      22 320        syn-C2H3C(O)NH2, v=0
  154597.8445  0.0030 -6.1080 3  289.3501 97  71510 30348 642      49 545        syn-C2H3C(O)NH2, v=0
  154598.0935  0.0030 -6.1080 3  289.3501 97  71510 30348 742      49 445        syn-C2H3C(O)NH2, v=0
  154611.0624  0.0009 -5.6016 3   61.4762 47  71510 30323 321      22 320        syn-C2H3C(O)NH2, v=0
  154625.6908  0.0009 -5.6015 3   61.4752 47  71510 30323 221      22 220        syn-C2H3C(O)NH2, v=0
  154641.6930  0.0200 -3.5236 3   61.4752 47 -71510 30323 321      22 220        syn-C2H3C(O)NH2, v=0
  154647.3676  0.0010 -5.8009 3   79.8609 43  71510 303211111      201110        syn-C2H3C(O)NH2, v=0
  154647.3998  0.0010 -5.8009 3   79.8609 43  71510 303211110      2011 9        syn-C2H3C(O)NH2, v=0
  154724.1052  0.0009 -5.6232 3   59.8544 45  71510 30322 419      21 418        syn-C2H3C(O)NH2, v=0
  154826.3486  0.0200 -3.7783 3  303.0426 93 -71510 303461334      461235        syn-C2H3C(O)NH2, v=0
  154833.7272  0.0022 -6.5560 3   12.1035 21  71510 30310 4 7      10 110        syn-C2H3C(O)NH2, v=0
  154921.2412  0.0200 -4.5230 3  297.0187 91 -71510 303451431      441530        syn-C2H3C(O)NH2, v=0
  154949.4402  0.0056 -6.3493 3  217.6430 79  71510 303391128      40 833        syn-C2H3C(O)NH2, v=0
  154978.3332  0.0014 -6.7505 3    9.5218 17  71510 303 8 5 4       8 2 7        syn-C2H3C(O)NH2, v=0
  154978.8965  0.0513 -6.8250 3 1509.6188193  71510 303964056      954155        syn-C2H3C(O)NH2, v=0
  154978.8965  0.0513 -6.8250 3 1509.6188193  71510 303964057      954154        syn-C2H3C(O)NH2, v=0
  154990.8691  0.0200 -3.7645 3  269.9133 89 -71510 303441134      441035        syn-C2H3C(O)NH2, v=0
  155049.2536  0.0048 -6.4319 3  145.3040 71  71510 30335 332      36 235        syn-C2H3C(O)NH2, v=0
  155049.3850  0.0048 -6.4319 3  145.3040 71  71510 30335 432      36 135        syn-C2H3C(O)NH2, v=0
  155076.0600  0.0010 -5.7607 3   74.9627 43  71510 303211012      201011        syn-C2H3C(O)NH2, v=0
  155076.8526  0.0010 -5.7607 3   74.9627 43  71510 303211011      201010        syn-C2H3C(O)NH2, v=0
  155084.6214  0.0200 -3.7015 3  142.9413 61 -71510 303301218      301119        syn-C2H3C(O)NH2, v=0
  155087.4375  0.0032 -6.0023 3  300.6000 63  71510 3033128 3      3227 6        syn-C2H3C(O)NH2, v=0
  155087.4375  0.0032 -6.0023 3  300.6000 63  71510 3033128 4      3227 5        syn-C2H3C(O)NH2, v=0
  155089.8525  0.0051 -5.4203 3  793.7411143  71510 303712745      702842        syn-C2H3C(O)NH2, v=0
  155089.8546  0.0051 -5.4203 3  793.7411143  71510 303712744      702843        syn-C2H3C(O)NH2, v=0
  155112.1404  0.0009 -5.6208 3   59.8241 45  71510 30322 319      21 318        syn-C2H3C(O)NH2, v=0
  155123.5113  0.0200 -3.7336 3  258.0118 85 -71510 303421330      421231        syn-C2H3C(O)NH2, v=0
  155170.3837  0.0588 -6.7492 3 1181.6920143  71510 303714922      724825        syn-C2H3C(O)NH2, v=0
  155170.3837  0.0588 -6.7492 3 1181.6920143  71510 303714923      724824        syn-C2H3C(O)NH2, v=0
  155178.3840  0.0128 -6.0086 3  688.7315105  71510 303523913      533816        syn-C2H3C(O)NH2, v=0
  155178.3840  0.0128 -6.0086 3  688.7315105  71510 303523914      533815        syn-C2H3C(O)NH2, v=0
  155209.8224  0.0200 -3.7009 3  142.9368 61 -71510 303301219      301120        syn-C2H3C(O)NH2, v=0
  155213.9809  0.0189 -5.9214 3  755.9176149  71510 303741758      731855        syn-C2H3C(O)NH2, v=0
  155265.4245  0.0255 -6.8594 3  948.2140171  71510 303851471      861374        syn-C2H3C(O)NH2, v=0
  155265.4952  0.0255 -6.8594 3  948.2140171  71510 303851571      861274        syn-C2H3C(O)NH2, v=0
  155271.7028  0.0200 -3.7906 3   62.8329 45 -71510 30322 418      21 517        syn-C2H3C(O)NH2, v=0
  155278.4432  0.0090 -6.6142 3  604.8250131  71510 303651847      661552        syn-C2H3C(O)NH2, v=0
  155344.0305  0.0116 -6.7813 3  776.9164147  71510 303732251      741956        syn-C2H3C(O)NH2, v=0
  155358.9852  0.0010 -7.0609 3  258.8467 87  71510 303431133      43 934        syn-C2H3C(O)NH2, v=0
  155383.8327  0.0031 -4.1970 3  604.8214131  71510 303651847      651748        syn-C2H3C(O)NH2, v=0
  155432.7382  0.1042 -6.7285 3 1167.4457185  71510 303922172      912269        syn-C2H3C(O)NH2, v=0
  155443.7435  0.0021 -4.3968 3  207.5429 77  71510 303381127      371226        syn-C2H3C(O)NH2, v=0
  155481.3317  0.0486 -6.3042 3  950.6562167  71510 303831965      822062        syn-C2H3C(O)NH2, v=0
  155533.6095  0.0200 -3.7522 3  243.1793 85 -71510 303421033      42 934        syn-C2H3C(O)NH2, v=0
  155541.5361  0.0021 -7.0337 3  108.3860 61  71510 30330 327      30 328        syn-C2H3C(O)NH2, v=0
  155541.6732  0.0021 -3.9538 3  108.3860 61  71510 30330 327      30 228        syn-C2H3C(O)NH2, v=0
  155545.2776  0.0021 -3.9538 3  108.3860 61  71510 30330 427      30 328        syn-C2H3C(O)NH2, v=0
  155545.4148  0.0021 -7.0336 3  108.3860 61  71510 30330 427      30 228        syn-C2H3C(O)NH2, v=0
  155620.2171  0.0068 -6.5515 3  570.9613125  71510 303622043      631746        syn-C2H3C(O)NH2, v=0
  155625.9483  0.0064 -5.5095 3  842.0342147  71510 303732846      722943        syn-C2H3C(O)NH2, v=0
  155625.9490  0.0064 -5.5095 3  842.0342147  71510 303732845      722944        syn-C2H3C(O)NH2, v=0
  155632.3194  0.0200 -3.6349 3   59.8241 45 -71510 30322 419      21 318        syn-C2H3C(O)NH2, v=0
  155658.8618  0.0014 -5.2861 3   32.7949 31  71510 30315 6 9      15 312        syn-C2H3C(O)NH2, v=0
  155667.4211  0.0010 -5.7248 3   70.5615 43  71510 30321 913      20 912        syn-C2H3C(O)NH2, v=0
  155681.9015  0.0010 -5.7247 3   70.5618 43  71510 30321 912      20 911        syn-C2H3C(O)NH2, v=0
  155701.1918  0.0031 -6.1347 3  272.7670 59  71510 3032927 2      3026 5        syn-C2H3C(O)NH2, v=0
  155701.1918  0.0031 -6.1347 3  272.7670 59  71510 3032927 3      3026 4        syn-C2H3C(O)NH2, v=0
  155719.3477  0.0589 -6.9523 3 1576.0080197  71510 303984157      974256        syn-C2H3C(O)NH2, v=0
  155719.3477  0.0589 -6.9523 3 1576.0080197  71510 303984158      974255        syn-C2H3C(O)NH2, v=0
  155735.0079  0.0013 -4.4498 3  227.0533 81  71510 303401130      391227        syn-C2H3C(O)NH2, v=0
  155749.5847  0.0064 -6.4098 3  655.3796143  71510 303711160      721063        syn-C2H3C(O)NH2, v=0
  155749.7215  0.0064 -6.4098 3  655.3796143  71510 303711260      72 963        syn-C2H3C(O)NH2, v=0
  155856.5315  0.0054 -4.2751 3  652.6132137  71510 303681751      681652        syn-C2H3C(O)NH2, v=0
  155882.2111  0.0200 -3.7783 3  297.8430 93 -71510 303461235      461136        syn-C2H3C(O)NH2, v=0
  155895.7645  0.0107 -5.9600 3  645.5430101  71510 303503812      513715        syn-C2H3C(O)NH2, v=0
  155895.7645  0.0107 -5.9600 3  645.5430101  71510 303503813      513714        syn-C2H3C(O)NH2, v=0
  155900.3632  0.0009 -5.7496 3    7.3848 17  71510 303 8 4 5       7 1 6        syn-C2H3C(O)NH2, v=0
  155903.1695  0.0058 -6.3503 3  358.3369101  71510 303501436      511141        syn-C2H3C(O)NH2, v=0
  155960.1761  0.0516 -6.6515 3 1124.6675139  71510 303694821      704724        syn-C2H3C(O)NH2, v=0
  155960.1761  0.0516 -6.6515 3 1124.6675139  71510 303694822      704723        syn-C2H3C(O)NH2, v=0
  155973.3790  0.0013 -5.0200 3   41.0515 35  71510 30317 611      17 314        syn-C2H3C(O)NH2, v=0
  155975.0414  0.0010 -4.0182 3   26.5301 29  71510 30314 510      13 4 9        syn-C2H3C(O)NH2, v=0
  156176.4260  0.0200 -3.7031 3  135.4671 59 -71510 303291217      291118        syn-C2H3C(O)NH2, v=0
  156185.9393  0.0081 -5.6018 3  891.7628151  71510 303752947      743044        syn-C2H3C(O)NH2, v=0
  156185.9395  0.0081 -5.6018 3  891.7628151  71510 303752946      743045        syn-C2H3C(O)NH2, v=0
  156211.6146  0.0019 -6.9954 3  253.6360 87  71510 30343 934      43 935        syn-C2H3C(O)NH2, v=0
  156226.1717  0.0052 -6.8065 3  109.9470 63  71510 30331 229      32 132        syn-C2H3C(O)NH2, v=0
  156226.2397  0.0052 -6.8065 3  109.9470 63  71510 30331 329      32 032        syn-C2H3C(O)NH2, v=0
  156237.7478  0.0200 -3.7028 3  135.4649 59 -71510 303291218      291119        syn-C2H3C(O)NH2, v=0
  156267.2680  0.0025 -6.1770 3  253.2002 83  71510 303411427      421132        syn-C2H3C(O)NH2, v=0
  156278.3651  0.0200 -3.7112 3  227.0533 79 -71510 303391326      391227        syn-C2H3C(O)NH2, v=0
  156302.0499  0.0030 -6.3475 3  246.3776 55  71510 3032726 1      2825 4        syn-C2H3C(O)NH2, v=0
  156302.0499  0.0030 -6.3475 3  246.3776 55  71510 3032726 2      2825 3        syn-C2H3C(O)NH2, v=0
  156406.6822  0.0064 -6.4915 3  145.6064 65  71510 30332 923      33 628        syn-C2H3C(O)NH2, v=0
  156408.7713  0.0200 -3.7202 3  247.3863 83 -71510 303411329      411230        syn-C2H3C(O)NH2, v=0
  156426.6666  0.0017 -6.9306 3  193.3148 77  71510 30338 731      38 732        syn-C2H3C(O)NH2, v=0
  156472.4206  0.0010 -5.6922 3   66.6703 43  71510 30321 814      20 813        syn-C2H3C(O)NH2, v=0
  156476.0552  0.0534 -6.8806 3 1257.9719191  71510 303952273      942570        syn-C2H3C(O)NH2, v=0
  156536.9196  0.0017 -3.7551 3  193.3111 77  71510 30338 731      38 632        syn-C2H3C(O)NH2, v=0
  156541.4048  0.0200 -3.7850 3  314.8990 95 -71510 303471335      471236        syn-C2H3C(O)NH2, v=0
  156604.3585  0.0089 -5.9187 3  603.7915 97  71510 303483711      493614        syn-C2H3C(O)NH2, v=0
  156604.3585  0.0089 -5.9187 3  603.7915 97  71510 303483712      493613        syn-C2H3C(O)NH2, v=0
  156610.1528  0.0036 -4.7652 3  281.1326 91  71510 303451135      441232        syn-C2H3C(O)NH2, v=0
  156610.8878  0.0015 -3.7458 3  217.6430 81  71510 30340 932      40 833        syn-C2H3C(O)NH2, v=0
  156660.8642  0.0010 -5.6912 3   66.6758 43  71510 30321 813      20 812        syn-C2H3C(O)NH2, v=0
  156665.5601  0.0624 -6.9192 3 1282.2469193  71510 303962274      952571        syn-C2H3C(O)NH2, v=0
  156700.5746  0.0079 -6.6497 3  695.8515139  71510 303692148      701853        syn-C2H3C(O)NH2, v=0
  156742.5324  0.0451 -6.5583 3 1069.0709135  71510 303674720      684623        syn-C2H3C(O)NH2, v=0
  156742.5324  0.0451 -6.5583 3 1069.0709135  71510 303674721      684622        syn-C2H3C(O)NH2, v=0
  156767.2512  0.0100 -5.6972 3  942.9260155  71510 303773047      763146        syn-C2H3C(O)NH2, v=0
  156767.2512  0.0100 -5.6972 3  942.9260155  71510 303773048      763145        syn-C2H3C(O)NH2, v=0
  156804.3430  0.0013 -6.9880 3  243.1369 85  71510 303421033      42 834        syn-C2H3C(O)NH2, v=0
  156889.3712  0.0029 -6.7372 3  221.4321 51  71510 3032525 0      2624 3        syn-C2H3C(O)NH2, v=0
  156889.3712  0.0029 -6.7372 3  221.4321 51  71510 3032525 1      2624 2        syn-C2H3C(O)NH2, v=0
  156892.4303  0.0009 -5.6472 3   60.3853 43  71510 30321 616      20 615        syn-C2H3C(O)NH2, v=0
  156959.6111  0.0020 -6.9631 3  127.7300 65  71510 30332 428      32 429        syn-C2H3C(O)NH2, v=0
  156960.6086  0.0020 -3.8618 3  127.7300 65  71510 30332 428      32 329        syn-C2H3C(O)NH2, v=0
  156976.4117  0.0018 -3.7647 3  253.6105 87  71510 30343 934      43 835        syn-C2H3C(O)NH2, v=0
  156979.5545  0.0020 -3.8617 3  127.7300 65  71510 30332 528      32 429        syn-C2H3C(O)NH2, v=0
  156980.5520  0.0020 -6.9630 3  127.7300 65  71510 30332 528      32 329        syn-C2H3C(O)NH2, v=0
  156997.4200  0.0010 -5.6412 3   53.8142 41  71510 30320 515      19 514        syn-C2H3C(O)NH2, v=0
  157007.3179  0.0015 -6.9495 3  217.6297 81  71510 30340 932      40 733        syn-C2H3C(O)NH2, v=0
  157055.6562  0.0399 -7.0496 3 1064.6830181  71510 303901575      911478        syn-C2H3C(O)NH2, v=0
  157055.7021  0.0399 -7.0496 3 1064.6830181  71510 303901675      911378        syn-C2H3C(O)NH2, v=0
  157092.6224  0.0027 -6.7363 3   60.3853 39  71510 30319 910      20 615        syn-C2H3C(O)NH2, v=0
  157126.9111  0.0200 -3.7071 3  128.2565 57 -71510 303281216      281117        syn-C2H3C(O)NH2, v=0
  157135.4989  0.0024 -4.3579 3   79.1203 55  71510 30327 126      27 027        syn-C2H3C(O)NH2, v=0
  157135.5262  0.0024 -4.3579 3   79.1203 55  71510 30327 226      27 127        syn-C2H3C(O)NH2, v=0
  157155.9162  0.0200 -3.7069 3  128.2554 57 -71510 303281217      281118        syn-C2H3C(O)NH2, v=0
  157259.6830  0.0036 -6.1470 3  239.4092 89  71510 30344 539      45 442        syn-C2H3C(O)NH2, v=0
  157259.8566  0.0036 -6.1470 3  239.4092 89  71510 30344 639      45 342        syn-C2H3C(O)NH2, v=0
  157263.7030  0.0010 -5.6641 3   63.2978 43  71510 30321 715      20 714        syn-C2H3C(O)NH2, v=0
  157281.3472  0.0200 -3.7694 3  296.9400 91 -71510 303451431      451332        syn-C2H3C(O)NH2, v=0
  157303.9138  0.0074 -5.8853 3  563.4778 93  71510 303463610      473513        syn-C2H3C(O)NH2, v=0
  157303.9138  0.0074 -5.8853 3  563.4778 93  71510 303463611      473512        syn-C2H3C(O)NH2, v=0
  157317.8193  0.0037 -6.2117 3  494.4970125  71510 30362 953      63 856        syn-C2H3C(O)NH2, v=0
  157317.9829  0.0037 -6.2117 3  494.4970125  71510 303621053      63 756        syn-C2H3C(O)NH2, v=0
  157322.1715  0.0680 -7.0246 3 1316.1318195  71510 303972374      962671        syn-C2H3C(O)NH2, v=0
  157334.0785  0.0031 -3.9395 3  423.7272111  71510 303551342      551243        syn-C2H3C(O)NH2, v=0
  157367.7275  0.0123 -5.7955 3  995.5228159  71510 303793149      783246        syn-C2H3C(O)NH2, v=0
  157367.7276  0.0123 -5.7955 3  995.5228159  71510 303793148      783247        syn-C2H3C(O)NH2, v=0
  157517.3503  0.0392 -6.4696 3 1014.9032131  71510 303654619      664522        syn-C2H3C(O)NH2, v=0
  157517.3503  0.0392 -6.4696 3 1014.9032131  71510 303654620      664521        syn-C2H3C(O)NH2, v=0
  157556.6517  0.0200 -3.7497 3  193.3148 77 -71510 30338 831      38 732        syn-C2H3C(O)NH2, v=0
  157615.4824  0.0027 -6.1887 3  303.0426 91  71510 303451530      461235        syn-C2H3C(O)NH2, v=0
  157665.1984  0.0017 -6.9175 3  170.2095 73  71510 30336 630      36 631        syn-C2H3C(O)NH2, v=0
  157666.8740  0.0016 -6.9243 3  193.3111 77  71510 30338 831      38 632        syn-C2H3C(O)NH2, v=0
  157670.4609  0.0200 -4.4648 3  268.9301 87 -71510 303431330      421429        syn-C2H3C(O)NH2, v=0
  157680.6443  0.0009 -5.6247 3   57.3107 43  71510 30321 417      20 416        syn-C2H3C(O)NH2, v=0
  157692.1851  0.0017 -3.7691 3  170.2086 73  71510 30336 630      36 531        syn-C2H3C(O)NH2, v=0
  157697.8821  0.0124 -6.7224 3  680.7318139  71510 303691950      701655        syn-C2H3C(O)NH2, v=0
  157717.4474  0.0021 -7.0414 3  292.2697 93  71510 303461036      461037        syn-C2H3C(O)NH2, v=0
  157724.4654  0.0018 -6.9273 3  148.3428 69  71510 30334 529      34 530        syn-C2H3C(O)NH2, v=0
  157730.1544  0.0018 -3.8034 3  148.3426 69  71510 30334 529      34 430        syn-C2H3C(O)NH2, v=0
  157744.1467  0.0200 -3.8214 3   17.2784 19 -71510 303 9 7 3       8 6 2        syn-C2H3C(O)NH2, v=0
  157744.1467  0.0200 -3.8214 3   17.2784 19 -71510 303 9 7 2       8 6 3        syn-C2H3C(O)NH2, v=0
  157755.8509  0.0056 -6.5325 3  619.2370131  71510 303652045      661750        syn-C2H3C(O)NH2, v=0
  157812.9164  0.0018 -3.8030 3  148.3428 69  71510 30334 629      34 530        syn-C2H3C(O)NH2, v=0
  157818.6054  0.0018 -6.9269 3  148.3426 69  71510 30334 629      34 430        syn-C2H3C(O)NH2, v=0
  157862.0773  0.0008 -3.8939 3   19.3642 23  71510 30311 6 6      10 5 5        syn-C2H3C(O)NH2, v=0
  157865.6230  0.0027 -6.3286 3  122.9906 57  71510 303281117      29 822        syn-C2H3C(O)NH2, v=0
  157897.8936  0.0029 -6.1113 3  355.8243107  71510 30353 746      54 649        syn-C2H3C(O)NH2, v=0
  157898.0737  0.0029 -6.1113 3  355.8243107  71510 30353 846      54 549        syn-C2H3C(O)NH2, v=0
  157919.9275  0.0200 -3.7069 3  237.0241 81 -71510 303401328      401229        syn-C2H3C(O)NH2, v=0
  157931.7312  0.0027 -4.0555 3  517.4781121  71510 303601743      601644        syn-C2H3C(O)NH2, v=0
  157958.5146  0.0200 -3.7133 3  121.3074 55 -71510 303271215      271116        syn-C2H3C(O)NH2, v=0
  157971.7263  0.0200 -3.7133 3  121.3069 55 -71510 303271216      271117        syn-C2H3C(O)NH2, v=0
  157982.7112  0.0103 -6.5441 3  752.9975153  71510 303761264      771167        syn-C2H3C(O)NH2, v=0
  157982.8019  0.0103 -6.5441 3  752.9975153  71510 303761364      771067        syn-C2H3C(O)NH2, v=0
  157985.5504  0.0149 -5.8970 3 1049.5522163  71510 303813249      803348        syn-C2H3C(O)NH2, v=0
  157985.5504  0.0149 -5.8970 3 1049.5522163  71510 303813250      803347        syn-C2H3C(O)NH2, v=0
  157994.1537  0.0062 -5.8607 3  524.6025 89  71510 3034435 9      453412        syn-C2H3C(O)NH2, v=0
  157994.1537  0.0062 -5.8607 3  524.6025 89  71510 303443510      453411        syn-C2H3C(O)NH2, v=0
  158002.7099  0.0017 -3.7675 3  170.2095 73  71510 30336 730      36 631        syn-C2H3C(O)NH2, v=0
  158002.8488  0.0008 -3.8933 3   19.3600 23  71510 30311 6 5      10 5 6        syn-C2H3C(O)NH2, v=0
  158029.6966  0.0017 -6.9156 3  170.2086 73  71510 30336 730      36 531        syn-C2H3C(O)NH2, v=0
  158284.5171  0.0340 -6.3856 3  962.1655127  71510 303634518      644421        syn-C2H3C(O)NH2, v=0
  158284.5171  0.0340 -6.3856 3  962.1655127  71510 303634519      644420        syn-C2H3C(O)NH2, v=0
  158408.5694  0.0014 -6.5029 3   11.6160 19  71510 303 9 5 5       9 2 8        syn-C2H3C(O)NH2, v=0
  158469.9650  0.0030 -6.2216 3  357.3541 99  71510 303491633      501338        syn-C2H3C(O)NH2, v=0
  158487.5272  0.0044 -6.4302 3  547.0767123  71510 303611942      621647        syn-C2H3C(O)NH2, v=0
  158500.9939  0.0031 -6.8645 3   55.6569 37  71510 30318 910      19 613        syn-C2H3C(O)NH2, v=0
  158519.7511  0.0011 -4.0059 3   30.1697 31  71510 30315 511      14 410        syn-C2H3C(O)NH2, v=0
  158619.1781  0.0180 -6.0014 3 1105.0130167  71510 303833350      823449        syn-C2H3C(O)NH2, v=0
  158619.1781  0.0180 -6.0014 3 1105.0130167  71510 303833351      823448        syn-C2H3C(O)NH2, v=0
  158641.3192  0.0012 -7.0360 3  269.7915 89  71510 303441134      44 935        syn-C2H3C(O)NH2, v=0
  158674.7751  0.0053 -5.8464 3  487.1665 85  71510 3034234 8      433311        syn-C2H3C(O)NH2, v=0
  158674.7751  0.0053 -5.8464 3  487.1665 85  71510 3034234 9      433310        syn-C2H3C(O)NH2, v=0
  158687.8426  0.0200 -3.7220 3  114.6181 53 -71510 303261214      261115        syn-C2H3C(O)NH2, v=0
  158693.6330  0.0200 -3.7219 3  114.6179 53 -71510 303261215      261116        syn-C2H3C(O)NH2, v=0
  158700.7198  0.0051 -4.6791 3  907.9721161  71510 303802159      802060        syn-C2H3C(O)NH2, v=0
  158707.3411  0.0016 -5.4748 3   28.9647 29  71510 30314 6 8      14 311        syn-C2H3C(O)NH2, v=0
  158794.0358  0.0030 -4.2990 3  154.1401 67  71510 30333 924      321023        syn-C2H3C(O)NH2, v=0
  158847.0894  0.0011 -5.6554 3   63.3606 43  71510 30321 714      20 713        syn-C2H3C(O)NH2, v=0
  158870.3355  0.0038 -6.3437 3  479.3740115  71510 303571839      581544        syn-C2H3C(O)NH2, v=0
  158875.4942  0.0034 -6.2738 3  416.1321107  71510 303531736      541441        syn-C2H3C(O)NH2, v=0
  159043.9081  0.0293 -6.3065 3  910.8587123  71510 303614417      624320        syn-C2H3C(O)NH2, v=0
  159043.9081  0.0293 -6.3065 3  910.8587123  71510 303614418      624319        syn-C2H3C(O)NH2, v=0
  159108.6195  0.0200 -3.7896 3  326.9804 97 -71510 303481336      481237        syn-C2H3C(O)NH2, v=0
  159122.6942  0.0019 -3.7849 3  292.2228 93  71510 303461036      46 937        syn-C2H3C(O)NH2, v=0
  159267.2966  0.0215 -6.1090 3 1161.9042171  71510 303853451      843550        syn-C2H3C(O)NH2, v=0
  159267.2966  0.0215 -6.1090 3 1161.9042171  71510 303853452      843549        syn-C2H3C(O)NH2, v=0
  159269.4229  0.0200 -3.6926 3  217.1739 77 -71510 303381325      381226        syn-C2H3C(O)NH2, v=0
  159281.6639  0.0058 -6.4501 3  501.7733117  71510 303581940      591643        syn-C2H3C(O)NH2, v=0
  159316.7366  0.0026 -3.8735 3  377.2947105  71510 303521240      521141        syn-C2H3C(O)NH2, v=0
  159327.7909  0.0200 -3.7332 3  108.1871 51 -71510 303251213      251114        syn-C2H3C(O)NH2, v=0
  159330.2220  0.0200 -3.7331 3  108.1870 51 -71510 303251214      251115        syn-C2H3C(O)NH2, v=0
  159345.4461  0.0046 -5.8440 3  451.1702 81  71510 3034033 7      413210        syn-C2H3C(O)NH2, v=0
  159345.4461  0.0046 -5.8440 3  451.1702 81  71510 3034033 8      4132 9        syn-C2H3C(O)NH2, v=0
  159466.1260  0.0042 -6.2428 3  193.9851 81  71510 30340 436      41 339        syn-C2H3C(O)NH2, v=0
  159466.2386  0.0042 -6.2428 3  193.9851 81  71510 30340 536      41 239        syn-C2H3C(O)NH2, v=0
  159546.5858  0.0200 -3.6943 3  226.9284 79 -71510 303391327      391228        syn-C2H3C(O)NH2, v=0
  159649.4685  0.0111 -4.5975 3  860.7341157  71510 303782058      781959        syn-C2H3C(O)NH2, v=0
  159649.6550  0.0022 -4.0813 3   96.4904 59  71510 30329 227      29 128        syn-C2H3C(O)NH2, v=0
  159649.9244  0.0022 -4.0813 3   96.4904 59  71510 30329 327      29 228        syn-C2H3C(O)NH2, v=0
  159665.0630  0.0017 -3.8366 3  363.5373101  71510 303501535      501436        syn-C2H3C(O)NH2, v=0
  159717.6978  0.0200 -3.9334 3  437.0469111 -71510 303551639      551540        syn-C2H3C(O)NH2, v=0
  159750.1569  0.0200 -4.1727 3  595.0743131 -71510 303651649      651550        syn-C2H3C(O)NH2, v=0
  159795.3865  0.0251 -6.2326 3  860.9839119  71510 303594316      604219        syn-C2H3C(O)NH2, v=0
  159795.3865  0.0251 -6.2326 3  860.9839119  71510 303594317      604218        syn-C2H3C(O)NH2, v=0
  159888.7389  0.0200 -3.7471 3  102.0130 49 -71510 303241212      241113        syn-C2H3C(O)NH2, v=0
  159889.7244  0.0200 -3.7471 3  102.0129 49 -71510 303241213      241114        syn-C2H3C(O)NH2, v=0
  159922.0361  0.0048 -6.3032 3  579.9179135  71510 303671057      68 960        syn-C2H3C(O)NH2, v=0
  159922.1472  0.0048 -6.3032 3  579.9179135  71510 303671157      68 860        syn-C2H3C(O)NH2, v=0
  159928.7806  0.0255 -6.2195 3 1220.2247175  71510 303873552      863651        syn-C2H3C(O)NH2, v=0
  159928.7806  0.0255 -6.2195 3 1220.2247175  71510 303873553      863650        syn-C2H3C(O)NH2, v=0
  159933.1408  0.0022 -3.8215 3  333.4551 99  71510 303491138      491039        syn-C2H3C(O)NH2, v=0
  159954.5590  0.0188 -6.8438 3  761.0950147  71510 303732053      741758        syn-C2H3C(O)NH2, v=0
  159972.3191  0.0072 -5.3379 3  497.5038121  71510 303601447      591544        syn-C2H3C(O)NH2, v=0
  159994.0660  0.0054 -4.4598 3  780.3294149  71510 303742054      741955        syn-C2H3C(O)NH2, v=0
  160005.8041  0.0041 -5.8558 3  416.6145 77  71510 3033832 6      3931 9        syn-C2H3C(O)NH2, v=0
  160005.8041  0.0041 -5.8558 3  416.6145 77  71510 3033832 7      3931 8        syn-C2H3C(O)NH2, v=0
  160072.1057  0.0171 -6.6989 3  857.3089163  71510 303811368      821271        syn-C2H3C(O)NH2, v=0
  160072.1654  0.0171 -6.6989 3  857.3089163  71510 303811468      821171        syn-C2H3C(O)NH2, v=0
  160110.1079  0.0065 -6.3986 3  417.4017109  71510 303541539      551244        syn-C2H3C(O)NH2, v=0
  160165.8746  0.0013 -3.9884 3   34.0870 33  71510 30316 512      15 411        syn-C2H3C(O)NH2, v=0
  160297.4747  0.0018 -4.9523 3   45.4621 37  71510 30318 612      18 315        syn-C2H3C(O)NH2, v=0
  160370.0318  0.0854 -7.0136 3 1342.3493153  71510 303765224      775127        syn-C2H3C(O)NH2, v=0
  160370.0318  0.0854 -7.0136 3 1342.3493153  71510 303765225      775126        syn-C2H3C(O)NH2, v=0
  160378.3530  0.0009 -5.6036 3   62.8329 45  71510 30322 518      21 517        syn-C2H3C(O)NH2, v=0
  160379.4235  0.0009 -3.7640 3   96.0944 47  71510 303231211      231112        syn-C2H3C(O)NH2, v=0
  160379.7955  0.0009 -3.7640 3   96.0944 47  71510 303231212      231113        syn-C2H3C(O)NH2, v=0
  160510.6334  0.0200 -3.5836 3   65.0154 47 -71510 30323 320      22 419        syn-C2H3C(O)NH2, v=0
  160519.4532  0.0012 -6.8283 3  160.3717 45  71510 3032221 1      2121 0        syn-C2H3C(O)NH2, v=0
  160519.4532  0.0012 -6.8283 3  160.3717 45  71510 3032221 2      2121 1        syn-C2H3C(O)NH2, v=0
  160538.8012  0.0215 -6.1640 3  812.5420115  71510 303574215      584118        syn-C2H3C(O)NH2, v=0
  160538.8012  0.0215 -6.1640 3  812.5420115  71510 303574216      584117        syn-C2H3C(O)NH2, v=0
  160589.4575  0.0012 -6.5170 3  150.6948 45  71510 3032220 2      2120 1        syn-C2H3C(O)NH2, v=0
  160589.4575  0.0012 -6.5170 3  150.6948 45  71510 3032220 3      2120 2        syn-C2H3C(O)NH2, v=0
  160590.5823  0.0012 -4.4333 3  252.6551 85  71510 303421231      411328        syn-C2H3C(O)NH2, v=0
  160600.3084  0.0200 -3.3265 3   68.2041 53 -71510 30326 026      25 125        syn-C2H3C(O)NH2, v=0
  160600.3226  0.0010 -5.5160 3   68.2041 53  71510 30326 126      25 125        syn-C2H3C(O)NH2, v=0
  160600.3234  0.0010 -5.5160 3   68.2041 53  71510 30326 026      25 025        syn-C2H3C(O)NH2, v=0
  160600.3084  0.0200 -3.3265 3   68.2041 53 -71510 30326 126      25 025        syn-C2H3C(O)NH2, v=0
  160602.6627  0.0300 -6.3332 3 1279.9733179  71510 303893653      883752        syn-C2H3C(O)NH2, v=0
  160602.6627  0.0300 -6.3332 3 1279.9733179  71510 303893654      883751        syn-C2H3C(O)NH2, v=0
  160603.8349  0.0010 -3.3939 3   67.6842 51  71510 30325 124      24 223        syn-C2H3C(O)NH2, v=0
  160603.9529  0.0010 -5.5384 3   67.6842 51  71510 30325 224      24 223        syn-C2H3C(O)NH2, v=0
  160604.0775  0.0010 -5.5384 3   67.6842 51  71510 30325 124      24 123        syn-C2H3C(O)NH2, v=0
  160604.1955  0.0010 -3.3939 3   67.6842 51  71510 30325 224      24 123        syn-C2H3C(O)NH2, v=0
  160653.3159  0.0200 -3.4752 3   66.6335 49 -71510 30324 222      23 321        syn-C2H3C(O)NH2, v=0
  160655.4532  0.0038 -5.8854 3  383.4999 73  71510 3033631 5      3730 8        syn-C2H3C(O)NH2, v=0
  160655.4532  0.0038 -5.8854 3  383.4999 73  71510 3033631 6      3730 7        syn-C2H3C(O)NH2, v=0
  160656.7403  0.0056 -4.6359 3  886.9018159  71510 303792158      792059        syn-C2H3C(O)NH2, v=0
  160661.6533  0.0009 -5.5601 3   66.6335 49  71510 30324 322      23 321        syn-C2H3C(O)NH2, v=0
  160669.1482  0.0011 -6.3318 3  141.4917 45  71510 3032219 3      2119 2        syn-C2H3C(O)NH2, v=0
  160669.1482  0.0011 -6.3318 3  141.4917 45  71510 3032219 4      2119 3        syn-C2H3C(O)NH2, v=0
  160669.3711  0.0009 -5.5601 3   66.6329 49  71510 30324 222      23 221        syn-C2H3C(O)NH2, v=0
  160677.6449  0.0200 -3.4751 3   66.6329 49 -71510 30324 322      23 221        syn-C2H3C(O)NH2, v=0
  160728.3736  0.0014 -3.7740 3  309.5377 95  71510 303471236      471137        syn-C2H3C(O)NH2, v=0
  160760.8626  0.0011 -6.1989 3  132.7627 45  71510 3032218 4      2118 3        syn-C2H3C(O)NH2, v=0
  160760.8626  0.0011 -6.1989 3  132.7627 45  71510 3032218 5      2118 4        syn-C2H3C(O)NH2, v=0
  160803.4436  0.0009 -5.5806 3   65.0154 47  71510 30323 420      22 419        syn-C2H3C(O)NH2, v=0
  160807.3707  0.0200 -3.7842 3   90.4302 45 -71510 303221210      221111        syn-C2H3C(O)NH2, v=0
  160807.3707  0.0200 -3.7842 3   90.4302 45 -71510 303221211      221112        syn-C2H3C(O)NH2, v=0
  160846.4749  0.0200 -3.7550 3  280.9913 91 -71510 303451135      451036        syn-C2H3C(O)NH2, v=0
  160867.6639  0.0011 -6.0952 3  124.5085 45  71510 3032217 5      2117 4        syn-C2H3C(O)NH2, v=0
  160867.6639  0.0011 -6.0952 3  124.5085 45  71510 3032217 6      2117 5        syn-C2H3C(O)NH2, v=0
  160886.1321  0.0011 -6.9712 3    3.5374 13  71510 303 6 4 2       5 1 5        syn-C2H3C(O)NH2, v=0
  160891.2070  0.0101 -4.7084 3  929.2340163  71510 303812160      812061        syn-C2H3C(O)NH2, v=0
  160896.5215  0.0031 -6.1087 3  300.3632 99  71510 30349 643      50 546        syn-C2H3C(O)NH2, v=0
  160896.6524  0.0031 -6.1087 3  300.3632 99  71510 30349 743      50 446        syn-C2H3C(O)NH2, v=0
  160955.3796  0.0032 -6.1496 3  429.0240117  71510 30358 850      59 753        syn-C2H3C(O)NH2, v=0
  160955.5067  0.0032 -6.1496 3  429.0240117  71510 30358 950      59 653        syn-C2H3C(O)NH2, v=0
  160976.9100  0.0200 -4.0140 3   22.9439 27 -71510 30313 5 8      12 4 9        syn-C2H3C(O)NH2, v=0
  160993.6364  0.0010 -6.0104 3  116.7298 45  71510 3032216 6      2116 5        syn-C2H3C(O)NH2, v=0
  160993.6364  0.0010 -6.0104 3  116.7298 45  71510 3032216 7      2116 6        syn-C2H3C(O)NH2, v=0
  161030.8323  0.0009 -5.5792 3   64.9981 47  71510 30323 320      22 319        syn-C2H3C(O)NH2, v=0
  161065.4293  0.0015 -4.4555 3  237.2316 83  71510 303411131      401228        syn-C2H3C(O)NH2, v=0
  161087.1271  0.0056 -6.3389 3  264.2919 87  71510 303431231      44 936        syn-C2H3C(O)NH2, v=0
  161098.2644  0.0102 -4.4834 3  794.7433151  71510 303751956      751857        syn-C2H3C(O)NH2, v=0
  161120.3872  0.0017 -6.9368 3  227.4787 83  71510 30341 833      41 834        syn-C2H3C(O)NH2, v=0
  161144.3324  0.0010 -5.9390 3  109.4275 45  71510 3032215 7      2115 6        syn-C2H3C(O)NH2, v=0
  161144.3324  0.0010 -5.9390 3  109.4275 45  71510 3032215 8      2115 7        syn-C2H3C(O)NH2, v=0
  161166.6468  0.0048 -6.4291 3  153.0853 73  71510 30336 333      37 236        syn-C2H3C(O)NH2, v=0
  161166.7129  0.0048 -6.4291 3  153.0853 73  71510 30336 433      37 136        syn-C2H3C(O)NH2, v=0
  161174.7607  0.0014 -3.9623 3   38.2692 35  71510 30317 513      16 412        syn-C2H3C(O)NH2, v=0
  161176.3138  0.0758 -6.9058 3 1281.5317149  71510 303745123      755026        syn-C2H3C(O)NH2, v=0
  161176.3138  0.0758 -6.9058 3 1281.5317149  71510 303745124      755025        syn-C2H3C(O)NH2, v=0
  161179.0108  0.0200 -3.8083 3   85.0194 43 -71510 3032112 9      211110        syn-C2H3C(O)NH2, v=0
  161179.0108  0.0200 -3.8083 3   85.0194 43 -71510 303211210      211111        syn-C2H3C(O)NH2, v=0
  161200.6671  0.0200 -3.6827 3  217.1010 77 -71510 303381326      381227        syn-C2H3C(O)NH2, v=0
  161273.9867  0.0182 -6.1012 3  765.5339111  71510 303554114      564017        syn-C2H3C(O)NH2, v=0
  161273.9867  0.0182 -6.1012 3  765.5339111  71510 303554115      564016        syn-C2H3C(O)NH2, v=0
  161288.1079  0.0352 -6.4498 3 1341.1489183  71510 303913754      903853        syn-C2H3C(O)NH2, v=0
  161288.1079  0.0352 -6.4498 3 1341.1489183  71510 303913755      903852        syn-C2H3C(O)NH2, v=0
  161293.9624  0.0035 -5.9379 3  351.8269 69  71510 3033430 4      3529 7        syn-C2H3C(O)NH2, v=0
  161293.9624  0.0035 -5.9379 3  351.8269 69  71510 3033430 5      3529 6        syn-C2H3C(O)NH2, v=0
  161323.6078  0.0009 -3.5789 3   64.9981 47  71510 30323 420      22 319        syn-C2H3C(O)NH2, v=0
  161327.4756  0.0010 -5.8777 3  102.6031 45  71510 3032214 8      2114 7        syn-C2H3C(O)NH2, v=0
  161327.4756  0.0010 -5.8777 3  102.6031 45  71510 3032214 9      2114 8        syn-C2H3C(O)NH2, v=0
  161350.8592  0.0016 -3.7406 3  227.4710 83  71510 30341 833      41 734        syn-C2H3C(O)NH2, v=0
  161408.5191  0.0026 -6.2420 3  158.3887 65  71510 303321220      33 925        syn-C2H3C(O)NH2, v=0
  161500.3515  0.0200 -3.8369 3   79.8609 41 -71510 3032012 8      2011 9        syn-C2H3C(O)NH2, v=0
  161500.3515  0.0200 -3.8369 3   79.8609 41 -71510 3032012 9      201110        syn-C2H3C(O)NH2, v=0
  161512.0353  0.0031 -4.1484 3  108.6824 57  71510 30328 721      27 820        syn-C2H3C(O)NH2, v=0
  161554.1129  0.0010 -5.8244 3   96.2583 45  71510 303221310      2113 9        syn-C2H3C(O)NH2, v=0
  161554.1130  0.0010 -5.8244 3   96.2583 45  71510 3032213 9      2113 8        syn-C2H3C(O)NH2, v=0
  161647.8921  0.0200 -4.7774 3  472.8826113 -71510 303561938      552035        syn-C2H3C(O)NH2, v=0
  161675.6522  0.0015 -4.7773 3  472.8825113  71510 303561937      552036        syn-C2H3C(O)NH2, v=0
  161681.6180  0.0200 -4.8446 3  510.1405117 -71510 303582039      572136        syn-C2H3C(O)NH2, v=0
  161682.6443  0.0021 -7.0118 3  115.1582 63  71510 30331 328      31 329        syn-C2H3C(O)NH2, v=0
  161682.7122  0.0021 -3.9344 3  115.1582 63  71510 30331 328      31 229        syn-C2H3C(O)NH2, v=0
  161684.5825  0.0021 -3.9344 3  115.1582 63  71510 30331 428      31 329        syn-C2H3C(O)NH2, v=0
  161684.6505  0.0021 -7.0117 3  115.1582 63  71510 30331 428      31 229        syn-C2H3C(O)NH2, v=0
  161691.4977  0.0200 -4.8445 3  510.1405117 -71510 303582038      572137        syn-C2H3C(O)NH2, v=0
  161711.3506  0.0200 -3.6781 3  207.5842 75 -71510 303371324      371225        syn-C2H3C(O)NH2, v=0
  161726.9790  0.0015 -4.7132 3  437.0696109  71510 303541837      531934        syn-C2H3C(O)NH2, v=0
  161776.7025  0.0200 -3.8709 3   74.9538 39 -71510 3031912 7      1911 8        syn-C2H3C(O)NH2, v=0
  161776.7025  0.0200 -3.8709 3   74.9538 39 -71510 3031912 8      1911 9        syn-C2H3C(O)NH2, v=0
  161804.0658  0.0015 -4.7128 3  437.0695109  71510 303541836      531935        syn-C2H3C(O)NH2, v=0
  161811.8853  0.0200 -4.9146 3  548.8421121 -71510 303602140      592237        syn-C2H3C(O)NH2, v=0
  161815.2654  0.0200 -4.9146 3  548.8421121 -71510 303602139      592238        syn-C2H3C(O)NH2, v=0
  161840.5948  0.0010 -5.7775 3   90.3957 45  71510 303221211      211210        syn-C2H3C(O)NH2, v=0
  161840.5980  0.0010 -5.7775 3   90.3957 45  71510 303221210      2112 9        syn-C2H3C(O)NH2, v=0
  161866.1942  0.0015 -3.9263 3   42.7001 37  71510 30318 514      17 413        syn-C2H3C(O)NH2, v=0
  161920.8631  0.0034 -6.0221 3  321.5962 65  71510 3033229 3      3328 6        syn-C2H3C(O)NH2, v=0
  161920.8631  0.0034 -6.0221 3  321.5962 65  71510 3033229 4      3328 5        syn-C2H3C(O)NH2, v=0
  161930.4636  0.0200 -4.6519 3  402.7029105 -71510 303521736      511833        syn-C2H3C(O)NH2, v=0
  161938.2588  0.0200 -3.7393 3  253.6360 87 -71510 303431034      43 935        syn-C2H3C(O)NH2, v=0
  161975.2365  0.0670 -6.8023 3 1222.1388145  71510 303725022      734925        syn-C2H3C(O)NH2, v=0
  161975.2365  0.0670 -6.8023 3 1222.1388145  71510 303725023      734924        syn-C2H3C(O)NH2, v=0
  161984.3938  0.0409 -6.5695 3 1403.7504187  71510 303933855      923954        syn-C2H3C(O)NH2, v=0
  161984.3938  0.0409 -6.5695 3 1403.7504187  71510 303933856      923953        syn-C2H3C(O)NH2, v=0
  161985.0016  0.0041 -4.2904 3  680.5888139  71510 303691950      691851        syn-C2H3C(O)NH2, v=0
  162000.7610  0.0154 -6.0446 3  719.9604107  71510 303534013      543916        syn-C2H3C(O)NH2, v=0
  162000.7610  0.0154 -6.0446 3  719.9604107  71510 303534014      543915        syn-C2H3C(O)NH2, v=0
  162012.8689  0.0200 -3.9117 3   70.2973 37 -71510 3031812 6      1811 7        syn-C2H3C(O)NH2, v=0
  162012.8689  0.0200 -3.9117 3   70.2973 37 -71510 3031812 7      1811 8        syn-C2H3C(O)NH2, v=0
  162022.8968  0.0019 -4.9875 3  588.9864125  71510 303622241      612338        syn-C2H3C(O)NH2, v=0
  162024.0572  0.0019 -4.9875 3  588.9864125  71510 303622240      612339        syn-C2H3C(O)NH2, v=0
  162025.6177  0.0278 -6.8729 3  968.3065173  71510 303861472      871375        syn-C2H3C(O)NH2, v=0
  162025.6568  0.0278 -6.8729 3  968.3065173  71510 303861572      871275        syn-C2H3C(O)NH2, v=0
  162062.6820  0.0291 -6.9779 3  845.9101155  71510 303772156      781861        syn-C2H3C(O)NH2, v=0
  162139.4836  0.0200 -4.6508 3  402.7025105 -71510 303521735      511834        syn-C2H3C(O)NH2, v=0
  162212.1891  0.0010 -5.7359 3   85.0194 45  71510 303221112      211111        syn-C2H3C(O)NH2, v=0
  162212.2811  0.0010 -5.7359 3   85.0194 45  71510 303221111      211110        syn-C2H3C(O)NH2, v=0
  162213.2304  0.0200 -3.9612 3   65.8904 35 -71510 3031712 5      1711 6        syn-C2H3C(O)NH2, v=0
  162213.2304  0.0200 -3.9612 3   65.8904 35 -71510 3031712 6      1711 7        syn-C2H3C(O)NH2, v=0
  162249.4439  0.0200 -4.5939 3  369.7841101 -71510 303501635      491732        syn-C2H3C(O)NH2, v=0
  162299.8023  0.0053 -6.8027 3  116.7185 65  71510 30332 230      33 133        syn-C2H3C(O)NH2, v=0
  162299.8358  0.0053 -6.8027 3  116.7185 65  71510 30332 330      33 033        syn-C2H3C(O)NH2, v=0
  162301.6447  0.0023 -5.0634 3  630.5722129  71510 303642342      632439        syn-C2H3C(O)NH2, v=0
  162302.0354  0.0023 -5.0634 3  630.5722129  71510 303642341      632440        syn-C2H3C(O)NH2, v=0
  162355.3981  0.0070 -6.4182 3  672.0455145  71510 303721161      731064        syn-C2H3C(O)NH2, v=0
  162355.4727  0.0070 -6.4182 3  672.0455145  71510 303721261      73 964        syn-C2H3C(O)NH2, v=0
  162373.2858  0.0200 -3.7353 3  285.4072 89 -71510 303441430      441331        syn-C2H3C(O)NH2, v=0
  162381.8854  0.0200 -4.0227 3   61.7325 33 -71510 3031612 4      1611 5        syn-C2H3C(O)NH2, v=0
  162381.8854  0.0200 -4.0227 3   61.7325 33 -71510 3031612 5      1611 6        syn-C2H3C(O)NH2, v=0
  162406.4468  0.0050 -6.3670 3  437.0469109  71510 303541837      551540        syn-C2H3C(O)NH2, v=0
  162427.5770  0.0030 -4.6393 3  269.6652 89  71510 303441134      431231        syn-C2H3C(O)NH2, v=0
  162458.7099  0.0200 -4.4530 3  279.7434 89 -71510 303441332      431429        syn-C2H3C(O)NH2, v=0
  162522.4887  0.0200 -4.1013 3   57.8228 31 -71510 3031512 3      1511 4        syn-C2H3C(O)NH2, v=0
  162522.4887  0.0200 -4.1013 3   57.8228 31 -71510 3031512 4      1511 5        syn-C2H3C(O)NH2, v=0
  162525.5952  0.0200 -3.7921 3  339.2800 99 -71510 303491337      491238        syn-C2H3C(O)NH2, v=0
  162535.6477  0.0033 -6.1536 3  292.8081 61  71510 3033028 2      3127 5        syn-C2H3C(O)NH2, v=0
  162535.6477  0.0033 -6.1536 3  292.8081 61  71510 3033028 3      3127 4        syn-C2H3C(O)NH2, v=0
  162595.6507  0.0015 -3.8806 3   47.3623 39  71510 30319 515      18 414        syn-C2H3C(O)NH2, v=0
  162617.7946  0.0014 -4.5398 3  338.3155 97  71510 303481534      471631        syn-C2H3C(O)NH2, v=0
  162631.5557  0.0046 -4.9167 3  346.3672101  71510 303501239      491336        syn-C2H3C(O)NH2, v=0
  162637.4228  0.0028 -5.1422 3  673.5984133  71510 303662443      652540        syn-C2H3C(O)NH2, v=0
  162637.5527  0.0028 -5.1422 3  673.5984133  71510 303662442      652541        syn-C2H3C(O)NH2, v=0
  162638.5026  0.0200 -4.2073 3   54.1606 29 -71510 3031412 2      1411 3        syn-C2H3C(O)NH2, v=0
  162638.5026  0.0200 -4.2073 3   54.1606 29 -71510 3031412 3      1411 4        syn-C2H3C(O)NH2, v=0
  162640.8574  0.0035 -6.6210 3   80.1377 45  71510 303221013      23 716        syn-C2H3C(O)NH2, v=0
  162690.8928  0.0474 -6.6923 3 1467.7764191  71510 303953956      944055        syn-C2H3C(O)NH2, v=0
  162690.8928  0.0474 -6.6923 3 1467.7764191  71510 303953957      944054        syn-C2H3C(O)NH2, v=0
  162703.0714  0.0014 -6.9636 3  253.6105 87  71510 303431034      43 835        syn-C2H3C(O)NH2, v=0
  162709.6898  0.0010 -5.6987 3   80.1354 45  71510 303221013      211012        syn-C2H3C(O)NH2, v=0
  162711.6827  0.0010 -5.6987 3   80.1355 45  71510 303221012      211011        syn-C2H3C(O)NH2, v=0
  162718.9245  0.0130 -5.9945 3  675.8225103  71510 303513912      523815        syn-C2H3C(O)NH2, v=0
  162718.9245  0.0130 -5.9945 3  675.8225103  71510 303513913      523814        syn-C2H3C(O)NH2, v=0
  162723.5627  0.0200 -4.3988 3  242.2917 83 -71510 303411229      401328        syn-C2H3C(O)NH2, v=0
  162733.0592  0.0200 -4.3636 3   50.7454 27 -71510 3031312 1      1311 2        syn-C2H3C(O)NH2, v=0
  162733.0592  0.0200 -4.3636 3   50.7454 27 -71510 3031312 2      1311 3        syn-C2H3C(O)NH2, v=0
  162766.7185  0.0590 -6.7030 3 1164.1719141  71510 303704921      714824        syn-C2H3C(O)NH2, v=0
  162766.7185  0.0590 -6.7030 3 1164.1719141  71510 303704922      714823        syn-C2H3C(O)NH2, v=0
  162800.5638  0.0200 -4.5908 3  369.7831101 -71510 303501634      491733        syn-C2H3C(O)NH2, v=0
  162809.0300  0.0011 -4.6435 3   47.5765 25  71510 3031212 0      1211 1        syn-C2H3C(O)NH2, v=0
  162809.0300  0.0011 -4.6435 3   47.5765 25  71510 3031212 1      1211 2        syn-C2H3C(O)NH2, v=0
  162817.6572  0.0200 -3.6724 3  207.5429 75 -71510 303371325      371226        syn-C2H3C(O)NH2, v=0
  162838.8133  0.0200 -4.4914 3  308.3001 93 -71510 303461433      451530        syn-C2H3C(O)NH2, v=0
  162889.4346  0.0028 -6.5169 3   85.8130 47  71510 303231013      24 718        syn-C2H3C(O)NH2, v=0
  162988.0874  0.0016 -6.3110 3   13.9233 21  71510 30310 5 6      10 2 9        syn-C2H3C(O)NH2, v=0
  163004.0863  0.0018 -4.3342 3   21.0929 27  71510 30313 4 9      12 310        syn-C2H3C(O)NH2, v=0
  163021.6753  0.0035 -5.2241 3  718.0642137  71510 303682544      672641        syn-C2H3C(O)NH2, v=0
  163021.7180  0.0035 -5.2241 3  718.0642137  71510 303682543      672642        syn-C2H3C(O)NH2, v=0
  163093.2063  0.0017 -5.6898 3   25.3520 27  71510 30313 6 7      13 310        syn-C2H3C(O)NH2, v=0
  163129.8469  0.0013 -7.0125 3  280.9151 91  71510 303451135      45 936        syn-C2H3C(O)NH2, v=0
  163137.7687  0.0032 -6.3655 3  265.4631 57  71510 3032827 1      2926 4        syn-C2H3C(O)NH2, v=0
  163137.7687  0.0032 -6.3655 3  265.4631 57  71510 3032827 2      2926 3        syn-C2H3C(O)NH2, v=0
  163141.6140  0.0009 -5.5863 3   62.5704 45  71510 30322 418      21 417        syn-C2H3C(O)NH2, v=0
  163186.1674  0.0020 -6.9413 3  135.1103 67  71510 30333 429      33 430        syn-C2H3C(O)NH2, v=0
  163186.6777  0.0020 -3.8436 3  135.1102 67  71510 30333 429      33 330        syn-C2H3C(O)NH2, v=0
  163193.2566  0.0024 -4.3372 3   84.8815 57  71510 30328 127      28 028        syn-C2H3C(O)NH2, v=0
  163193.2697  0.0024 -4.3372 3   84.8815 57  71510 30328 227      28 128        syn-C2H3C(O)NH2, v=0
  163196.8612  0.0020 -3.8435 3  135.1103 67  71510 30333 529      33 430        syn-C2H3C(O)NH2, v=0
  163197.3714  0.0020 -6.9413 3  135.1102 67  71510 30333 529      33 330        syn-C2H3C(O)NH2, v=0
  163201.0656  0.0015 -3.7311 3  227.4787 83  71510 30341 933      41 834        syn-C2H3C(O)NH2, v=0
  163357.6971  0.0012 -5.6097 3   60.8046 43  71510 30321 615      20 614        syn-C2H3C(O)NH2, v=0
  163395.2032  0.0010 -5.6650 3   75.7540 45  71510 30322 914      21 913        syn-C2H3C(O)NH2, v=0
  163407.0592  0.0545 -6.8181 3 1533.2258195  71510 303974057      964156        syn-C2H3C(O)NH2, v=0
  163407.0592  0.0545 -6.8181 3 1533.2258195  71510 303974058      964155        syn-C2H3C(O)NH2, v=0
  163427.3018  0.0010 -5.6648 3   75.7548 45  71510 30322 913      21 912        syn-C2H3C(O)NH2, v=0
  163428.2587  0.0109 -5.9517 3  633.1210 99  71510 303493811      503714        syn-C2H3C(O)NH2, v=0
  163428.2587  0.0109 -5.9517 3  633.1210 99  71510 303493812      503713        syn-C2H3C(O)NH2, v=0
  163431.5376  0.0015 -6.9254 3  227.4710 83  71510 30341 933      41 734        syn-C2H3C(O)NH2, v=0
  163445.3772  0.0016 -6.9047 3  202.5323 79  71510 30339 732      39 733        syn-C2H3C(O)NH2, v=0
  163447.5290  0.0045 -5.3089 3  763.9685141  71510 303702645      692742        syn-C2H3C(O)NH2, v=0
  163447.5429  0.0045 -5.3089 3  763.9685141  71510 303702644      692743        syn-C2H3C(O)NH2, v=0
  163454.7283  0.0235 -7.0117 3  931.4958161  71510 303802456      812161        syn-C2H3C(O)NH2, v=0
  163481.8616  0.0036 -5.2302 3   38.6991 35  71510 30317 512      17 215        syn-C2H3C(O)NH2, v=0
  163487.4473  0.0036 -6.1470 3  249.4123 91  71510 30345 540      46 443        syn-C2H3C(O)NH2, v=0
  163487.5373  0.0036 -6.1470 3  249.4123 91  71510 30345 640      46 343        syn-C2H3C(O)NH2, v=0
  163507.4157  0.0016 -3.7371 3  202.5302 79  71510 30339 732      39 633        syn-C2H3C(O)NH2, v=0
  163514.2903  0.0200 -3.7002 3   68.1826 47 -71510 30323 419      22 518        syn-C2H3C(O)NH2, v=0
  163532.4497  0.0058 -5.1117 3  418.5013111  71510 303551343      541440        syn-C2H3C(O)NH2, v=0
  163550.6696  0.0518 -6.6082 3 1107.6320137  71510 303684820      694723        syn-C2H3C(O)NH2, v=0
  163550.6696  0.0518 -6.6082 3 1107.6320137  71510 303684821      694722        syn-C2H3C(O)NH2, v=0
  163711.4105  0.0009 -5.4619 3    9.3408 19  71510 303 9 4 6       8 1 7        syn-C2H3C(O)NH2, v=0
  163723.0353  0.0015 -3.8272 3   52.2378 41  71510 30320 516      19 415        syn-C2H3C(O)NH2, v=0
  163726.6384  0.0031 -6.7545 3  239.5617 53  71510 3032626 0      2725 3        syn-C2H3C(O)NH2, v=0
  163726.6384  0.0031 -6.7545 3  239.5617 53  71510 3032626 1      2725 2        syn-C2H3C(O)NH2, v=0
  163739.5430  0.0200 -3.6669 3  198.2767 73 -71510 303361323      361224        syn-C2H3C(O)NH2, v=0
  163799.2438  0.0039 -6.2174 3  508.9429127  71510 30363 954      64 857        syn-C2H3C(O)NH2, v=0
  163799.3318  0.0039 -6.2174 3  508.9429127  71510 303631054      64 757        syn-C2H3C(O)NH2, v=0
  163808.7431  0.0039 -4.0756 3  540.0739125  71510 303621547      621448        syn-C2H3C(O)NH2, v=0
  163909.4245  0.0057 -5.3967 3  811.3102145  71510 303722746      712843        syn-C2H3C(O)NH2, v=0
  163909.4290  0.0057 -5.3967 3  811.3102145  71510 303722745      712844        syn-C2H3C(O)NH2, v=0
  164023.0063  0.0014 -4.5319 3  338.3127 97  71510 303481533      471632        syn-C2H3C(O)NH2, v=0
  164062.4183  0.0009 -5.5966 3   65.6187 45  71510 30322 617      21 616        syn-C2H3C(O)NH2, v=0
  164086.8900  0.0018 -6.9053 3  156.3329 71  71510 30335 530      35 531        syn-C2H3C(O)NH2, v=0
  164087.2196  0.0073 -6.4631 3  480.9380117  71510 303581642      591347        syn-C2H3C(O)NH2, v=0
  164089.8946  0.0018 -3.7860 3  156.3328 71  71510 30335 530      35 431        syn-C2H3C(O)NH2, v=0
  164119.1537  0.0200 -3.7340 3  202.5323 79 -71510 30339 832      39 733        syn-C2H3C(O)NH2, v=0
  164128.5242  0.0091 -5.9168 3  591.8566 95  71510 303473710      483613        syn-C2H3C(O)NH2, v=0
  164128.5242  0.0091 -5.9168 3  591.8566 95  71510 303473711      483612        syn-C2H3C(O)NH2, v=0
  164132.4174  0.0625 -6.9469 3 1600.0973199  71510 303994158      984257        syn-C2H3C(O)NH2, v=0
  164132.4174  0.0625 -6.9469 3 1600.0973199  71510 303994159      984256        syn-C2H3C(O)NH2, v=0
  164135.9757  0.0018 -3.7857 3  156.3329 71  71510 30335 630      35 531        syn-C2H3C(O)NH2, v=0
  164138.9803  0.0018 -6.9051 3  156.3328 71  71510 30335 630      35 431        syn-C2H3C(O)NH2, v=0
  164160.9136  0.0200 -3.7701 3  332.2877 97 -71510 303481435      481336        syn-C2H3C(O)NH2, v=0
  164181.1952  0.0016 -6.9011 3  202.5302 79  71510 30339 832      39 633        syn-C2H3C(O)NH2, v=0
  164229.5569  0.0025 -6.1905 3  198.2603 73  71510 303361323      371028        syn-C2H3C(O)NH2, v=0
  164251.2445  0.0030 -6.1142 3  368.0490109  71510 30354 747      55 650        syn-C2H3C(O)NH2, v=0
  164251.3399  0.0030 -6.1142 3  368.0490109  71510 30354 847      55 550        syn-C2H3C(O)NH2, v=0
  164257.3702  0.0017 -6.8943 3  178.8118 75  71510 30337 631      37 632        syn-C2H3C(O)NH2, v=0
  164272.0805  0.0017 -3.7520 3  178.8114 75  71510 30337 631      37 532        syn-C2H3C(O)NH2, v=0
  164291.5976  0.0010 -5.6343 3   71.8896 45  71510 30322 815      21 814        syn-C2H3C(O)NH2, v=0
  164303.4867  0.0019 -4.4862 3  247.7196 85  71510 303421132      411229        syn-C2H3C(O)NH2, v=0
  164326.9906  0.0453 -6.5179 3 1052.5203133  71510 303664719      674622        syn-C2H3C(O)NH2, v=0
  164326.9906  0.0453 -6.5179 3 1052.5203133  71510 303664720      674621        syn-C2H3C(O)NH2, v=0
  164334.7165  0.0200 -3.7841 3  344.7013 99 -71510 303491436      491337        syn-C2H3C(O)NH2, v=0
  164354.5850  0.0200 -3.6637 3  198.2539 73 -71510 303361324      361225        syn-C2H3C(O)NH2, v=0
  164402.8269  0.0072 -5.4875 3  860.0885149  71510 303742847      732944        syn-C2H3C(O)NH2, v=0
  164402.8283  0.0072 -5.4875 3  860.0885149  71510 303742846      732945        syn-C2H3C(O)NH2, v=0
  164419.4045  0.0009 -5.5899 3   59.0510 43  71510 30321 516      20 515        syn-C2H3C(O)NH2, v=0
  164451.3448  0.0017 -3.7510 3  178.8118 75  71510 30337 731      37 632        syn-C2H3C(O)NH2, v=0
  164459.6497  0.0083 -4.3685 3  731.2627145  71510 303721854      721755        syn-C2H3C(O)NH2, v=0
  164464.3686  0.0644 -7.0068 3 1340.9137197  71510 303982375      972672        syn-C2H3C(O)NH2, v=0
  164466.0550  0.0017 -6.8933 3  178.8114 75  71510 30337 731      37 532        syn-C2H3C(O)NH2, v=0
  164485.2978  0.0017 -3.8598 3   76.7969 49  71510 30324 519      23 618        syn-C2H3C(O)NH2, v=0
  164501.7610  0.0063 -6.4261 3  184.2974 73  71510 303361026      37 731        syn-C2H3C(O)NH2, v=0
  164623.5710  0.0008 -3.7217 3   18.3942 17  71510 303 8 8 1       7 7 0        syn-C2H3C(O)NH2, v=0
  164623.5711  0.0008 -3.7217 3   18.3942 17  71510 303 8 8 0       7 7 1        syn-C2H3C(O)NH2, v=0
  164631.2471  0.0114 -6.5549 3  770.8730155  71510 303771265      781168        syn-C2H3C(O)NH2, v=0
  164631.2967  0.0114 -6.5549 3  770.8730155  71510 303771365      781068        syn-C2H3C(O)NH2, v=0
  164635.2076  0.0200 -3.7547 3  320.1207 95 -71510 303471434      471335        syn-C2H3C(O)NH2, v=0
  164656.9700  0.0010 -5.6324 3   71.9015 45  71510 30322 814      21 813        syn-C2H3C(O)NH2, v=0
  164819.4593  0.0076 -5.8909 3  552.0300 91  71510 3034536 9      463512        syn-C2H3C(O)NH2, v=0
  164819.4593  0.0076 -5.8909 3  552.0300 91  71510 303453610      463511        syn-C2H3C(O)NH2, v=0
  164848.5538  0.0200 -3.8623 3   22.0836 25 -71510 30312 6 7      11 5 6        syn-C2H3C(O)NH2, v=0
  164873.3848  0.0017 -6.9608 3  264.2919 89  71510 30344 935      44 936        syn-C2H3C(O)NH2, v=0
  164908.6903  0.0024 -4.5465 3  258.5281 87  71510 303431133      421230        syn-C2H3C(O)NH2, v=0
  164924.0040  0.0089 -5.5814 3  910.3022153  71510 303762948      753045        syn-C2H3C(O)NH2, v=0
  164924.0044  0.0089 -5.5814 3  910.3022153  71510 303762947      753046        syn-C2H3C(O)NH2, v=0
  164942.1613  0.0072 -6.6488 3  118.3943 59  71510 30329 821      30 526        syn-C2H3C(O)NH2, v=0
  164959.9197  0.0043 -6.3032 3  376.7851101  71510 303501734      511437        syn-C2H3C(O)NH2, v=0
  164964.6213  0.0032 -4.1332 3  587.7264129  71510 303641846      641747        syn-C2H3C(O)NH2, v=0
  164980.8062  0.0010 -5.6089 3   68.5435 45  71510 30322 716      21 715        syn-C2H3C(O)NH2, v=0
  165015.2305  0.0200 -3.7862 3   19.4794 21 -71510 30310 7 4       9 6 3        syn-C2H3C(O)NH2, v=0
  165016.4228  0.0200 -3.7862 3   19.4794 21 -71510 30310 7 3       9 6 4        syn-C2H3C(O)NH2, v=0
  165025.6021  0.0027 -4.3063 3  184.2799 73  71510 303361026      351125        syn-C2H3C(O)NH2, v=0
  165095.5721  0.0394 -6.4323 3  998.8378129  71510 303644618      654521        syn-C2H3C(O)NH2, v=0
  165095.5721  0.0394 -6.4323 3  998.8378129  71510 303644619      654520        syn-C2H3C(O)NH2, v=0
  165100.4279  0.0116 -5.6466 3  657.8120139  71510 303691654      681751        syn-C2H3C(O)NH2, v=0
  165217.7911  0.0200 -3.8609 3   22.0728 25 -71510 30312 6 6      11 5 7        syn-C2H3C(O)NH2, v=0
  165266.2048  0.0200 -3.7962 3  357.3541101 -71510 303501437      501338        syn-C2H3C(O)NH2, v=0
  165295.9115  0.0159 -6.8579 3  842.5706153  71510 303762353      772058        syn-C2H3C(O)NH2, v=0
  165327.7416  0.0016 -3.7432 3  264.2768 89  71510 30344 935      44 836        syn-C2H3C(O)NH2, v=0
  165384.7920  0.0071 -4.8145 3 1000.2505169  71510 303842262      842163        syn-C2H3C(O)NH2, v=0
  165454.4626  0.0200 -3.6584 3  189.2457 71 -71510 303351322      351223        syn-C2H3C(O)NH2, v=0
  165469.8592  0.0110 -5.6783 3  961.9504157  71510 303783049      773146        syn-C2H3C(O)NH2, v=0
  165469.8594  0.0110 -5.6783 3  961.9504157  71510 303783048      773147        syn-C2H3C(O)NH2, v=0
  165500.7780  0.0064 -5.8752 3  513.6421 87  71510 3034335 8      443411        syn-C2H3C(O)NH2, v=0
  165500.7780  0.0064 -5.8752 3  513.6421 87  71510 3034335 9      443410        syn-C2H3C(O)NH2, v=0
  165550.5467  0.0013 -3.7693 3   57.3107 43  71510 30321 517      20 416        syn-C2H3C(O)NH2, v=0
  165618.4831  0.0037 -6.4556 3  109.0935 53  71510 303261116      27 819        syn-C2H3C(O)NH2, v=0
  165627.9464  0.0200 -3.7383 3  308.2071 93 -71510 303461433      461334        syn-C2H3C(O)NH2, v=0
  165630.4441  0.0042 -6.2421 3  202.9783 83  71510 30341 437      42 340        syn-C2H3C(O)NH2, v=0
  165630.5016  0.0042 -6.2421 3  202.9783 83  71510 30341 537      42 240        syn-C2H3C(O)NH2, v=0
  165733.6314  0.0023 -4.0622 3  102.8577 61  71510 30330 228      30 129        syn-C2H3C(O)NH2, v=0
  165733.7656  0.0023 -4.0622 3  102.8577 61  71510 30330 328      30 229        syn-C2H3C(O)NH2, v=0
  165755.9346  0.0042 -5.7019 3   28.5580 31  71510 30315 411      15 114        syn-C2H3C(O)NH2, v=0
  165786.4955  0.0200 -3.6567 3  189.2335 71 -71510 303351323      351224        syn-C2H3C(O)NH2, v=0
  165856.2938  0.0342 -6.3516 3  946.5855125  71510 303624517      634420        syn-C2H3C(O)NH2, v=0
  165856.2938  0.0342 -6.3516 3  946.5855125  71510 303624518      634419        syn-C2H3C(O)NH2, v=0
  165876.2009  0.0024 -4.7844 3   16.4402 25  71510 30312 3 9      11 210        syn-C2H3C(O)NH2, v=0
  166021.0418  0.1442 -6.8650 3 1271.7064193  71510 303962275      952372        syn-C2H3C(O)NH2, v=0
  166037.8038  0.0135 -5.7782 3 1015.0319161  71510 303803149      793248        syn-C2H3C(O)NH2, v=0
  166037.8038  0.0135 -5.7782 3 1015.0319161  71510 303803150      793247        syn-C2H3C(O)NH2, v=0
  166172.1684  0.0055 -5.8714 3  476.6936 83  71510 3034134 7      423310        syn-C2H3C(O)NH2, v=0
  166172.1684  0.0055 -5.8714 3  476.6936 83  71510 3034134 8      4233 9        syn-C2H3C(O)NH2, v=0
  166189.9524  0.0200 -3.7687 3  321.4369 97 -71510 303481237      481138        syn-C2H3C(O)NH2, v=0
  166274.0948  0.0200 -4.4721 3  308.2925 93 -71510 303461432      451531        syn-C2H3C(O)NH2, v=0
  166302.4305  0.0027 -6.8376 3   55.3967 37  71510 30318 9 9      19 614        syn-C2H3C(O)NH2, v=0
  166321.3728  0.0082 -4.5804 3  866.0594157  71510 303782157      782058        syn-C2H3C(O)NH2, v=0
  166372.4672  0.0015 -3.7917 3  350.6274 99  71510 303491534      491435        syn-C2H3C(O)NH2, v=0
  166376.4565  0.0721 -6.4168 3 1045.0186175  71510 303872068      862165        syn-C2H3C(O)NH2, v=0
  166408.9666  0.0025 -6.1682 3  242.6042 81  71510 303401426      411131        syn-C2H3C(O)NH2, v=0
  166451.7063  0.0051 -6.3112 3  595.5745137  71510 303681058      69 961        syn-C2H3C(O)NH2, v=0
  166451.7664  0.0051 -6.3112 3  595.5745137  71510 303681158      69 861        syn-C2H3C(O)NH2, v=0
  166469.4774  0.0311 -6.9710 3  871.6073155  71510 303772454      782157        syn-C2H3C(O)NH2, v=0
  166480.4820  0.0025 -3.9904 3   92.0671 53  71510 30326 620      25 719        syn-C2H3C(O)NH2, v=0
  166504.5871  0.0200 -3.7071 3  274.1894 87 -71510 303431429      431330        syn-C2H3C(O)NH2, v=0
  166539.2909  0.0025 -6.5010 3   14.4281 23  71510 30311 4 8      11 111        syn-C2H3C(O)NH2, v=0
  166606.7221  0.0299 -6.0091 3  840.3527157  71510 303781861      771958        syn-C2H3C(O)NH2, v=0
  166609.0235  0.0295 -6.2761 3  895.7645121  71510 303604416      614319        syn-C2H3C(O)NH2, v=0
  166609.0235  0.0295 -6.2761 3  895.7645121  71510 303604417      614318        syn-C2H3C(O)NH2, v=0
  166625.6585  0.0163 -5.8812 3 1069.5458165  71510 303823250      813349        syn-C2H3C(O)NH2, v=0
  166625.6585  0.0163 -5.8812 3 1069.5458165  71510 303823251      813348        syn-C2H3C(O)NH2, v=0
  166658.7209  0.0200 -3.2885 3   73.5612 55 -71510 30327 027      26 126        syn-C2H3C(O)NH2, v=0
  166658.7295  0.0010 -5.4787 3   73.5612 55  71510 30327 127      26 126        syn-C2H3C(O)NH2, v=0
  166658.7298  0.0010 -5.4787 3   73.5612 55  71510 30327 027      26 026        syn-C2H3C(O)NH2, v=0
  166658.7209  0.0200 -3.2885 3   73.5612 55 -71510 30327 127      26 026        syn-C2H3C(O)NH2, v=0
  166660.9291  0.0200 -3.3529 3   73.0413 53 -71510 30326 125      25 224        syn-C2H3C(O)NH2, v=0
  166660.9043  0.0010 -5.5002 3   73.0413 53  71510 30326 225      25 224        syn-C2H3C(O)NH2, v=0
  166660.9651  0.0010 -5.5002 3   73.0413 53  71510 30326 125      25 124        syn-C2H3C(O)NH2, v=0
  166660.9291  0.0200 -3.3529 3   73.0413 53 -71510 30326 225      25 124        syn-C2H3C(O)NH2, v=0
  166700.6208  0.0200 -3.5293 3   70.3792 49 -71510 30324 321      23 420        syn-C2H3C(O)NH2, v=0
  166708.0353  0.0200 -3.4298 3   71.9926 51 -71510 30325 223      24 322        syn-C2H3C(O)NH2, v=0
  166712.2857  0.0009 -5.5211 3   71.9926 51  71510 30325 323      24 322        syn-C2H3C(O)NH2, v=0
  166715.0131  0.0009 -5.5608 3   68.1826 47  71510 30323 519      22 518        syn-C2H3C(O)NH2, v=0
  166716.3157  0.0009 -5.5210 3   71.9923 51  71510 30325 223      24 222        syn-C2H3C(O)NH2, v=0
  166720.5590  0.0200 -3.4297 3   71.9923 51 -71510 30325 323      24 222        syn-C2H3C(O)NH2, v=0
  166747.7762  0.0200 -3.7928 3  351.7920101 -71510 303501338      501239        syn-C2H3C(O)NH2, v=0
  166759.9133  0.0188 -6.7120 3  876.3932165  71510 303821369      831272        syn-C2H3C(O)NH2, v=0
  166759.9460  0.0188 -6.7120 3  876.3932165  71510 303821469      831172        syn-C2H3C(O)NH2, v=0
  166833.2904  0.0048 -5.8819 3  441.1849 79  71510 3033933 6      4032 9        syn-C2H3C(O)NH2, v=0
  166833.2904  0.0048 -5.8819 3  441.1849 79  71510 3033933 7      4032 8        syn-C2H3C(O)NH2, v=0
  166856.0107  0.0106 -6.7178 3  758.0880145  71510 303722250      731955        syn-C2H3C(O)NH2, v=0
  166862.9638  0.0009 -5.5406 3   70.3792 49  71510 30324 421      23 420        syn-C2H3C(O)NH2, v=0
  166897.9060  0.0059 -6.3499 3  315.4233 95  71510 303471334      481039        syn-C2H3C(O)NH2, v=0
  166903.0347  0.0037 -6.2601 3  320.9904 93  71510 303461631      471334        syn-C2H3C(O)NH2, v=0
  166927.6983  0.0200 -3.6523 3  180.4868 69 -71510 303341321      341222        syn-C2H3C(O)NH2, v=0
  166993.4060  0.0009 -5.5399 3   70.3695 49  71510 30324 321      23 320        syn-C2H3C(O)NH2, v=0
  167002.6739  0.0200 -3.7214 3  296.5528 91 -71510 303451432      451333        syn-C2H3C(O)NH2, v=0
  167032.7617  0.0200 -3.8062 3  370.2386103 -71510 303511438      511339        syn-C2H3C(O)NH2, v=0
  167051.9033  0.0078 -4.7699 3  978.1307167  71510 303832261      832162        syn-C2H3C(O)NH2, v=0
  167083.1398  0.0200 -3.7456 3  292.2697 93 -71510 303461136      461037        syn-C2H3C(O)NH2, v=0
  167096.3884  0.0016 -5.4004 3    9.9758 21  71510 30310 3 8       9 0 9        syn-C2H3C(O)NH2, v=0
  167101.7295  0.0200 -3.6515 3  180.4805 69 -71510 303341322      341223        syn-C2H3C(O)NH2, v=0
  167155.7264  0.0200 -3.5268 3   70.3695 49 -71510 30324 421      23 320        syn-C2H3C(O)NH2, v=0
  167177.5696  0.0031 -6.1109 3  311.5779101  71510 30350 644      51 547        syn-C2H3C(O)NH2, v=0
  167177.6380  0.0031 -6.1109 3  311.5779101  71510 30350 744      51 447        syn-C2H3C(O)NH2, v=0
  167231.5776  0.0195 -5.9872 3 1125.4910169  71510 303843351      833450        syn-C2H3C(O)NH2, v=0
  167231.5776  0.0195 -5.9872 3 1125.4910169  71510 303843352      833449        syn-C2H3C(O)NH2, v=0
  167236.0345  0.0173 -4.7240 3  950.6562165  71510 303822161      822062        syn-C2H3C(O)NH2, v=0
  167277.3589  0.0048 -6.4274 3  161.0687 75  71510 30337 334      38 237        syn-C2H3C(O)NH2, v=0
  167277.3921  0.0048 -6.4274 3  161.0687 75  71510 30337 434      38 137        syn-C2H3C(O)NH2, v=0
  167279.6790  0.0034 -3.9871 3  487.6286119  71510 303591445      591346        syn-C2H3C(O)NH2, v=0
  167353.6161  0.0253 -6.2060 3  846.3755117  71510 303584315      594218        syn-C2H3C(O)NH2, v=0
  167353.6161  0.0253 -6.2060 3  846.3755117  71510 303584316      594217        syn-C2H3C(O)NH2, v=0
  167359.5730  0.0200 -3.9942 3  501.7733119 -71510 303591742      591643        syn-C2H3C(O)NH2, v=0
  167361.1122  0.0034 -6.1547 3  442.4600119  71510 30359 851      60 754        syn-C2H3C(O)NH2, v=0
  167361.1800  0.0034 -6.1547 3  442.4600119  71510 30359 951      60 654        syn-C2H3C(O)NH2, v=0
  167459.0076  0.0019 -7.0023 3  303.7472 95  71510 303471037      471038        syn-C2H3C(O)NH2, v=0
  167483.7742  0.0043 -5.9102 3  407.1169 75  71510 3033732 5      3831 8        syn-C2H3C(O)NH2, v=0
  167483.7742  0.0043 -5.9102 3  407.1169 75  71510 3033732 6      3831 7        syn-C2H3C(O)NH2, v=0
  167562.7875  0.0011 -5.5952 3   68.6592 45  71510 30322 715      21 714        syn-C2H3C(O)NH2, v=0
  167565.7350  0.0037 -6.3456 3  142.5246 61  71510 303301219      31 922        syn-C2H3C(O)NH2, v=0
  167703.0718  0.0028 -6.3652 3  115.7134 55  71510 303271116      28 821        syn-C2H3C(O)NH2, v=0
  167801.2808  0.0012 -6.8219 3  175.8742 47  71510 3032322 1      2222 0        syn-C2H3C(O)NH2, v=0
  167801.2808  0.0012 -6.8219 3  175.8742 47  71510 3032322 2      2222 1        syn-C2H3C(O)NH2, v=0
  167814.5207  0.0021 -6.9918 3  122.1323 65  71510 30332 329      32 330        syn-C2H3C(O)NH2, v=0
  167814.5542  0.0021 -3.9167 3  122.1323 65  71510 30332 329      32 230        syn-C2H3C(O)NH2, v=0
  167815.1042  0.0025 -4.9275 3   50.0592 39  71510 30319 613      19 316        syn-C2H3C(O)NH2, v=0
  167815.5182  0.0021 -3.9167 3  122.1323 65  71510 30332 429      32 330        syn-C2H3C(O)NH2, v=0
  167815.5517  0.0021 -6.9918 3  122.1323 65  71510 30332 429      32 230        syn-C2H3C(O)NH2, v=0
  167853.9893  0.0233 -6.0962 3 1182.8663173  71510 303863452      853551        syn-C2H3C(O)NH2, v=0
  167853.9893  0.0233 -6.0962 3 1182.8663173  71510 303863453      853550        syn-C2H3C(O)NH2, v=0
  167861.3712  0.0084 -6.5427 3  548.9421125  71510 303621745      631450        syn-C2H3C(O)NH2, v=0
  167871.4525  0.0012 -6.5091 3  165.7261 47  71510 3032321 2      2221 1        syn-C2H3C(O)NH2, v=0
  167871.4525  0.0012 -6.5091 3  165.7261 47  71510 3032321 3      2221 2        syn-C2H3C(O)NH2, v=0
  167950.6745  0.0012 -6.3225 3  156.0515 47  71510 3032320 3      2220 2        syn-C2H3C(O)NH2, v=0
  167950.6745  0.0012 -6.3225 3  156.0515 47  71510 3032320 4      2220 3        syn-C2H3C(O)NH2, v=0
  167972.1995  0.0856 -6.9636 3 1323.6231151  71510 303755223      765126        syn-C2H3C(O)NH2, v=0
  167972.1995  0.0856 -6.9636 3 1323.6231151  71510 303755224      765125        syn-C2H3C(O)NH2, v=0
  167989.7183  0.0152 -4.8452 3 1022.5568171  71510 303852263      852164        syn-C2H3C(O)NH2, v=0
  168012.6543  0.0027 -6.1710 3  291.4185 89  71510 303441529      451234        syn-C2H3C(O)NH2, v=0
  168018.0412  0.0200 -3.8790 3  422.7424109 -71510 303541638      541539        syn-C2H3C(O)NH2, v=0
  168041.0205  0.0011 -6.1881 3  146.8510 47  71510 3032319 4      2219 3        syn-C2H3C(O)NH2, v=0
  168041.0205  0.0011 -6.1881 3  146.8510 47  71510 3032319 5      2219 4        syn-C2H3C(O)NH2, v=0
  168089.9129  0.0217 -6.1416 3  798.4197113  71510 303564214      574117        syn-C2H3C(O)NH2, v=0
  168089.9129  0.0217 -6.1416 3  798.4197113  71510 303564215      574116        syn-C2H3C(O)NH2, v=0
  168116.4174  0.0072 -6.5917 3  678.0521137  71510 303682147      691852        syn-C2H3C(O)NH2, v=0
  168123.2181  0.0039 -5.9616 3  374.4900 71  71510 3033531 4      3630 7        syn-C2H3C(O)NH2, v=0
  168123.2181  0.0039 -5.9616 3  374.4900 71  71510 3033531 5      3630 6        syn-C2H3C(O)NH2, v=0
  168145.1712  0.0011 -6.0830 3  138.1251 47  71510 3032318 5      2218 4        syn-C2H3C(O)NH2, v=0
  168145.1712  0.0011 -6.0830 3  138.1251 47  71510 3032318 6      2218 5        syn-C2H3C(O)NH2, v=0
  168191.2604  0.0035 -6.2395 3  269.6652 85  71510 303421528      431231        syn-C2H3C(O)NH2, v=0
  168201.3989  0.0018 -5.9239 3   21.9732 25  71510 30312 6 6      12 3 9        syn-C2H3C(O)NH2, v=0
  168209.3547  0.0200 -3.6485 3  171.9967 67 -71510 303331320      331221        syn-C2H3C(O)NH2, v=0
  168248.2554  0.0012 -3.7100 3   62.5704 45  71510 30322 518      21 417        syn-C2H3C(O)NH2, v=0
  168266.6446  0.0011 -5.9967 3  129.8744 47  71510 3032317 6      2217 5        syn-C2H3C(O)NH2, v=0
  168266.6446  0.0011 -5.9967 3  129.8744 47  71510 3032317 7      2217 6        syn-C2H3C(O)NH2, v=0
  168297.8752  0.0200 -3.6480 3  171.9935 67 -71510 303331321      331222        syn-C2H3C(O)NH2, v=0
  168311.6442  0.0018 -3.7620 3  303.7188 95  71510 303471037      47 938        syn-C2H3C(O)NH2, v=0
  168369.9394  0.0053 -6.8001 3  123.6921 67  71510 30333 231      34 134        syn-C2H3C(O)NH2, v=0
  168369.9558  0.0053 -6.8001 3  123.6921 67  71510 30333 331      34 034        syn-C2H3C(O)NH2, v=0
  168410.1373  0.0011 -5.9238 3  122.0999 47  71510 3032316 7      2216 6        syn-C2H3C(O)NH2, v=0
  168410.1373  0.0011 -5.9238 3  122.0999 47  71510 3032316 8      2216 7        syn-C2H3C(O)NH2, v=0
  168480.1621  0.0062 -4.3967 3  760.8106147  71510 303732053      731954        syn-C2H3C(O)NH2, v=0
  168488.4116  0.0013 -6.9905 3  292.2228 93  71510 303461136      46 937        syn-C2H3C(O)NH2, v=0
  168491.5482  0.0275 -6.2083 3 1241.6707177  71510 303883553      873652        syn-C2H3C(O)NH2, v=0
  168491.5482  0.0275 -6.2083 3 1241.6707177  71510 303883554      873651        syn-C2H3C(O)NH2, v=0
  168510.9061  0.0200 -4.4130 3  263.2753 87 -71510 303431232      421329        syn-C2H3C(O)NH2, v=0
  168523.8366  0.0200 -3.7275 3  264.2919 89 -71510 303441035      44 936        syn-C2H3C(O)NH2, v=0
  168574.2050  0.0015 -6.9105 3  237.5139 85  71510 30342 834      42 835        syn-C2H3C(O)NH2, v=0
  168582.0479  0.0010 -5.8610 3  114.8027 47  71510 3032315 8      2215 7        syn-C2H3C(O)NH2, v=0
  168582.0479  0.0010 -5.8610 3  114.8027 47  71510 3032315 9      2215 8        syn-C2H3C(O)NH2, v=0
  168588.5074  0.0037 -6.2778 3  180.4309 69  71510 303341322      351025        syn-C2H3C(O)NH2, v=0
  168620.9460  0.0009 -5.5497 3   68.0122 47  71510 30323 419      22 418        syn-C2H3C(O)NH2, v=0
  168628.8673  0.0200 -3.7045 3  285.1624 89 -71510 303441431      441332        syn-C2H3C(O)NH2, v=0
  168706.7515  0.0015 -3.7236 3  237.5095 85  71510 30342 834      42 735        syn-C2H3C(O)NH2, v=0
  168749.3759  0.0302 -6.8884 3  988.5987175  71510 303871473      881376        syn-C2H3C(O)NH2, v=0
  168749.3974  0.0302 -6.8884 3  988.5987175  71510 303871573      881276        syn-C2H3C(O)NH2, v=0
  168751.1871  0.0037 -6.0446 3  343.3049 67  71510 3033330 3      3429 6        syn-C2H3C(O)NH2, v=0
  168751.1871  0.0037 -6.0446 3  343.3049 67  71510 3033330 4      3429 5        syn-C2H3C(O)NH2, v=0
  168773.0700  0.0759 -6.8584 3 1263.2892147  71510 303735122      745025        syn-C2H3C(O)NH2, v=0
  168773.0700  0.0759 -6.8584 3 1263.2892147  71510 303735123      745024        syn-C2H3C(O)NH2, v=0
  168773.1610  0.0035 -6.2442 3  222.8115 77  71510 303381425      391128        syn-C2H3C(O)NH2, v=0
  168791.3026  0.0010 -5.8062 3  107.9844 47  71510 3032314 9      2214 8        syn-C2H3C(O)NH2, v=0
  168791.3026  0.0010 -5.8062 3  107.9844 47  71510 303231410      2214 9        syn-C2H3C(O)NH2, v=0
  168817.7397  0.0184 -6.0834 3  751.8979109  71510 303544113      554016        syn-C2H3C(O)NH2, v=0
  168817.7397  0.0184 -6.0834 3  751.8979109  71510 303544114      554015        syn-C2H3C(O)NH2, v=0
  168834.4279  0.0200 -4.2558 3  670.3013139 -71510 303691752      691653        syn-C2H3C(O)NH2, v=0
  168859.8098  0.0017 -6.1638 3   16.4402 23  71510 30311 5 7      11 210        syn-C2H3C(O)NH2, v=0
  168929.9603  0.0076 -6.4285 3  688.9121147  71510 303731162      741065        syn-C2H3C(O)NH2, v=0
  168930.0009  0.0076 -6.4285 3  688.9121147  71510 303731262      74 965        syn-C2H3C(O)NH2, v=0
  168978.1940  0.0014 -6.9413 3  264.2768 89  71510 303441035      44 836        syn-C2H3C(O)NH2, v=0
  169050.7206  0.0010 -5.7578 3  101.6472 47  71510 303231311      221310        syn-C2H3C(O)NH2, v=0
  169050.7210  0.0010 -5.7578 3  101.6472 47  71510 303231310      2213 9        syn-C2H3C(O)NH2, v=0
  169056.3498  0.0052 -6.4803 3  602.4670129  71510 303642044      651749        syn-C2H3C(O)NH2, v=0
  169095.5961  0.0029 -6.1959 3  344.7013 97  71510 303481632      491337        syn-C2H3C(O)NH2, v=0
  169143.0979  0.0323 -6.3234 3 1301.9029181  71510 303903654      893753        syn-C2H3C(O)NH2, v=0
  169143.0979  0.0323 -6.3234 3 1301.9029181  71510 303903655      893752        syn-C2H3C(O)NH2, v=0
  169198.8947  0.0163 -4.5997 3  881.2580159  71510 303792059      791960        syn-C2H3C(O)NH2, v=0
  169249.7794  0.0025 -4.3181 3   90.8448 59  71510 30329 128      29 029        syn-C2H3C(O)NH2, v=0
  169249.7857  0.0025 -4.3181 3   90.8448 59  71510 30329 228      29 129        syn-C2H3C(O)NH2, v=0
  169334.6278  0.0200 -3.6467 3  163.7727 65 -71510 303321319      321220        syn-C2H3C(O)NH2, v=0
  169367.2115  0.0035 -6.1751 3  313.5619 63  71510 3033129 2      3228 5        syn-C2H3C(O)NH2, v=0
  169367.2115  0.0035 -6.1751 3  313.5619 63  71510 3033129 3      3228 4        syn-C2H3C(O)NH2, v=0
  169378.2859  0.0200 -3.6464 3  163.7711 65 -71510 303321320      321221        syn-C2H3C(O)NH2, v=0
  169379.3903  0.0010 -5.7148 3   95.7942 47  71510 303231212      221211        syn-C2H3C(O)NH2, v=0
  169379.4002  0.0010 -5.7148 3   95.7942 47  71510 303231211      221210        syn-C2H3C(O)NH2, v=0
  169393.7582  0.0019 -6.9217 3  142.6922 69  71510 30334 430      34 431        syn-C2H3C(O)NH2, v=0
  169394.0177  0.0019 -3.8271 3  142.6922 69  71510 30334 430      34 331        syn-C2H3C(O)NH2, v=0
  169399.4472  0.0019 -3.8271 3  142.6922 69  71510 30334 530      34 431        syn-C2H3C(O)NH2, v=0
  169399.7067  0.0019 -6.9217 3  142.6922 69  71510 30334 530      34 331        syn-C2H3C(O)NH2, v=0
  169536.9062  0.0156 -6.0319 3  706.8110105  71510 303524012      533915        syn-C2H3C(O)NH2, v=0
  169536.9062  0.0156 -6.0319 3  706.8110105  71510 303524013      533914        syn-C2H3C(O)NH2, v=0
  169566.4080  0.0672 -6.7575 3 1204.3804143  71510 303715021      724924        syn-C2H3C(O)NH2, v=0
  169566.4080  0.0672 -6.7575 3 1204.3804143  71510 303715022      724923        syn-C2H3C(O)NH2, v=0
  169633.5287  0.0030 -3.9099 3  437.7553113  71510 303561343      561244        syn-C2H3C(O)NH2, v=0
  169652.4761  0.0042 -6.3841 3  531.3360121  71510 303601941      611646        syn-C2H3C(O)NH2, v=0
  169671.2584  0.0200 -3.8141 3  383.3474105 -71510 303521439      521340        syn-C2H3C(O)NH2, v=0
  169701.7303  0.0036 -6.1484 3  259.6171 93  71510 30346 541      47 444        syn-C2H3C(O)NH2, v=0
  169701.7768  0.0036 -6.1484 3  259.6171 93  71510 30346 641      47 344        syn-C2H3C(O)NH2, v=0
  169704.2714  0.0033 -6.2408 3  402.4502105  71510 303521735      531440        syn-C2H3C(O)NH2, v=0
  169807.0373  0.0010 -5.6762 3   90.4302 47  71510 303231113      221112        syn-C2H3C(O)NH2, v=0
  169807.2847  0.0010 -5.6762 3   90.4302 47  71510 303231112      221111        syn-C2H3C(O)NH2, v=0
  169807.6401  0.0377 -6.4415 3 1363.5619185  71510 303923755      913854        syn-C2H3C(O)NH2, v=0
  169807.6401  0.0377 -6.4415 3 1363.5619185  71510 303923756      913853        syn-C2H3C(O)NH2, v=0
  169844.9494  0.0014 -3.7180 3  237.5139 85  71510 30342 934      42 835        syn-C2H3C(O)NH2, v=0
  169857.5552  0.0200 -3.6840 3  263.2753 85 -71510 303421428      421329        syn-C2H3C(O)NH2, v=0
  169878.4421  0.0037 -6.3039 3  464.6628113  71510 303561838      571543        syn-C2H3C(O)NH2, v=0
  169921.8009  0.0042 -6.3860 3   19.6840 27  71510 30313 310      13 013        syn-C2H3C(O)NH2, v=0
  169970.7862  0.0034 -6.3860 3  285.2617 59  71510 3032928 1      3027 4        syn-C2H3C(O)NH2, v=0
  169970.7862  0.0034 -6.3860 3  285.2617 59  71510 3032928 2      3027 3        syn-C2H3C(O)NH2, v=0
  169971.4433  0.0032 -4.1639 3  134.2277 63  71510 30331 823      30 922        syn-C2H3C(O)NH2, v=0
  169977.4959  0.0014 -6.9038 3  237.5095 85  71510 30342 934      42 735        syn-C2H3C(O)NH2, v=0
  170124.4188  0.0021 -3.7964 3  345.7870101  71510 303501139      501040        syn-C2H3C(O)NH2, v=0
  170247.2045  0.0131 -5.9875 3  663.1598101  71510 303503911      513814        syn-C2H3C(O)NH2, v=0
  170247.2045  0.0131 -5.9875 3  663.1598101  71510 303503912      513813        syn-C2H3C(O)NH2, v=0
  170254.5911  0.0041 -6.2247 3  523.5898129  71510 30364 955      65 858        syn-C2H3C(O)NH2, v=0
  170254.6383  0.0041 -6.2247 3  523.5898129  71510 303641055      65 758        syn-C2H3C(O)NH2, v=0
  170279.5614  0.0016 -6.8825 3  211.9498 81  71510 30340 733      40 734        syn-C2H3C(O)NH2, v=0
  170314.1495  0.0015 -3.7219 3  211.9487 81  71510 30340 733      40 634        syn-C2H3C(O)NH2, v=0
  170328.6983  0.0200 -3.6469 3  155.8126 63 -71510 303311318      311219        syn-C2H3C(O)NH2, v=0
  170349.5482  0.0200 -3.6468 3  155.8118 63 -71510 303311319      311220        syn-C2H3C(O)NH2, v=0
  170352.1258  0.0592 -6.6610 3 1146.8979139  71510 303694920      704823        syn-C2H3C(O)NH2, v=0
  170352.1258  0.0592 -6.6610 3 1146.8979139  71510 303694921      704822        syn-C2H3C(O)NH2, v=0
  170381.5363  0.0010 -5.6414 3   85.5628 47  71510 303231014      221013        syn-C2H3C(O)NH2, v=0
  170386.2903  0.0010 -5.6414 3   85.5630 47  71510 303231013      221012        syn-C2H3C(O)NH2, v=0
  170391.6401  0.0200 -3.6882 3  274.0395 87 -71510 303431430      431331        syn-C2H3C(O)NH2, v=0
  170403.9594  0.0200 -4.4073 3  279.7231 89 -71510 303441331      431430        syn-C2H3C(O)NH2, v=0
  170410.6142  0.0018 -6.8856 3  164.5243 73  71510 30336 531      36 532        syn-C2H3C(O)NH2, v=0
  170412.1904  0.0018 -3.7705 3  164.5243 73  71510 30336 531      36 432        syn-C2H3C(O)NH2, v=0
  170437.6009  0.0018 -3.7703 3  164.5243 73  71510 30336 631      36 532        syn-C2H3C(O)NH2, v=0
  170439.1771  0.0018 -6.8855 3  164.5243 73  71510 30336 631      36 432        syn-C2H3C(O)NH2, v=0
  170484.3106  0.0438 -6.5627 3 1426.6463189  71510 303943856      933955        syn-C2H3C(O)NH2, v=0
  170484.3106  0.0438 -6.5627 3 1426.6463189  71510 303943857      933954        syn-C2H3C(O)NH2, v=0
  170561.3708  0.0033 -6.7743 3  258.4046 55  71510 3032727 0      2826 3        syn-C2H3C(O)NH2, v=0
  170561.3708  0.0033 -6.7743 3  258.4046 55  71510 3032727 1      2826 2        syn-C2H3C(O)NH2, v=0
  170584.4753  0.0031 -6.1186 3  380.4752111  71510 30355 748      56 651        syn-C2H3C(O)NH2, v=0
  170584.5256  0.0031 -6.1186 3  380.4752111  71510 30355 848      56 551        syn-C2H3C(O)NH2, v=0
  170598.0931  0.0025 -3.8459 3  390.4700107  71510 303531241      531142        syn-C2H3C(O)NH2, v=0
  170655.8334  0.0011 -4.0051 3   26.1464 29  71510 30314 5 9      13 410        syn-C2H3C(O)NH2, v=0
  170676.0040  0.0200 -3.7201 3  211.9498 81 -71510 30340 833      40 734        syn-C2H3C(O)NH2, v=0
  170710.5796  0.0015 -6.8804 3  211.9487 81  71510 30340 833      40 634        syn-C2H3C(O)NH2, v=0
  170766.7915  0.0016 -6.8739 3  187.6150 77  71510 30338 632      38 633        syn-C2H3C(O)NH2, v=0
  170774.7469  0.0016 -3.7370 3  187.6147 77  71510 30338 632      38 533        syn-C2H3C(O)NH2, v=0
  170877.0445  0.0016 -3.7365 3  187.6150 77  71510 30338 732      38 633        syn-C2H3C(O)NH2, v=0
  170877.4505  0.0190 -6.8179 3  785.6662147  71510 303732351      742054        syn-C2H3C(O)NH2, v=0
  170884.9999  0.0016 -6.8733 3  187.6147 77  71510 30338 732      38 533        syn-C2H3C(O)NH2, v=0
  170948.4074  0.0111 -5.9512 3  620.9451 97  71510 303483810      493713        syn-C2H3C(O)NH2, v=0
  170948.4074  0.0111 -5.9512 3  620.9451 97  71510 303483811      493712        syn-C2H3C(O)NH2, v=0
  170998.5587  0.0200 -3.6246 3   73.7436 49 -71510 30324 420      23 519        syn-C2H3C(O)NH2, v=0
  171050.3126  0.0009 -5.5505 3   71.0912 47  71510 30323 618      22 617        syn-C2H3C(O)NH2, v=0
  171093.5804  0.0030 -6.9720 3   50.8090 35  71510 30317 9 9      18 612        syn-C2H3C(O)NH2, v=0
  171118.7042  0.0016 -4.8125 3  524.5759119  71510 303592040      582137        syn-C2H3C(O)NH2, v=0
  171130.1270  0.0520 -6.5690 3 1090.8427135  71510 303674819      684722        syn-C2H3C(O)NH2, v=0
  171130.1270  0.0520 -6.5690 3 1090.8427135  71510 303674820      684721        syn-C2H3C(O)NH2, v=0
  171136.7033  0.0018 -4.8843 3  563.7616123  71510 303612141      602238        syn-C2H3C(O)NH2, v=0
  171137.4911  0.0016 -4.8124 3  524.5759119  71510 303592039      582138        syn-C2H3C(O)NH2, v=0
  171143.3184  0.0018 -4.8842 3  563.7616123  71510 303612140      602239        syn-C2H3C(O)NH2, v=0
  171168.6749  0.0010 -5.6095 3   81.2042 47  71510 30323 915      22 914        syn-C2H3C(O)NH2, v=0
  171172.3583  0.0505 -6.6868 3 1491.1551193  71510 303963957      954056        syn-C2H3C(O)NH2, v=0
  171172.3583  0.0505 -6.6868 3 1491.1551193  71510 303963958      954055        syn-C2H3C(O)NH2, v=0
  171196.9294  0.0023 -4.3168 3  217.1010 79  71510 303391128      381227        syn-C2H3C(O)NH2, v=0
  171210.0157  0.0008 -3.6491 3  148.1144 61  71510 303301317      301218        syn-C2H3C(O)NH2, v=0
  171213.8417  0.0016 -4.7436 3  486.8343115  71510 303571939      562036        syn-C2H3C(O)NH2, v=0
  171219.6388  0.0200 -3.6491 3  148.1140 61 -71510 303301318      301219        syn-C2H3C(O)NH2, v=0
  171236.4754  0.0010 -5.6092 3   81.2061 47  71510 30323 914      22 913        syn-C2H3C(O)NH2, v=0
  171247.3704  0.0125 -6.5675 3  788.9489157  71510 303781266      791169        syn-C2H3C(O)NH2, v=0
  171247.3975  0.0125 -6.5675 3  788.9489157  71510 303781366      791069        syn-C2H3C(O)NH2, v=0
  171250.4162  0.0020 -4.9589 3  604.3903127  71510 303632242      622339        syn-C2H3C(O)NH2, v=0
  171252.7065  0.0020 -4.9589 3  604.3903127  71510 303632241      622340        syn-C2H3C(O)NH2, v=0
  171257.6942  0.0009 -5.5460 3   64.5355 45  71510 30322 517      21 516        syn-C2H3C(O)NH2, v=0
  171266.1836  0.0016 -4.7434 3  486.8342115  71510 303571938      562037        syn-C2H3C(O)NH2, v=0
  171437.9465  0.0015 -4.6777 3  450.5382111  71510 303551838      541935        syn-C2H3C(O)NH2, v=0
  171444.3640  0.0025 -5.0365 3  646.4607131  71510 303652343      642440        syn-C2H3C(O)NH2, v=0
  171445.1452  0.0025 -5.0365 3  646.4607131  71510 303652342      642441        syn-C2H3C(O)NH2, v=0
  171454.7358  0.0106 -6.6365 3  621.4104133  71510 303661848      671553        syn-C2H3C(O)NH2, v=0
  171580.5951  0.0015 -4.6769 3  450.5380111  71510 303551837      541936        syn-C2H3C(O)NH2, v=0
  171597.3253  0.0200 -3.8355 3   25.0646 27 -71510 30313 6 8      12 5 7        syn-C2H3C(O)NH2, v=0
  171640.2673  0.0093 -5.9238 3  580.1677 93  71510 3034637 9      473612        syn-C2H3C(O)NH2, v=0
  171640.2673  0.0093 -5.9238 3  580.1677 93  71510 303463710      473611        syn-C2H3C(O)NH2, v=0
  171661.0994  0.0027 -6.2626 3  150.0866 63  71510 303311219      32 924        syn-C2H3C(O)NH2, v=0
  171694.8557  0.0200 -3.7921 3  364.5115103 -71510 303511339      511240        syn-C2H3C(O)NH2, v=0
  171705.7494  0.0031 -5.1170 3  689.9718135  71510 303672444      662541        syn-C2H3C(O)NH2, v=0
  171706.0123  0.0031 -5.1169 3  689.9718135  71510 303672443      662542        syn-C2H3C(O)NH2, v=0
  171761.9943  0.0013 -4.4202 3  290.8234 91  71510 303451333      441430        syn-C2H3C(O)NH2, v=0
  171785.1901  0.0042 -6.2426 3  212.1733 85  71510 30342 438      43 341        syn-C2H3C(O)NH2, v=0
  171785.2193  0.0042 -6.2426 3  212.1733 85  71510 30342 538      43 241        syn-C2H3C(O)NH2, v=0
  171794.6771  0.0015 -4.6148 3  415.6892107  71510 303531737      521834        syn-C2H3C(O)NH2, v=0
  171814.0466  0.0023 -4.0447 3  109.4271 63  71510 30331 229      31 130        syn-C2H3C(O)NH2, v=0
  171814.1131  0.0023 -4.0447 3  109.4271 63  71510 30331 329      31 230        syn-C2H3C(O)NH2, v=0
  171821.6783  0.0200 -3.6519 3   68.0122 47 -71510 30323 519      22 418        syn-C2H3C(O)NH2, v=0
  171855.7011  0.0042 -4.2244 3  662.4330137  71510 303681949      681850        syn-C2H3C(O)NH2, v=0
  171871.1290  0.0580 -6.8141 3 1557.0869197  71510 303984058      974157        syn-C2H3C(O)NH2, v=0
  171871.1290  0.0580 -6.8141 3 1557.0869197  71510 303984059      974156        syn-C2H3C(O)NH2, v=0
  171900.3055  0.0455 -6.4818 3 1036.2159131  71510 303654718      664621        syn-C2H3C(O)NH2, v=0
  171900.3055  0.0455 -6.4818 3 1036.2159131  71510 303654719      664620        syn-C2H3C(O)NH2, v=0
  171918.1079  0.0200 -3.6907 3   20.3440 19 -71510 303 9 8 2       8 7 1        syn-C2H3C(O)NH2, v=0
  171918.1079  0.0200 -3.6907 3   20.3440 19 -71510 303 9 8 1       8 7 2        syn-C2H3C(O)NH2, v=0
  171948.7761  0.0200 -3.7534 3  338.0483 97 -71510 303481533      481434        syn-C2H3C(O)NH2, v=0
  171992.8256  0.0200 -3.6534 3  140.6766 59 -71510 303291316      291217        syn-C2H3C(O)NH2, v=0
  171997.1263  0.0200 -3.6534 3  140.6764 59 -71510 303291317      291218        syn-C2H3C(O)NH2, v=0
  172024.2436  0.0039 -5.2004 3  734.9224139  71510 303692545      682642        syn-C2H3C(O)NH2, v=0
  172024.3310  0.0039 -5.2004 3  734.9224139  71510 303692544      682643        syn-C2H3C(O)NH2, v=0
  172055.6548  0.0101 -4.9616 3 1096.9668177  71510 303882365      882266        syn-C2H3C(O)NH2, v=0
  172064.6443  0.0024 -5.3313 3   12.1035 23  71510 30311 2 9      10 110        syn-C2H3C(O)NH2, v=0
  172134.2716  0.0010 -5.5806 3   77.3698 47  71510 30323 816      22 815        syn-C2H3C(O)NH2, v=0
  172150.9045  0.0200 -3.7631 3  333.5377 99 -71510 303491238      491139        syn-C2H3C(O)NH2, v=0
  172160.4322  0.0062 -6.3898 3  227.4787 81  71510 303401129      41 834        syn-C2H3C(O)NH2, v=0
  172173.5695  0.0015 -4.6128 3  415.6886107  71510 303531736      521835        syn-C2H3C(O)NH2, v=0
  172197.7519  0.0200 -3.6727 3  263.1862 85 -71510 303421429      421330        syn-C2H3C(O)NH2, v=0
  172213.0335  0.0011 -5.5510 3   66.2536 45  71510 30322 616      21 615        syn-C2H3C(O)NH2, v=0
  172249.3556  0.0015 -4.5554 3  382.2895103  71510 303511636      501733        syn-C2H3C(O)NH2, v=0
  172262.8471  0.0200 -3.7530 3   21.9295 23 -71510 30311 7 5      10 6 4        syn-C2H3C(O)NH2, v=0
  172267.6431  0.0200 -3.7530 3   21.9294 23 -71510 30311 7 4      10 6 5        syn-C2H3C(O)NH2, v=0
  172322.5143  0.0078 -5.9067 3  540.8284 89  71510 3034436 8      453511        syn-C2H3C(O)NH2, v=0
  172322.5143  0.0078 -5.9067 3  540.8284 89  71510 3034436 9      453510        syn-C2H3C(O)NH2, v=0
  172391.5453  0.0050 -5.2868 3  781.3115143  71510 303712646      702743        syn-C2H3C(O)NH2, v=0
  172391.5741  0.0050 -5.2868 3  781.3115143  71510 303712645      702744        syn-C2H3C(O)NH2, v=0
  172427.9657  0.0066 -6.3801 3  371.0335103  71510 303511437      521142        syn-C2H3C(O)NH2, v=0
  172471.2811  0.0200 -3.8324 3   25.0392 27 -71510 30313 6 7      12 5 8        syn-C2H3C(O)NH2, v=0
  172580.0517  0.0664 -6.9443 3 1624.4404201  71510 303A04159      994258        syn-C2H3C(O)NH2, v=0
  172580.0517  0.0664 -6.9443 3 1624.4404201  71510 303A04160      994257        syn-C2H3C(O)NH2, v=0
  172585.9000  0.0123 -4.7130 3  956.2346165  71510 303822260      822161        syn-C2H3C(O)NH2, v=0
  172609.2087  0.0200 -3.6650 3  252.6551 83 -71510 303411427      411328        syn-C2H3C(O)NH2, v=0
  172615.0390  0.0010 -5.5581 3   74.0467 47  71510 30323 717      22 716        syn-C2H3C(O)NH2, v=0
  172633.0421  0.0028 -6.5854 3   79.8045 45  71510 303221012      23 717        syn-C2H3C(O)NH2, v=0
  172662.5452  0.0396 -6.3996 3  983.0186127  71510 303634617      644520        syn-C2H3C(O)NH2, v=0
  172662.5452  0.0396 -6.3996 3  983.0186127  71510 303634618      644519        syn-C2H3C(O)NH2, v=0
  172672.9042  0.0200 -4.5007 3  350.3417 99 -71510 303491535      481632        syn-C2H3C(O)NH2, v=0
  172688.3296  0.0008 -3.6598 3  133.4977 57  71510 303281315      281216        syn-C2H3C(O)NH2, v=0
  172690.2083  0.0200 -3.6598 3  133.4976 57 -71510 303281316      281217        syn-C2H3C(O)NH2, v=0
  172716.9132  0.0200 -3.2526 3   79.1203 57 -71510 30328 028      27 127        syn-C2H3C(O)NH2, v=0
  172716.9255  0.0010 -5.4435 3   79.1203 57  71510 30328 128      27 127        syn-C2H3C(O)NH2, v=0
  172716.9257  0.0010 -5.4435 3   79.1203 57  71510 30328 028      27 027        syn-C2H3C(O)NH2, v=0
  172716.9132  0.0200 -3.2526 3   79.1203 57 -71510 30328 128      27 027        syn-C2H3C(O)NH2, v=0
  172717.8453  0.0200 -3.3144 3   78.6005 55 -71510 30327 126      26 225        syn-C2H3C(O)NH2, v=0
  172717.8211  0.0010 -5.4643 3   78.6005 55  71510 30327 226      26 225        syn-C2H3C(O)NH2, v=0
  172717.8507  0.0010 -5.4643 3   78.6005 55  71510 30327 126      26 125        syn-C2H3C(O)NH2, v=0
  172717.8453  0.0200 -3.3144 3   78.6005 55 -71510 30327 226      26 125        syn-C2H3C(O)NH2, v=0
  172738.4105  0.0014 -4.4536 3  319.8504 95  71510 303471434      461531        syn-C2H3C(O)NH2, v=0
  172761.1484  0.0200 -3.3873 3   77.5535 53 -71510 30326 224      25 323        syn-C2H3C(O)NH2, v=0
  172763.2979  0.0009 -5.4843 3   77.5535 53  71510 30326 324      25 323        syn-C2H3C(O)NH2, v=0
  172765.3830  0.0009 -5.4843 3   77.5533 53  71510 30326 224      25 223        syn-C2H3C(O)NH2, v=0
  172767.5769  0.0200 -3.3873 3   77.5533 53 -71510 30326 324      25 223        syn-C2H3C(O)NH2, v=0
  172794.4273  0.0039 -4.7592 3  333.5162 99  71510 303491238      481335        syn-C2H3C(O)NH2, v=0
  172800.9531  0.0063 -5.3762 3  829.1381147  71510 303732747      722844        syn-C2H3C(O)NH2, v=0
  172800.9625  0.0063 -5.3762 3  829.1381147  71510 303732746      722845        syn-C2H3C(O)NH2, v=0
  172808.9038  0.0011 -5.5772 3   77.3939 47  71510 30323 815      22 814        syn-C2H3C(O)NH2, v=0
  172822.6617  0.0200 -3.4796 3   75.9452 51 -71510 30325 322      24 421        syn-C2H3C(O)NH2, v=0
  172911.4838  0.0009 -5.5030 3   75.9452 51  71510 30325 422      24 421        syn-C2H3C(O)NH2, v=0
  172932.8365  0.0016 -6.9331 3  275.1467 91  71510 30345 936      45 937        syn-C2H3C(O)NH2, v=0
  172948.2061  0.0009 -5.5213 3   73.7436 49  71510 30324 520      23 519        syn-C2H3C(O)NH2, v=0
  172953.6592  0.0054 -6.3208 3  611.4318139  71510 303691059      70 962        syn-C2H3C(O)NH2, v=0
  172953.6916  0.0054 -6.3208 3  611.4318139  71510 303691159      70 862        syn-C2H3C(O)NH2, v=0
  172984.9843  0.0009 -5.5026 3   75.9398 51  71510 30325 322      24 321        syn-C2H3C(O)NH2, v=0
  172988.4597  0.0011 -5.2411 3   11.4979 21  71510 30310 4 7       9 1 8        syn-C2H3C(O)NH2, v=0
  172994.8549  0.0066 -5.9015 3  502.9278 85  71510 3034235 7      433410        syn-C2H3C(O)NH2, v=0
  172994.8549  0.0066 -5.9015 3  502.9278 85  71510 3034235 8      4334 9        syn-C2H3C(O)NH2, v=0
  172996.1584  0.0084 -5.3857 3  566.4701129  71510 303641550      631647        syn-C2H3C(O)NH2, v=0
  173066.6233  0.0133 -4.4748 3  814.3638153  71510 303761957      761858        syn-C2H3C(O)NH2, v=0
  173073.8138  0.0200 -3.4782 3   75.9398 51 -71510 30325 422      24 321        syn-C2H3C(O)NH2, v=0
  173174.5753  0.0014 -3.8199 3  396.6737107  71510 303531440      531341        syn-C2H3C(O)NH2, v=0
  173199.6373  0.0015 -3.7265 3  275.1378 91  71510 30345 936      45 837        syn-C2H3C(O)NH2, v=0
  173225.3828  0.0200 -4.5503 3  382.2876103 -71510 303511635      501734        syn-C2H3C(O)NH2, v=0
  173247.0152  0.0080 -5.4686 3  878.4011151  71510 303752848      742945        syn-C2H3C(O)NH2, v=0
  173247.0182  0.0080 -5.4686 3  878.4011151  71510 303752847      742946        syn-C2H3C(O)NH2, v=0
  173305.8451  0.0008 -3.6685 3  126.5763 55  71510 303271314      271215        syn-C2H3C(O)NH2, v=0
  173306.6100  0.0008 -3.6685 3  126.5763 55  71510 303271315      271216        syn-C2H3C(O)NH2, v=0
  173329.6361  0.0048 -4.1484 3  611.8731133  71510 303661650      661551        syn-C2H3C(O)NH2, v=0
  173351.1990  0.0077 -6.8674 3   93.8530 53  71510 30326 719      27 424        syn-C2H3C(O)NH2, v=0
  173382.0158  0.0049 -6.4270 3  169.2539 77  71510 30338 335      39 238        syn-C2H3C(O)NH2, v=0
  173382.0323  0.0049 -6.4270 3  169.2539 77  71510 30338 435      39 138        syn-C2H3C(O)NH2, v=0
  173393.2053  0.0013 -6.6945 3    4.8393 15  71510 303 7 4 3       6 1 6        syn-C2H3C(O)NH2, v=0
  173414.3397  0.0206 -6.7269 3  895.6776167  71510 303831370      841273        syn-C2H3C(O)NH2, v=0
  173414.3424  0.0106 -4.9158 3 1073.7989175  71510 303872364      872265        syn-C2H3C(O)NH2, v=0
  173414.3576  0.0206 -6.7269 3  895.6776167  71510 303831470      841173        syn-C2H3C(O)NH2, v=0
  173416.7187  0.0344 -6.3225 3  931.2517123  71510 303614516      624419        syn-C2H3C(O)NH2, v=0
  173416.7187  0.0344 -6.3225 3  931.2517123  71510 303614517      624418        syn-C2H3C(O)NH2, v=0
  173442.4613  0.0032 -6.1145 3  322.9943103  71510 30351 645      52 548        syn-C2H3C(O)NH2, v=0
  173442.4970  0.0032 -6.1145 3  322.9943103  71510 30351 745      52 448        syn-C2H3C(O)NH2, v=0
  173474.8490  0.0018 -6.1741 3   18.8439 23  71510 30311 6 5      11 3 8        syn-C2H3C(O)NH2, v=0
  173592.8044  0.0014 -3.7368 3  303.7472 95  71510 303471137      471038        syn-C2H3C(O)NH2, v=0
  173656.9701  0.0057 -5.9107 3  466.4666 81  71510 3034034 6      4133 9        syn-C2H3C(O)NH2, v=0
  173656.9701  0.0057 -5.9107 3  466.4666 81  71510 3034034 7      4133 8        syn-C2H3C(O)NH2, v=0
  173725.2579  0.0099 -5.5640 3  929.0995155  71510 303772949      763046        syn-C2H3C(O)NH2, v=0
  173725.2588  0.0099 -5.5640 3  929.0995155  71510 303772948      763047        syn-C2H3C(O)NH2, v=0
  173744.5535  0.0035 -6.1613 3  456.0973121  71510 30360 852      61 755        syn-C2H3C(O)NH2, v=0
  173744.5894  0.0035 -6.1613 3  456.0973121  71510 30360 952      61 655        syn-C2H3C(O)NH2, v=0
  173853.4121  0.0200 -3.6796 3  119.9114 53 -71510 303261313      261214        syn-C2H3C(O)NH2, v=0
  173853.4121  0.0200 -3.6796 3  119.9114 53 -71510 303261314      261215        syn-C2H3C(O)NH2, v=0
  173938.4517  0.0021 -3.9006 3  129.3083 67  71510 30333 330      33 231        syn-C2H3C(O)NH2, v=0
  173938.9456  0.0021 -3.9006 3  129.3083 67  71510 30333 430      33 331        syn-C2H3C(O)NH2, v=0
  173977.3818  0.0200 -3.6585 3  252.6035 83 -71510 303411428      411329        syn-C2H3C(O)NH2, v=0
  174162.6865  0.0297 -6.2508 3  880.9163119  71510 303594415      604318        syn-C2H3C(O)NH2, v=0
  174162.6865  0.0297 -6.2508 3  880.9163119  71510 303594416      604317        syn-C2H3C(O)NH2, v=0
  174199.2358  0.0009 -5.5144 3   73.6368 49  71510 30324 420      23 419        syn-C2H3C(O)NH2, v=0
  174231.9789  0.0121 -5.6624 3  981.2322159  71510 303793050      783147        syn-C2H3C(O)NH2, v=0
  174231.9793  0.0121 -5.6624 3  981.2322159  71510 303793049      783148        syn-C2H3C(O)NH2, v=0
  174308.5139  0.0050 -5.9377 3  431.4455 77  71510 3033833 5      3932 8        syn-C2H3C(O)NH2, v=0
  174308.5139  0.0050 -5.9377 3  431.4455 77  71510 3033833 6      3932 7        syn-C2H3C(O)NH2, v=0
  174337.5027  0.0200 -3.6933 3  113.5017 51 -71510 303251312      251213        syn-C2H3C(O)NH2, v=0
  174337.5027  0.0200 -3.6933 3  113.5017 51 -71510 303251313      251214        syn-C2H3C(O)NH2, v=0
  174435.4354  0.0200 -3.7983 3  389.0070105 -71510 303521538      521439        syn-C2H3C(O)NH2, v=0
  174436.9136  0.0054 -6.7986 3  130.8676 69  71510 30334 232      35 135        syn-C2H3C(O)NH2, v=0
  174436.9216  0.0054 -6.7986 3  130.8676 69  71510 30334 332      35 035        syn-C2H3C(O)NH2, v=0
  174445.4409  0.0014 -6.9703 3  303.7188 95  71510 303471137      47 938        syn-C2H3C(O)NH2, v=0
  174615.7408  0.0200 -3.8154 3  402.4502107 -71510 303531539      531440        syn-C2H3C(O)NH2, v=0
  174764.0902  0.0148 -5.7639 3 1034.7982163  71510 303813151      803248        syn-C2H3C(O)NH2, v=0
  174764.0903  0.0148 -5.7639 3 1034.7982163  71510 303813150      803249        syn-C2H3C(O)NH2, v=0
  174764.5305  0.0200 -3.7100 3  107.3463 49 -71510 303241311      241212        syn-C2H3C(O)NH2, v=0
  174764.5305  0.0200 -3.7100 3  107.3463 49 -71510 303241312      241213        syn-C2H3C(O)NH2, v=0
  174780.8833  0.0071 -6.5446 3  153.6068 67  71510 30333 924      34 629        syn-C2H3C(O)NH2, v=0
  174828.6735  0.0031 -4.0692 3  570.9613127  71510 303631845      631746        syn-C2H3C(O)NH2, v=0
  174829.0424  0.0262 -4.8625 3 1045.0186173  71510 303862264      862165        syn-C2H3C(O)NH2, v=0
  174848.2455  0.0116 -6.6802 3  704.1723139  71510 303692248      701951        syn-C2H3C(O)NH2, v=0
  174865.2408  0.0026 -6.1982 3  188.9318 71  71510 303351322      361027        syn-C2H3C(O)NH2, v=0
  174877.9658  0.0097 -4.5155 3  845.4827155  71510 303772156      772057        syn-C2H3C(O)NH2, v=0
  174885.6151  0.0152 -6.7440 3  698.3388141  71510 303701951      711656        syn-C2H3C(O)NH2, v=0
  174900.2965  0.0255 -6.1848 3  832.0133115  71510 303574314      584217        syn-C2H3C(O)NH2, v=0
  174900.2965  0.0255 -6.1848 3  832.0133115  71510 303574315      584216        syn-C2H3C(O)NH2, v=0
  174904.9424  0.0200 -3.6493 3  242.3208 81 -71510 303401426      401327        syn-C2H3C(O)NH2, v=0
  174932.5132  0.0200 -3.7798 3  375.8102103 -71510 303511537      511438        syn-C2H3C(O)NH2, v=0
  174949.1115  0.0044 -5.9878 3  397.8650 73  71510 3033632 4      3731 7        syn-C2H3C(O)NH2, v=0
  174949.1115  0.0044 -5.9878 3  397.8650 73  71510 3033632 5      3731 6        syn-C2H3C(O)NH2, v=0
  175081.5355  0.0013 -6.8186 3  192.0908 49  71510 3032423 1      2323 0        syn-C2H3C(O)NH2, v=0
  175081.5355  0.0013 -6.8186 3  192.0908 49  71510 3032423 2      2323 1        syn-C2H3C(O)NH2, v=0
  175088.4371  0.0226 -4.9937 3 1120.3163179  71510 303892366      892267        syn-C2H3C(O)NH2, v=0
  175094.6265  0.0200 -4.4879 3  350.3364 99 -71510 303491534      481633        syn-C2H3C(O)NH2, v=0
  175139.9099  0.0200 -3.7300 3  101.4441 47 -71510 303231310      231211        syn-C2H3C(O)NH2, v=0
  175139.9099  0.0200 -3.7300 3  101.4441 47 -71510 303231311      231212        syn-C2H3C(O)NH2, v=0
  175151.9720  0.0013 -6.5045 3  181.4715 49  71510 3032422 2      2322 1        syn-C2H3C(O)NH2, v=0
  175151.9720  0.0013 -6.5045 3  181.4715 49  71510 3032422 3      2322 2        syn-C2H3C(O)NH2, v=0
  175215.5839  0.0014 -4.4085 3  274.1894 89  71510 303441233      431330        syn-C2H3C(O)NH2, v=0
  175216.2350  0.0200 -3.7169 3  275.1467 91 -71510 303451036      45 937        syn-C2H3C(O)NH2, v=0
  175230.8921  0.0012 -6.3164 3  171.3257 49  71510 3032421 3      2321 2        syn-C2H3C(O)NH2, v=0
  175230.8921  0.0012 -6.3164 3  171.3257 49  71510 3032421 4      2321 3        syn-C2H3C(O)NH2, v=0
  175249.3808  0.0200 -3.8303 3  408.7799107 -71510 303531637      531538        syn-C2H3C(O)NH2, v=0
  175305.1732  0.0025 -4.3005 3   97.0102 61  71510 30330 129      30 030        syn-C2H3C(O)NH2, v=0
  175305.1762  0.0025 -4.3005 3   97.0102 61  71510 30330 229      30 130        syn-C2H3C(O)NH2, v=0
  175318.9970  0.0178 -5.8683 3 1089.7963167  71510 303833252      823349        syn-C2H3C(O)NH2, v=0
  175318.9971  0.0178 -5.8683 3 1089.7963167  71510 303833251      823350        syn-C2H3C(O)NH2, v=0
  175320.1482  0.0012 -6.1806 3  161.6537 49  71510 3032420 4      2320 3        syn-C2H3C(O)NH2, v=0
  175320.1482  0.0012 -6.1806 3  161.6537 49  71510 3032420 5      2320 4        syn-C2H3C(O)NH2, v=0
  175381.7825  0.0200 -3.7441 3   82.7294 51 -71510 30325 520      24 619        syn-C2H3C(O)NH2, v=0
  175422.1050  0.0011 -6.0741 3  152.4562 49  71510 3032419 5      2319 4        syn-C2H3C(O)NH2, v=0
  175422.1050  0.0011 -6.0741 3  152.4562 49  71510 3032419 6      2319 5        syn-C2H3C(O)NH2, v=0
  175438.9489  0.0328 -6.9057 3 1009.0907177  71510 303881474      891377        syn-C2H3C(O)NH2, v=0
  175438.9607  0.0328 -6.9057 3 1009.0907177  71510 303881574      891277        syn-C2H3C(O)NH2, v=0
  175468.5532  0.0200 -3.7538 3   95.7942 45 -71510 3032213 9      221210        syn-C2H3C(O)NH2, v=0
  175468.5532  0.0200 -3.7538 3   95.7942 45 -71510 303221310      221211        syn-C2H3C(O)NH2, v=0
  175475.4105  0.0083 -6.4404 3  705.9792149  71510 303741163      751066        syn-C2H3C(O)NH2, v=0
  175475.4324  0.0083 -6.4404 3  705.9792149  71510 303741263      75 966        syn-C2H3C(O)NH2, v=0
  175483.0084  0.0014 -6.9214 3  275.1378 91  71510 303451036      45 837        syn-C2H3C(O)NH2, v=0
  175539.8219  0.0011 -5.9863 3  143.7338 49  71510 3032418 6      2318 5        syn-C2H3C(O)NH2, v=0
  175539.8219  0.0011 -5.9863 3  143.7338 49  71510 3032418 7      2318 6        syn-C2H3C(O)NH2, v=0
  175563.9925  0.0858 -6.9173 3 1305.1426149  71510 303745222      755125        syn-C2H3C(O)NH2, v=0
  175563.9925  0.0858 -6.9173 3 1305.1426149  71510 303745223      755124        syn-C2H3C(O)NH2, v=0
  175578.3586  0.0041 -6.0697 3  365.7258 69  71510 3033431 3      3530 6        syn-C2H3C(O)NH2, v=0
  175578.3586  0.0041 -6.0697 3  365.7258 69  71510 3033431 4      3530 5        syn-C2H3C(O)NH2, v=0
  175580.6451  0.0200 -3.8305 3  416.1321109 -71510 303541540      541441        syn-C2H3C(O)NH2, v=0
  175585.5733  0.0019 -6.9040 3  150.4759 71  71510 30335 431      35 432        syn-C2H3C(O)NH2, v=0
  175585.7046  0.0019 -3.8123 3  150.4759 71  71510 30335 431      35 332        syn-C2H3C(O)NH2, v=0
  175588.5779  0.0019 -3.8122 3  150.4759 71  71510 30335 531      35 432        syn-C2H3C(O)NH2, v=0
  175588.7093  0.0019 -6.9039 3  150.4759 71  71510 30335 531      35 332        syn-C2H3C(O)NH2, v=0
  175629.3821  0.0219 -6.1251 3  784.5436111  71510 303554213      564116        syn-C2H3C(O)NH2, v=0
  175629.3821  0.0219 -6.1251 3  784.5436111  71510 303554214      564115        syn-C2H3C(O)NH2, v=0
  175636.7918  0.0027 -6.9563 3   50.6575 35  71510 30317 9 8      18 613        syn-C2H3C(O)NH2, v=0
  175677.3189  0.0011 -5.9120 3  135.4872 49  71510 3032417 7      2317 6        syn-C2H3C(O)NH2, v=0
  175677.3189  0.0011 -5.9120 3  135.4872 49  71510 3032417 8      2317 7        syn-C2H3C(O)NH2, v=0
  175682.8814  0.0200 -3.6456 3  242.2917 81 -71510 303401427      401328        syn-C2H3C(O)NH2, v=0
  175739.4086  0.0015 -6.8885 3  247.7485 87  71510 30343 835      43 836        syn-C2H3C(O)NH2, v=0
  175755.0486  0.0200 -3.7820 3   90.3957 43 -71510 3032113 8      2112 9        syn-C2H3C(O)NH2, v=0
  175755.0486  0.0200 -3.7820 3   90.3957 43 -71510 3032113 9      211210        syn-C2H3C(O)NH2, v=0
  175814.9029  0.0200 -3.7098 3  247.7460 87 -71510 30343 835      43 736        syn-C2H3C(O)NH2, v=0
  175839.9728  0.0011 -5.8478 3  127.7175 49  71510 3032416 8      2316 7        syn-C2H3C(O)NH2, v=0
  175839.9728  0.0011 -5.8478 3  127.7175 49  71510 3032416 9      2316 8        syn-C2H3C(O)NH2, v=0
  175894.5054  0.0213 -5.9758 3 1146.2255171  71510 303853352      843451        syn-C2H3C(O)NH2, v=0
  175894.5054  0.0213 -5.9758 3 1146.2255171  71510 303853353      843450        syn-C2H3C(O)NH2, v=0
  175903.6839  0.0036 -6.1511 3  270.0237 95  71510 30347 542      48 445        syn-C2H3C(O)NH2, v=0
  175903.7078  0.0036 -6.1511 3  270.0237 95  71510 30347 642      48 345        syn-C2H3C(O)NH2, v=0
  175977.8041  0.0200 -3.7602 3  362.8668101 -71510 303501536      501437        syn-C2H3C(O)NH2, v=0
  176003.4902  0.0010 -3.8158 3   85.2480 41  71510 3032013 7      2012 8        syn-C2H3C(O)NH2, v=0
  176003.4906  0.0010 -3.8158 3   85.2480 41  71510 3032013 8      2012 9        syn-C2H3C(O)NH2, v=0
  176035.1251  0.0010 -5.7915 3  120.4260 49  71510 3032415 9      2315 8        syn-C2H3C(O)NH2, v=0
  176035.1251  0.0010 -5.7915 3  120.4260 49  71510 303241510      2315 9        syn-C2H3C(O)NH2, v=0
  176130.5040  0.0020 -6.0538 3   19.1641 25  71510 30312 5 8      12 211        syn-C2H3C(O)NH2, v=0
  176148.9256  0.0200 -3.5963 3   73.6368 49 -71510 30324 520      23 419        syn-C2H3C(O)NH2, v=0
  176174.3538  0.0024 -3.9364 3  486.4113117  71510 303581741      581642        syn-C2H3C(O)NH2, v=0
  176195.8196  0.0038 -6.1990 3  335.0284 65  71510 3033230 2      3329 5        syn-C2H3C(O)NH2, v=0
  176195.8196  0.0038 -6.1990 3  335.0284 65  71510 3033230 3      3329 4        syn-C2H3C(O)NH2, v=0
  176217.7181  0.0200 -3.8563 3   80.3501 39 -71510 3031913 6      1912 7        syn-C2H3C(O)NH2, v=0
  176217.7181  0.0200 -3.8563 3   80.3501 39 -71510 3031913 7      1912 8        syn-C2H3C(O)NH2, v=0
  176273.0522  0.0010 -5.7416 3  113.6147 49  71510 303241410      2314 9        syn-C2H3C(O)NH2, v=0
  176273.0522  0.0010 -5.7416 3  113.6147 49  71510 303241411      231410        syn-C2H3C(O)NH2, v=0
  176349.7618  0.0186 -6.0720 3  738.5081107  71510 303534112      544015        syn-C2H3C(O)NH2, v=0
  176349.7618  0.0186 -6.0720 3  738.5081107  71510 303534113      544014        syn-C2H3C(O)NH2, v=0
  176359.3482  0.0761 -6.8147 3 1245.2926145  71510 303725121      735024        syn-C2H3C(O)NH2, v=0
  176359.3482  0.0761 -6.8147 3 1245.2926145  71510 303725122      735023        syn-C2H3C(O)NH2, v=0
  176401.1999  0.0200 -3.9056 3   75.7014 37 -71510 3031813 5      1812 6        syn-C2H3C(O)NH2, v=0
  176401.1999  0.0200 -3.9056 3   75.7014 37 -71510 3031813 6      1812 7        syn-C2H3C(O)NH2, v=0
  176487.0644  0.0033 -6.6875 3   74.2485 43  71510 303211012      22 715        syn-C2H3C(O)NH2, v=0
  176488.7489  0.0252 -6.0863 3 1204.0846175  71510 303873453      863552        syn-C2H3C(O)NH2, v=0
  176488.7489  0.0252 -6.0863 3 1204.0846175  71510 303873454      863551        syn-C2H3C(O)NH2, v=0
  176504.2056  0.0014 -3.7065 3  247.7485 87  71510 30343 935      43 836        syn-C2H3C(O)NH2, v=0
  176505.0166  0.0200 -3.7211 3  325.7893 95 -71510 303471532      471433        syn-C2H3C(O)NH2, v=0
  176555.8968  0.0012 -5.5379 3   74.2485 47  71510 30323 716      22 715        syn-C2H3C(O)NH2, v=0
  176557.1876  0.0200 -3.9669 3   71.3013 35 -71510 3031713 4      1712 5        syn-C2H3C(O)NH2, v=0
  176557.1876  0.0200 -3.9669 3   71.3013 35 -71510 3031713 5      1712 6        syn-C2H3C(O)NH2, v=0
  176568.5822  0.0010 -5.6972 3  107.2861 49  71510 303241312      231311        syn-C2H3C(O)NH2, v=0
  176568.5832  0.0010 -5.6972 3  107.2861 49  71510 303241311      231310        syn-C2H3C(O)NH2, v=0
  176579.6850  0.0014 -6.8847 3  247.7460 87  71510 30343 935      43 736        syn-C2H3C(O)NH2, v=0
  176685.7675  0.0043 -6.2336 3  538.4378131  71510 30365 956      66 859        syn-C2H3C(O)NH2, v=0
  176685.7927  0.0043 -6.2336 3  538.4378131  71510 303651056      66 759        syn-C2H3C(O)NH2, v=0
  176688.7459  0.0200 -4.0455 3   67.1490 33 -71510 3031613 3      1612 4        syn-C2H3C(O)NH2, v=0
  176688.7459  0.0200 -4.0455 3   67.1490 33 -71510 3031613 4      1612 5        syn-C2H3C(O)NH2, v=0
  176694.4549  0.0221 -6.9392 3  910.8442159  71510 303792455      802160        syn-C2H3C(O)NH2, v=0
  176703.8183  0.0018 -6.8680 3  172.9172 75  71510 30337 532      37 533        syn-C2H3C(O)NH2, v=0
  176704.6401  0.0018 -3.7567 3  172.9171 75  71510 30337 532      37 433        syn-C2H3C(O)NH2, v=0
  176718.5112  0.0200 -3.7566 3  172.9172 75 -71510 30337 632      37 533        syn-C2H3C(O)NH2, v=0
  176719.3504  0.0018 -6.8679 3  172.9171 75  71510 30337 632      37 433        syn-C2H3C(O)NH2, v=0
  176798.6436  0.0200 -4.1515 3   63.2439 31 -71510 3031513 2      1512 3        syn-C2H3C(O)NH2, v=0
  176798.6436  0.0200 -4.1515 3   63.2439 31 -71510 3031513 3      1512 4        syn-C2H3C(O)NH2, v=0
  176801.0277  0.0036 -6.4090 3  305.7732 61  71510 3033029 1      3128 4        syn-C2H3C(O)NH2, v=0
  176801.0277  0.0036 -6.4090 3  305.7732 61  71510 3033029 2      3128 3        syn-C2H3C(O)NH2, v=0
  176854.6524  0.0200 -3.6363 3  232.2662 79 -71510 303391425      391326        syn-C2H3C(O)NH2, v=0
  176861.3647  0.0200 -3.7447 3  315.4063 97 -71510 303481038      48 939        syn-C2H3C(O)NH2, v=0
  176889.5549  0.0200 -4.3080 3   59.5857 29 -71510 3031413 1      1412 2        syn-C2H3C(O)NH2, v=0
  176889.5549  0.0200 -4.3080 3   59.5857 29 -71510 3031413 2      1412 3        syn-C2H3C(O)NH2, v=0
  176899.1686  0.0032 -6.1244 3  393.1028113  71510 30356 749      57 652        syn-C2H3C(O)NH2, v=0
  176899.1950  0.0032 -6.1244 3  393.1028113  71510 30356 849      57 552        syn-C2H3C(O)NH2, v=0
  176943.9458  0.0010 -5.6573 3  101.4441 49  71510 303241213      231212        syn-C2H3C(O)NH2, v=0
  176943.9740  0.0010 -5.6573 3  101.4441 49  71510 303241212      231211        syn-C2H3C(O)NH2, v=0
  176963.7365  0.0011 -4.5884 3   56.1736 27  71510 3031313 0      1312 1        syn-C2H3C(O)NH2, v=0
  176963.7365  0.0011 -4.5884 3   56.1736 27  71510 3031313 1      1312 2        syn-C2H3C(O)NH2, v=0
  176982.1938  0.0015 -6.8633 3  221.5676 83  71510 30341 734      41 735        syn-C2H3C(O)NH2, v=0
  176994.9580  0.0031 -4.1848 3  162.4498 69  71510 30334 925      331024        syn-C2H3C(O)NH2, v=0
  177001.3145  0.0015 -3.7090 3  221.5669 83  71510 30341 734      41 635        syn-C2H3C(O)NH2, v=0
  177061.2377  0.0158 -6.0261 3  693.9077103  71510 303514011      523914        syn-C2H3C(O)NH2, v=0
  177061.2377  0.0158 -6.0261 3  693.9077103  71510 303514012      523913        syn-C2H3C(O)NH2, v=0
  177100.1317  0.0297 -6.1998 3 1263.3725179  71510 303893554      883653        syn-C2H3C(O)NH2, v=0
  177100.1317  0.0297 -6.1998 3 1263.3725179  71510 303893555      883652        syn-C2H3C(O)NH2, v=0
  177146.9993  0.0674 -6.7166 3 1186.8679141  71510 303705020      714923        syn-C2H3C(O)NH2, v=0
  177146.9993  0.0674 -6.7166 3 1186.8679141  71510 303705021      714922        syn-C2H3C(O)NH2, v=0
  177191.0849  0.0039 -4.0495 3  555.9951127  71510 303631548      631449        syn-C2H3C(O)NH2, v=0
  177212.6659  0.0015 -3.7080 3  221.5676 83  71510 30341 834      41 735        syn-C2H3C(O)NH2, v=0
  177214.7176  0.0016 -6.8559 3  196.6190 79  71510 30339 633      39 634        syn-C2H3C(O)NH2, v=0
  177219.0477  0.0200 -3.7239 3  196.6188 79 -71510 30339 633      39 534        syn-C2H3C(O)NH2, v=0
  177228.8785  0.0175 -5.7232 3  736.7485147  71510 303731757      721854        syn-C2H3C(O)NH2, v=0
  177231.7866  0.0015 -6.8621 3  221.5669 83  71510 30341 834      41 635        syn-C2H3C(O)NH2, v=0
  177261.2547  0.0200 -3.7905 3  377.4346105 -71510 303521340      521241        syn-C2H3C(O)NH2, v=0
  177276.7561  0.0016 -3.7236 3  196.6190 79  71510 30339 733      39 634        syn-C2H3C(O)NH2, v=0
  177281.0270  0.0016 -6.8556 3  196.6188 79  71510 30339 733      39 534        syn-C2H3C(O)NH2, v=0
  177285.1686  0.0200 -3.6343 3  232.2503 79 -71510 303391426      391327        syn-C2H3C(O)NH2, v=0
  177306.8451  0.0251 -4.7284 3  972.2164167  71510 303832162      832063        syn-C2H3C(O)NH2, v=0
  177338.2650  0.1035 -6.5434 3 1143.8164183  71510 303912171      902268        syn-C2H3C(O)NH2, v=0
  177393.4848  0.0035 -6.7964 3  277.9607 57  71510 3032828 0      2927 3        syn-C2H3C(O)NH2, v=0
  177393.4848  0.0035 -6.7964 3  277.9607 57  71510 3032828 1      2927 2        syn-C2H3C(O)NH2, v=0
  177397.9820  0.0025 -6.1650 3  232.2481 79  71510 303391425      401130        syn-C2H3C(O)NH2, v=0
  177404.0560  0.0200 -3.8437 3  430.0451111 -71510 303551541      551442        syn-C2H3C(O)NH2, v=0
  177433.7968  0.0200 -3.7401 3  350.1829 99 -71510 303491535      491436        syn-C2H3C(O)NH2, v=0
  177434.0183  0.0010 -5.6213 3   96.0944 49  71510 303241114      231113        syn-C2H3C(O)NH2, v=0
  177434.6487  0.0010 -5.6213 3   96.0944 49  71510 303241113      231112        syn-C2H3C(O)NH2, v=0
  177493.3672  0.0200 -3.8241 3  410.2116109 -71510 303541441      541342        syn-C2H3C(O)NH2, v=0
  177520.2575  0.0009 -5.5085 3   70.2480 47  71510 30323 518      22 517        syn-C2H3C(O)NH2, v=0
  177587.3648  0.0067 -5.1446 3  481.9447119  71510 303591446      581543        syn-C2H3C(O)NH2, v=0
  177615.4988  0.0200 -4.3311 3  252.6035 85 -71510 303421230      411329        syn-C2H3C(O)NH2, v=0
  177714.5115  0.0074 -6.4276 3  431.1190111  71510 303551540      561245        syn-C2H3C(O)NH2, v=0
  177727.2827  0.0348 -6.3164 3 1324.0880183  71510 303913655      903754        syn-C2H3C(O)NH2, v=0
  177727.2827  0.0348 -6.3164 3 1324.0880183  71510 303913656      903753        syn-C2H3C(O)NH2, v=0
  177763.5943  0.0134 -5.9883 3  650.7431 99  71510 303493910      503813        syn-C2H3C(O)NH2, v=0
  177763.5943  0.0134 -5.9883 3  650.7431 99  71510 303493911      503812        syn-C2H3C(O)NH2, v=0
  177766.5843  0.0052 -4.9320 3  404.2819109  71510 303541342      531439        syn-C2H3C(O)NH2, v=0
  177833.1994  0.0138 -6.5817 3  807.2250159  71510 303791267      801170        syn-C2H3C(O)NH2, v=0
  177833.2141  0.0138 -6.5817 3  807.2250159  71510 303791367      801070        syn-C2H3C(O)NH2, v=0
  177852.7676  0.0009 -5.5085 3   76.7969 49  71510 30324 619      23 618        syn-C2H3C(O)NH2, v=0
  177891.2848  0.0023 -4.0287 3  116.1985 65  71510 30332 230      32 131        syn-C2H3C(O)NH2, v=0
  177891.3176  0.0023 -4.0287 3  116.1985 65  71510 30332 330      32 231        syn-C2H3C(O)NH2, v=0
  177913.4542  0.0099 -4.3521 3  749.9830147  71510 303731855      731756        syn-C2H3C(O)NH2, v=0
  177926.8519  0.0594 -6.6230 3 1129.8698137  71510 303684919      694822        syn-C2H3C(O)NH2, v=0
  177926.8519  0.0594 -6.6230 3 1129.8698137  71510 303684920      694821        syn-C2H3C(O)NH2, v=0
  177931.2005  0.0042 -6.2444 3  221.5701 87  71510 30343 439      44 342        syn-C2H3C(O)NH2, v=0
  177931.2153  0.0042 -6.2444 3  221.5701 87  71510 30343 539      44 242        syn-C2H3C(O)NH2, v=0
  177944.3918  0.0200 -3.5600 3   79.5125 51 -71510 30325 421      24 520        syn-C2H3C(O)NH2, v=0
  177947.9290  0.0028 -6.4108 3  108.6824 53  71510 303261115      27 820        syn-C2H3C(O)NH2, v=0
  177955.8552  0.0200 -3.8143 3   28.3135 29 -71510 30314 6 9      13 5 8        syn-C2H3C(O)NH2, v=0
  178043.5533  0.0464 -6.1115 3  929.2340165  71510 303821964      812061        syn-C2H3C(O)NH2, v=0
  178094.2095  0.0010 -5.5884 3   91.2462 49  71510 303241015      231014        syn-C2H3C(O)NH2, v=0
  178105.0158  0.0010 -5.5883 3   91.2464 49  71510 303241014      231013        syn-C2H3C(O)NH2, v=0
  178169.0705  0.0236 -6.8646 3  779.7231149  71510 303742054      751759        syn-C2H3C(O)NH2, v=0
  178358.5083  0.0077 -6.5582 3  627.1295131  71510 303652145      661848        syn-C2H3C(O)NH2, v=0
  178369.0187  0.0404 -6.4359 3 1386.2300187  71510 303933756      923855        syn-C2H3C(O)NH2, v=0
  178369.0187  0.0404 -6.4359 3 1386.2300187  71510 303933757      923854        syn-C2H3C(O)NH2, v=0
  178372.0091  0.0029 -4.0047 3  115.7134 59  71510 30329 722      28 821        syn-C2H3C(O)NH2, v=0
  178397.6560  0.0148 -6.7910 3  822.9481151  71510 303752352      762057        syn-C2H3C(O)NH2, v=0
  178436.9444  0.0017 -6.4430 3   15.9775 21  71510 30310 6 4      10 3 7        syn-C2H3C(O)NH2, v=0
  178456.5971  0.0113 -5.9594 3  609.0153 95  71510 3034738 9      483712        syn-C2H3C(O)NH2, v=0
  178456.5971  0.0113 -5.9594 3  609.0153 95  71510 303473810      483711        syn-C2H3C(O)NH2, v=0
  178465.1485  0.0200 -4.4229 3  319.8363 95 -71510 303471433      461532        syn-C2H3C(O)NH2, v=0
  178493.3998  0.0200 -3.7576 3  345.8381101 -71510 303501239      501140        syn-C2H3C(O)NH2, v=0
  178537.4560  0.0200 -3.6256 3  222.4866 77 -71510 303381424      381325        syn-C2H3C(O)NH2, v=0
  178614.8222  0.0062 -4.3286 3  741.5945145  71510 303722052      721953        syn-C2H3C(O)NH2, v=0
  178652.8928  0.0033 -4.9400 3   54.8454 41  71510 30320 614      20 317        syn-C2H3C(O)NH2, v=0
  178698.8036  0.0522 -6.5342 3 1074.2993133  71510 303664818      674721        syn-C2H3C(O)NH2, v=0
  178698.8036  0.0522 -6.5342 3 1074.2993133  71510 303664819      674720        syn-C2H3C(O)NH2, v=0
  178715.9326  0.0143 -5.1203 3 1198.1160185  71510 303922468      922369        syn-C2H3C(O)NH2, v=0
  178769.4128  0.0200 -3.6245 3  222.4781 77 -71510 303381425      381326        syn-C2H3C(O)NH2, v=0
  178774.6558  0.0009 -3.2782 3   84.3618 57  71510 30328 127      27 226        syn-C2H3C(O)NH2, v=0
  178774.6690  0.0009 -5.4305 3   84.3618 57  71510 30328 227      27 226        syn-C2H3C(O)NH2, v=0
  178774.6834  0.0009 -5.4305 3   84.3618 57  71510 30328 127      27 126        syn-C2H3C(O)NH2, v=0
  178774.6966  0.0009 -3.2782 3   84.3618 57  71510 30328 227      27 126        syn-C2H3C(O)NH2, v=0
  178774.9004  0.0010 -3.2189 3   84.8815 59  71510 30329 029      28 128        syn-C2H3C(O)NH2, v=0
  178774.9004  0.0010 -5.4105 3   84.8815 59  71510 30329 129      28 128        syn-C2H3C(O)NH2, v=0
  178774.9005  0.0010 -5.4105 3   84.8815 59  71510 30329 029      28 028        syn-C2H3C(O)NH2, v=0
  178774.9006  0.0010 -3.2189 3   84.8815 59  71510 30329 129      28 028        syn-C2H3C(O)NH2, v=0
  178793.9622  0.0177 -4.8574 3 1050.8503173  71510 303862363      862264        syn-C2H3C(O)NH2, v=0
  178813.7352  0.0200 -3.3476 3   83.3162 55 -71510 30327 225      26 324        syn-C2H3C(O)NH2, v=0
  178814.7958  0.0009 -5.4497 3   83.3162 55  71510 30327 325      26 324        syn-C2H3C(O)NH2, v=0
  178815.8657  0.0009 -5.4497 3   83.3162 55  71510 30327 225      26 224        syn-C2H3C(O)NH2, v=0
  178816.9657  0.0200 -3.3475 3   83.3162 55 -71510 30327 325      26 224        syn-C2H3C(O)NH2, v=0
  178906.5711  0.0200 -3.4337 3   81.7129 53 -71510 30326 323      25 422        syn-C2H3C(O)NH2, v=0
  178954.6018  0.0009 -5.4677 3   81.7129 53  71510 30326 423      25 422        syn-C2H3C(O)NH2, v=0
  178987.0731  0.0010 -5.5581 3   86.9138 49  71510 30324 916      23 915        syn-C2H3C(O)NH2, v=0
  178995.3857  0.0009 -5.4675 3   81.7099 53  71510 30326 323      25 322        syn-C2H3C(O)NH2, v=0
  179024.3154  0.0468 -6.5585 3 1449.7971191  71510 303953857      943956        syn-C2H3C(O)NH2, v=0
  179024.3154  0.0468 -6.5585 3 1449.7971191  71510 303953858      943955        syn-C2H3C(O)NH2, v=0
  179043.4247  0.0200 -3.4330 3   81.7099 53 -71510 30326 423      25 322        syn-C2H3C(O)NH2, v=0
  179084.3824  0.0023 -4.3619 3   24.1961 29  71510 30314 410      13 311        syn-C2H3C(O)NH2, v=0
  179104.3924  0.0009 -5.4846 3   79.5125 51  71510 30325 521      24 520        syn-C2H3C(O)NH2, v=0
  179123.9354  0.0010 -5.5574 3   86.9180 49  71510 30324 915      23 914        syn-C2H3C(O)NH2, v=0
  179139.9913  0.0095 -5.9408 3  568.7249 91  71510 3034537 8      463611        syn-C2H3C(O)NH2, v=0
  179139.9913  0.0095 -5.9408 3  568.7249 91  71510 3034537 9      463610        syn-C2H3C(O)NH2, v=0
  179166.8062  0.0200 -3.7199 3  337.7635 97 -71510 303481534      481435        syn-C2H3C(O)NH2, v=0
  179206.8481  0.0200 -3.6600 3   22.5402 21 -71510 30310 8 3       9 7 2        syn-C2H3C(O)NH2, v=0
  179206.8481  0.0200 -3.6600 3   22.5402 21 -71510 30310 8 2       9 7 3        syn-C2H3C(O)NH2, v=0
  179327.2769  0.0026 -6.1583 3  280.0339 87  71510 303431528      441233        syn-C2H3C(O)NH2, v=0
  179429.8212  0.0058 -6.3320 3  627.4899141  71510 303701060      71 963        syn-C2H3C(O)NH2, v=0
  179429.8386  0.0058 -6.3320 3  627.4899141  71510 303701160      71 863        syn-C2H3C(O)NH2, v=0
  179452.5306  0.0062 -6.3780 3  275.1467 89  71510 303441232      45 937        syn-C2H3C(O)NH2, v=0
  179462.7421  0.0457 -6.4503 3 1020.1574129  71510 303644717      654620        syn-C2H3C(O)NH2, v=0
  179462.7421  0.0457 -6.4503 3 1020.1574129  71510 303644718      654619        syn-C2H3C(O)NH2, v=0
  179474.8010  0.0200 -3.7220 3   24.6304 25 -71510 30312 7 6      11 6 5        syn-C2H3C(O)NH2, v=0
  179481.1569  0.0049 -6.4277 3  177.6412 79  71510 30339 336      40 239        syn-C2H3C(O)NH2, v=0
  179481.1651  0.0049 -6.4277 3  177.6412 79  71510 30339 436      40 139        syn-C2H3C(O)NH2, v=0
  179490.8657  0.0200 -3.7219 3   24.6299 25 -71510 30312 7 5      11 6 6        syn-C2H3C(O)NH2, v=0
  179520.0355  0.0043 -5.2851 3   42.8547 37  71510 30318 513      18 216        syn-C2H3C(O)NH2, v=0
  179533.2663  0.0019 -3.7776 3  358.3057103  71510 303511140      511041        syn-C2H3C(O)NH2, v=0
  179540.5768  0.0029 -6.4686 3   16.9551 25  71510 30312 4 9      12 112        syn-C2H3C(O)NH2, v=0
  179574.2138  0.0033 -4.6296 3  320.9904 97  71510 303481237      471334        syn-C2H3C(O)NH2, v=0
  179692.2821  0.0539 -6.6841 3 1514.7883195  71510 303973958      964057        syn-C2H3C(O)NH2, v=0
  179692.2821  0.0539 -6.6841 3 1514.7883195  71510 303973959      964056        syn-C2H3C(O)NH2, v=0
  179692.4939  0.0033 -6.1194 3  334.6122105  71510 30352 646      53 549        syn-C2H3C(O)NH2, v=0
  179692.5124  0.0033 -6.1194 3  334.6122105  71510 30352 746      53 449        syn-C2H3C(O)NH2, v=0
  179748.3333  0.0139 -5.0731 3 1173.9015183  71510 303912467      912368        syn-C2H3C(O)NH2, v=0
  179802.9521  0.0097 -6.6566 3  739.4950143  71510 303712249      721954        syn-C2H3C(O)NH2, v=0
  179813.5007  0.0080 -5.9342 3  529.8726 87  71510 3034336 7      443510        syn-C2H3C(O)NH2, v=0
  179813.5007  0.0080 -5.9342 3  529.8726 87  71510 3034336 8      4435 9        syn-C2H3C(O)NH2, v=0
  179848.9685  0.0200 -3.8083 3   28.2595 29 -71510 30314 6 8      13 5 9        syn-C2H3C(O)NH2, v=0
  179894.0723  0.0009 -5.4804 3   79.4475 51  71510 30325 421      24 420        syn-C2H3C(O)NH2, v=0
  179898.1135  0.0032 -3.9616 3  502.6842121  71510 303601446      601347        syn-C2H3C(O)NH2, v=0
  179980.5565  0.0010 -5.5308 3   83.1116 49  71510 30324 817      23 816        syn-C2H3C(O)NH2, v=0
  180009.3345  0.0200 -3.6170 3  212.9783 75 -71510 303371423      371324        syn-C2H3C(O)NH2, v=0
  180037.4725  0.0226 -6.7435 3  915.1620169  71510 303841371      851274        syn-C2H3C(O)NH2, v=0
  180037.4823  0.0226 -6.7435 3  915.1620169  71510 303841471      851174        syn-C2H3C(O)NH2, v=0
  180055.3897  0.0021 -3.8861 3  136.6862 69  71510 30334 331      34 232        syn-C2H3C(O)NH2, v=0
  180055.6412  0.0021 -3.8861 3  136.6862 69  71510 30334 431      34 332        syn-C2H3C(O)NH2, v=0
  180107.3620  0.0036 -6.1693 3  469.9358123  71510 30361 853      62 756        syn-C2H3C(O)NH2, v=0
  180107.3810  0.0036 -6.1693 3  469.9358123  71510 30361 953      62 656        syn-C2H3C(O)NH2, v=0
  180118.1849  0.0200 -3.8547 3  444.1816113 -71510 303561542      561443        syn-C2H3C(O)NH2, v=0
  180129.8978  0.0010 -5.5116 3   79.8045 49  71510 30324 718      23 717        syn-C2H3C(O)NH2, v=0
  180130.9713  0.0200 -3.6164 3  212.9739 75 -71510 303371424      371325        syn-C2H3C(O)NH2, v=0
  180213.2041  0.0017 -4.4237 3  285.4072 91  71510 303451234      441331        syn-C2H3C(O)NH2, v=0
  180218.5447  0.0399 -6.3716 3  967.4453125  71510 303624616      634519        syn-C2H3C(O)NH2, v=0
  180218.5447  0.0399 -6.3716 3  967.4453125  71510 303624617      634518        syn-C2H3C(O)NH2, v=0
  180223.1082  0.0200 -3.6939 3  313.8388 93 -71510 303461531      461432        syn-C2H3C(O)NH2, v=0
  180282.1561  0.0200 -3.7290 3  315.4233 97 -71510 303481138      481039        syn-C2H3C(O)NH2, v=0
  180372.1429  0.0617 -6.8128 3 1581.2022199  71510 303994059      984158        syn-C2H3C(O)NH2, v=0
  180372.1429  0.0617 -6.8128 3 1581.2022199  71510 303994060      984157        syn-C2H3C(O)NH2, v=0
  180476.8255  0.0068 -5.9420 3  492.4593 83  71510 3034135 6      4234 9        syn-C2H3C(O)NH2, v=0
  180476.8255  0.0068 -5.9420 3  492.4593 83  71510 3034135 7      4234 8        syn-C2H3C(O)NH2, v=0
  180498.0866  0.0200 -4.3972 3  302.1863 93 -71510 303461334      451431        syn-C2H3C(O)NH2, v=0
  180501.0070  0.0055 -6.7982 3  138.2452 71  71510 30335 233      36 136        syn-C2H3C(O)NH2, v=0
  180501.0109  0.0055 -6.7982 3  138.2452 71  71510 30335 333      36 036        syn-C2H3C(O)NH2, v=0
  180554.4884  0.0015 -6.9107 3  286.2001 93  71510 30346 937      46 938        syn-C2H3C(O)NH2, v=0
  180588.9778  0.0019 -4.8571 3  578.9442125  71510 303622142      612239        syn-C2H3C(O)NH2, v=0
  180593.0605  0.0200 -4.9334 3  620.0565129 -71510 303642243      632340        syn-C2H3C(O)NH2, v=0
  180597.5040  0.0200 -4.9333 3  620.0565129 -71510 303642242      632341        syn-C2H3C(O)NH2, v=0
  180601.6208  0.0200 -4.8570 3  578.9442125 -71510 303622141      612240        syn-C2H3C(O)NH2, v=0
  180687.4936  0.0022 -3.8518 3   98.5609 55  71510 30327 621      26 720        syn-C2H3C(O)NH2, v=0
  180691.6585  0.0027 -5.0125 3  662.6109133  71510 303662344      652441        syn-C2H3C(O)NH2, v=0
  180692.7629  0.0010 -5.4990 3   71.9980 47  71510 30323 617      22 616        syn-C2H3C(O)NH2, v=0
  180693.1973  0.0027 -5.0125 3  662.6109133  71510 303662343      652442        syn-C2H3C(O)NH2, v=0
  180697.1510  0.0017 -4.7836 3  539.2753121  71510 303602041      592138        syn-C2H3C(O)NH2, v=0
  180704.9382  0.0035 -6.4934 3  102.1594 51  71510 303251115      26 818        syn-C2H3C(O)NH2, v=0
  180709.5309  0.0200 -3.7136 3  286.1950 93 -71510 30346 937      46 838        syn-C2H3C(O)NH2, v=0
  180709.9193  0.0028 -6.1746 3  332.2877 95  71510 303471631      481336        syn-C2H3C(O)NH2, v=0
  180732.5718  0.0017 -4.7835 3  539.2752121  71510 303602040      592139        syn-C2H3C(O)NH2, v=0
  180869.6676  0.0035 -5.0946 3  706.6060137  71510 303682445      672542        syn-C2H3C(O)NH2, v=0
  180870.1921  0.0035 -5.0946 3  706.6060137  71510 303682444      672543        syn-C2H3C(O)NH2, v=0
  180890.9166  0.0065 -6.5364 3  660.4890135  71510 303672146      681851        syn-C2H3C(O)NH2, v=0
  180935.8359  0.0200 -4.7131 3  501.0510117 -71510 303581940      572037        syn-C2H3C(O)NH2, v=0
  180966.0775  0.0346 -6.2983 3  916.1639121  71510 303604515      614418        syn-C2H3C(O)NH2, v=0
  180966.0775  0.0346 -6.2983 3  916.1639121  71510 303604516      614417        syn-C2H3C(O)NH2, v=0
  181032.8149  0.0200 -4.7126 3  501.0508117 -71510 303581939      572038        syn-C2H3C(O)NH2, v=0
  181034.2320  0.0023 -3.8249 3  403.8261109  71510 303541242      541143        syn-C2H3C(O)NH2, v=0
  181054.0815  0.0200 -3.5437 3   79.4475 51 -71510 30325 521      24 420        syn-C2H3C(O)NH2, v=0
  181057.8755  0.0200 -3.7002 3  325.6123 95 -71510 303471533      471434        syn-C2H3C(O)NH2, v=0
  181114.7164  0.0044 -5.1797 3  752.0409141  71510 303702546      692643        syn-C2H3C(O)NH2, v=0
  181114.8929  0.0044 -5.1797 3  752.0409141  71510 303702545      692644        syn-C2H3C(O)NH2, v=0
  181129.6417  0.0059 -5.9677 3  456.4854 79  71510 3033934 5      4033 8        syn-C2H3C(O)NH2, v=0
  181129.6417  0.0059 -5.9677 3  456.4854 79  71510 3033934 6      4033 7        syn-C2H3C(O)NH2, v=0
  181166.3236  0.0011 -5.5252 3   83.1581 49  71510 30324 816      23 815        syn-C2H3C(O)NH2, v=0
  181186.3909  0.0150 -4.6465 3  934.6008163  71510 303812259      812160        syn-C2H3C(O)NH2, v=0
  181191.5645  0.0027 -3.8864 3  451.9565115  71510 303571344      571245        syn-C2H3C(O)NH2, v=0
  181309.6073  0.0007 -3.6103 3  203.7384 73  71510 303361422      361323        syn-C2H3C(O)NH2, v=0
  181310.1697  0.0015 -3.7881 3  395.1532105  71510 303521636      521537        syn-C2H3C(O)NH2, v=0
  181316.9024  0.0016 -4.6455 3  464.2730113  71510 303561839      551936        syn-C2H3C(O)NH2, v=0
  181359.5263  0.0026 -4.2844 3  103.3776 63  71510 30331 130      31 031        syn-C2H3C(O)NH2, v=0
  181359.5277  0.0026 -4.2844 3  103.3776 63  71510 30331 230      31 131        syn-C2H3C(O)NH2, v=0
  181369.8583  0.0013 -4.8817 3   57.3107 41  71510 30320 713      20 416        syn-C2H3C(O)NH2, v=0
  181371.6750  0.0200 -3.6100 3  203.7362 73 -71510 303361423      361324        syn-C2H3C(O)NH2, v=0
  181382.8169  0.0060 -6.4527 3  554.5414123  71510 303612042      621745        syn-C2H3C(O)NH2, v=0
  181416.8390  0.0056 -5.2677 3  798.9144145  71510 303722647      712744        syn-C2H3C(O)NH2, v=0
  181416.8977  0.0056 -5.2677 3  798.9144145  71510 303722646      712745        syn-C2H3C(O)NH2, v=0
  181576.1782  0.0016 -4.6442 3  464.2726113  71510 303561838      551937        syn-C2H3C(O)NH2, v=0
  181593.9932  0.0032 -6.2117 3  389.0070103  71510 303511734      521439        syn-C2H3C(O)NH2, v=0
  181639.8941  0.0049 -6.4310 3  585.9338127  71510 303632043      641748        syn-C2H3C(O)NH2, v=0
  181676.4114  0.0211 -4.5937 3  901.9121161  71510 303802060      801961        syn-C2H3C(O)NH2, v=0
  181705.1945  0.0299 -6.2308 3  866.3141117  71510 303584414      594317        syn-C2H3C(O)NH2, v=0
  181705.1945  0.0299 -6.2308 3  866.3141117  71510 303584415      594316        syn-C2H3C(O)NH2, v=0
  181763.9610  0.0019 -6.8880 3  158.4613 73  71510 30336 432      36 433        syn-C2H3C(O)NH2, v=0
  181764.0271  0.0019 -3.7990 3  158.4613 73  71510 30336 432      36 333        syn-C2H3C(O)NH2, v=0
  181765.5372  0.0019 -3.7990 3  158.4613 73  71510 30336 532      36 433        syn-C2H3C(O)NH2, v=0
  181765.6033  0.0019 -6.8880 3  158.4613 73  71510 30336 532      36 333        syn-C2H3C(O)NH2, v=0
  181767.9978  0.0071 -5.3586 3  847.2253149  71510 303742748      732845        syn-C2H3C(O)NH2, v=0
  181768.0171  0.0071 -5.3586 3  847.2253149  71510 303742747      732846        syn-C2H3C(O)NH2, v=0
  181771.5996  0.0051 -6.0165 3  421.9517 75  71510 3033733 4      3832 7        syn-C2H3C(O)NH2, v=0
  181771.5996  0.0051 -6.0165 3  421.9517 75  71510 3033733 5      3832 6        syn-C2H3C(O)NH2, v=0
  181790.7671  0.0015 -4.0095 3   29.5856 31  71510 30315 510      14 411        syn-C2H3C(O)NH2, v=0
  181827.5889  0.0016 -4.5811 3  428.9433109  71510 303541738      531835        syn-C2H3C(O)NH2, v=0
  181959.6768  0.0200 -3.7079 3  286.2001 93 -71510 303461037      46 938        syn-C2H3C(O)NH2, v=0
  181993.6783  0.0092 -6.4539 3  723.2469151  71510 303751164      761067        syn-C2H3C(O)NH2, v=0
  181993.6902  0.0092 -6.4539 3  723.2469151  71510 303751264      76 967        syn-C2H3C(O)NH2, v=0
  182020.6794  0.0036 -6.2677 3  450.1897111  71510 303551837      561542        syn-C2H3C(O)NH2, v=0
  182025.6095  0.0040 -6.3412 3  515.8330119  71510 303591940      601645        syn-C2H3C(O)NH2, v=0
  182094.3192  0.0037 -6.1551 3  280.6320 97  71510 30348 543      49 446        syn-C2H3C(O)NH2, v=0
  182094.3314  0.0037 -6.1551 3  280.6320 97  71510 30348 643      49 346        syn-C2H3C(O)NH2, v=0
  182096.3865  0.0356 -6.9247 3 1029.7825179  71510 303891475      901378        syn-C2H3C(O)NH2, v=0
  182096.3930  0.0356 -6.9247 3 1029.7825179  71510 303891575      901278        syn-C2H3C(O)NH2, v=0
  182114.7543  0.0014 -6.9038 3  286.1950 93  71510 303461037      46 838        syn-C2H3C(O)NH2, v=0
  182135.5904  0.0200 -4.1577 3  644.6077135 -71510 303671948      671849        syn-C2H3C(O)NH2, v=0
  182161.6700  0.0089 -5.4525 3  896.9726153  71510 303762849      752946        syn-C2H3C(O)NH2, v=0
  182161.6763  0.0089 -5.4525 3  896.9726153  71510 303762848      752947        syn-C2H3C(O)NH2, v=0
  182188.3065  0.0328 -5.1539 3 1222.5073187  71510 303932469      932370        syn-C2H3C(O)NH2, v=0
  182360.1427  0.0014 -6.8184 3  209.0213 51  71510 3032524 1      2424 0        syn-C2H3C(O)NH2, v=0
  182360.1427  0.0014 -6.8184 3  209.0213 51  71510 3032524 2      2424 1        syn-C2H3C(O)NH2, v=0
  182375.5214  0.0028 -6.2909 3  142.0310 61  71510 303301218      31 923        syn-C2H3C(O)NH2, v=0
  182388.9392  0.0015 -4.5208 3  395.0644105  71510 303521637      511734        syn-C2H3C(O)NH2, v=0
  182402.3223  0.0046 -6.0972 3  388.8588 71  71510 3033532 3      3631 6        syn-C2H3C(O)NH2, v=0
  182402.3223  0.0046 -6.0972 3  388.8588 71  71510 3033532 4      3631 5        syn-C2H3C(O)NH2, v=0
  182428.3593  0.0385 -5.0128 3 1143.8164181  71510 303902367      902268        syn-C2H3C(O)NH2, v=0
  182430.9329  0.0013 -6.5029 3  197.9309 51  71510 3032523 2      2423 1        syn-C2H3C(O)NH2, v=0
  182430.9329  0.0013 -6.5029 3  197.9309 51  71510 3032523 3      2423 2        syn-C2H3C(O)NH2, v=0
  182435.7365  0.0258 -6.1694 3  817.8970113  71510 303564313      574216        syn-C2H3C(O)NH2, v=0
  182435.7365  0.0258 -6.1694 3  817.8970113  71510 303564314      574215        syn-C2H3C(O)NH2, v=0
  182466.4341  0.0200 -3.6055 3  194.7647 71 -71510 303351421      351322        syn-C2H3C(O)NH2, v=0
  182471.4335  0.0014 -4.4223 3  331.6769 97  71510 303481435      471532        syn-C2H3C(O)NH2, v=0
  182497.2298  0.0200 -3.6053 3  194.7635 71 -71510 303351422      351323        syn-C2H3C(O)NH2, v=0
  182501.5073  0.0016 -4.5778 3  428.9420109  71510 303541737      531836        syn-C2H3C(O)NH2, v=0
  182509.6988  0.0013 -6.3134 3  187.3139 51  71510 3032522 3      2422 2        syn-C2H3C(O)NH2, v=0
  182509.6988  0.0013 -6.3134 3  187.3139 51  71510 3032522 4      2422 3        syn-C2H3C(O)NH2, v=0
  182536.3034  0.0014 -4.7939 3   62.5704 43  71510 30321 714      21 417        syn-C2H3C(O)NH2, v=0
  182536.3984  0.0029 -6.6661 3   74.0467 43  71510 303211011      22 716        syn-C2H3C(O)NH2, v=0
  182543.4241  0.0200 -3.8268 3  423.9561111 -71510 303551442      551343        syn-C2H3C(O)NH2, v=0
  182592.5191  0.0109 -5.5495 3  948.1552157  71510 303782950      773047        syn-C2H3C(O)NH2, v=0
  182592.5211  0.0109 -5.5495 3  948.1552157  71510 303782949      773048        syn-C2H3C(O)NH2, v=0
  182598.1048  0.0012 -6.1763 3  177.1707 51  71510 3032521 4      2421 3        syn-C2H3C(O)NH2, v=0
  182598.1048  0.0012 -6.1763 3  177.1707 51  71510 3032521 5      2421 4        syn-C2H3C(O)NH2, v=0
  182698.2516  0.0012 -6.0683 3  167.5018 51  71510 3032520 5      2420 4        syn-C2H3C(O)NH2, v=0
  182698.2516  0.0012 -6.0683 3  167.5018 51  71510 3032520 6      2420 5        syn-C2H3C(O)NH2, v=0
  182699.4785  0.0014 -6.8701 3  258.1826 89  71510 30344 836      44 837        syn-C2H3C(O)NH2, v=0
  182708.5167  0.0017 -6.7410 3   13.3849 19  71510 303 9 6 3       9 3 6        syn-C2H3C(O)NH2, v=0
  182742.0723  0.0014 -3.6986 3  258.1812 89  71510 30344 836      44 737        syn-C2H3C(O)NH2, v=0
  182774.0941  0.0200 -4.4665 3  362.6401101 -71510 303501536      491633        syn-C2H3C(O)NH2, v=0
  182787.7316  0.0083 -6.4913 3  495.6762119  71510 303591643      601348        syn-C2H3C(O)NH2, v=0
  182812.8228  0.0011 -5.9792 3  158.3077 51  71510 3032519 6      2419 5        syn-C2H3C(O)NH2, v=0
  182812.8228  0.0011 -5.9792 3  158.3077 51  71510 3032519 7      2419 6        syn-C2H3C(O)NH2, v=0
  182832.5780  0.0070 -4.2349 3  688.1304141  71510 303701753      701654        syn-C2H3C(O)NH2, v=0
  182887.4294  0.0026 -4.5308 3  308.7985 95  71510 303471236      461333        syn-C2H3C(O)NH2, v=0
  182945.2947  0.0011 -5.9035 3  149.5892 51  71510 3032518 7      2418 6        syn-C2H3C(O)NH2, v=0
  182945.2947  0.0011 -5.9035 3  149.5892 51  71510 3032518 8      2418 7        syn-C2H3C(O)NH2, v=0
  182953.0585  0.0021 -4.4631 3  296.9400 93  71510 303461235      451332        syn-C2H3C(O)NH2, v=0
  182972.1730  0.0017 -6.8523 3  181.5114 77  71510 30338 533      38 534        syn-C2H3C(O)NH2, v=0
  182972.5989  0.0017 -3.7445 3  181.5114 77  71510 30338 533      38 434        syn-C2H3C(O)NH2, v=0
  182980.1280  0.0200 -3.7445 3  181.5114 77 -71510 30338 633      38 534        syn-C2H3C(O)NH2, v=0
  182980.5543  0.0017 -6.8522 3  181.5114 77  71510 30338 633      38 434        syn-C2H3C(O)NH2, v=0
  183008.8079  0.0200 -3.6812 3  313.7318 93 -71510 303461532      461433        syn-C2H3C(O)NH2, v=0
  183021.4056  0.0042 -6.2254 3  357.2071 67  71510 3033331 2      3430 5        syn-C2H3C(O)NH2, v=0
  183021.4056  0.0042 -6.2254 3  357.2071 67  71510 3033331 3      3430 4        syn-C2H3C(O)NH2, v=0
  183040.4795  0.0016 -5.0047 3   52.2378 39  71510 30319 712      19 415        syn-C2H3C(O)NH2, v=0
  183056.1409  0.0134 -5.6494 3 1000.7721161  71510 303803051      793148        syn-C2H3C(O)NH2, v=0
  183056.1415  0.0134 -5.6494 3 1000.7721161  71510 303803050      793149        syn-C2H3C(O)NH2, v=0
  183059.8274  0.0029 -4.2084 3  193.3497 75  71510 303371027      361126        syn-C2H3C(O)NH2, v=0
  183094.4806  0.0045 -6.2439 3  553.4868133  71510 30366 957      67 860        syn-C2H3C(O)NH2, v=0
  183094.4940  0.0045 -6.2439 3  553.4868133  71510 303661057      67 760        syn-C2H3C(O)NH2, v=0
  183100.2413  0.0011 -5.8378 3  141.3472 51  71510 3032517 8      2417 7        syn-C2H3C(O)NH2, v=0
  183100.2413  0.0011 -5.8378 3  141.3472 51  71510 3032517 9      2417 8        syn-C2H3C(O)NH2, v=0
  183129.6878  0.0019 -5.3406 3   12.1005 23  71510 30311 3 9      10 010        syn-C2H3C(O)NH2, v=0
  183145.6285  0.0860 -6.8747 3 1286.9079147  71510 303735221      745124        syn-C2H3C(O)NH2, v=0
  183145.6285  0.0860 -6.8747 3 1286.9079147  71510 303735222      745123        syn-C2H3C(O)NH2, v=0
  183153.8352  0.0014 -3.6968 3  258.1826 89  71510 30344 936      44 837        syn-C2H3C(O)NH2, v=0
  183157.5303  0.0221 -6.1147 3  770.9134109  71510 303544212      554115        syn-C2H3C(O)NH2, v=0
  183157.5303  0.0221 -6.1147 3  770.9134109  71510 303544213      554114        syn-C2H3C(O)NH2, v=0
  183196.4291  0.0014 -6.8679 3  258.1812 89  71510 30344 936      44 737        syn-C2H3C(O)NH2, v=0
  183196.7298  0.0033 -6.1315 3  405.9318115  71510 30357 750      58 653        syn-C2H3C(O)NH2, v=0
  183196.7436  0.0033 -6.1315 3  405.9318115  71510 30357 850      58 553        syn-C2H3C(O)NH2, v=0
  183283.7927  0.0011 -5.7801 3  133.5829 51  71510 3032516 9      2416 8        syn-C2H3C(O)NH2, v=0
  183283.7927  0.0011 -5.7801 3  133.5829 51  71510 303251610      2416 9        syn-C2H3C(O)NH2, v=0
  183287.2147  0.0200 -3.6707 3  302.1863 91 -71510 303451530      451431        syn-C2H3C(O)NH2, v=0
  183294.4489  0.0009 -5.4758 3   76.1694 49  71510 30324 519      23 518        syn-C2H3C(O)NH2, v=0
  183328.4740  0.0200 -3.7886 3  390.5585107 -71510 303531341      531242        syn-C2H3C(O)NH2, v=0
  183500.3882  0.0200 -3.6024 3  186.0549 69 -71510 303341420      341321        syn-C2H3C(O)NH2, v=0
  183504.3418  0.0010 -5.7288 3  126.2979 51  71510 303251510      2415 9        syn-C2H3C(O)NH2, v=0
  183504.3418  0.0010 -5.7288 3  126.2979 51  71510 303251511      241510        syn-C2H3C(O)NH2, v=0
  183515.2290  0.0200 -3.6023 3  186.0544 69 -71510 303341421      341322        syn-C2H3C(O)NH2, v=0
  183548.8711  0.0162 -5.7523 3 1054.8220165  71510 303823152      813249        syn-C2H3C(O)NH2, v=0
  183548.8713  0.0162 -5.7523 3 1054.8220165  71510 303823151      813250        syn-C2H3C(O)NH2, v=0
  183589.0047  0.0014 -6.8467 3  231.3856 85  71510 30342 735      42 736        syn-C2H3C(O)NH2, v=0
  183599.4921  0.0014 -3.6981 3  231.3853 85  71510 30342 735      42 636        syn-C2H3C(O)NH2, v=0
  183615.4006  0.0016 -6.8401 3  205.8239 81  71510 30340 634      40 635        syn-C2H3C(O)NH2, v=0
  183617.6780  0.0016 -3.7126 3  205.8238 81  71510 30340 634      40 535        syn-C2H3C(O)NH2, v=0
  183628.4171  0.0039 -6.4343 3  326.9973 63  71510 3033130 1      3229 4        syn-C2H3C(O)NH2, v=0
  183628.4171  0.0039 -6.4343 3  326.9973 63  71510 3033130 2      3229 3        syn-C2H3C(O)NH2, v=0
  183649.9887  0.0016 -3.7124 3  205.8239 81  71510 30340 734      40 635        syn-C2H3C(O)NH2, v=0
  183652.2661  0.0016 -6.8399 3  205.8238 81  71510 30340 734      40 535        syn-C2H3C(O)NH2, v=0
  183709.8811  0.0200 -3.7996 3   31.8388 31 -71510 30315 610      14 5 9        syn-C2H3C(O)NH2, v=0
  183711.1161  0.0200 -3.8637 3  458.5348115 -71510 303571543      571444        syn-C2H3C(O)NH2, v=0
  183721.5353  0.0200 -3.6976 3  231.3856 85 -71510 30342 835      42 736        syn-C2H3C(O)NH2, v=0
  183732.0386  0.0014 -6.8461 3  231.3853 85  71510 30342 835      42 636        syn-C2H3C(O)NH2, v=0
  183773.6811  0.0010 -5.6830 3  119.4945 51  71510 303251412      241411        syn-C2H3C(O)NH2, v=0
  183773.6812  0.0010 -5.6830 3  119.4945 51  71510 303251411      241410        syn-C2H3C(O)NH2, v=0
  183855.7164  0.0013 -5.0789 3   13.8505 23  71510 30311 4 8      10 1 9        syn-C2H3C(O)NH2, v=0
  183870.3877  0.0188 -6.0673 3  725.3642105  71510 303524111      534014        syn-C2H3C(O)NH2, v=0
  183870.3877  0.0188 -6.0673 3  725.3642105  71510 303524112      534013        syn-C2H3C(O)NH2, v=0
  183879.1536  0.0035 -6.3611 3  134.5429 59  71510 303291218      30 921        syn-C2H3C(O)NH2, v=0
  183893.2559  0.0052 -6.3643 3  486.4113115  71510 303571939      581642        syn-C2H3C(O)NH2, v=0
  183924.5816  0.0200 -3.8842 3  471.3954115 -71510 303571740      571641        syn-C2H3C(O)NH2, v=0
  183935.3740  0.0764 -6.7749 3 1227.5417143  71510 303715120      725023        syn-C2H3C(O)NH2, v=0
  183935.3740  0.0764 -6.7749 3 1227.5417143  71510 303715121      725022        syn-C2H3C(O)NH2, v=0
  183965.6649  0.0024 -4.0141 3  123.1718 67  71510 30333 231      33 132        syn-C2H3C(O)NH2, v=0
  183965.6810  0.0024 -4.0141 3  123.1718 67  71510 30333 331      33 232        syn-C2H3C(O)NH2, v=0
  184067.6380  0.0194 -5.8582 3 1110.3039169  71510 303843253      833350        syn-C2H3C(O)NH2, v=0
  184067.6381  0.0194 -5.8582 3 1110.3039169  71510 303843252      833351        syn-C2H3C(O)NH2, v=0
  184069.2067  0.0043 -6.2473 3  231.1688 89  71510 30344 440      45 343        syn-C2H3C(O)NH2, v=0
  184069.2141  0.0043 -6.2473 3  231.1688 89  71510 30344 540      45 243        syn-C2H3C(O)NH2, v=0
  184082.2950  0.0016 -4.5124 3  395.0608105  71510 303521636      511735        syn-C2H3C(O)NH2, v=0
  184107.1396  0.0069 -6.4766 3  193.3148 75  71510 303371027      38 732        syn-C2H3C(O)NH2, v=0
  184108.9194  0.0010 -5.6418 3  113.1758 51  71510 303251313      241312        syn-C2H3C(O)NH2, v=0
  184108.9224  0.0010 -5.6418 3  113.1758 51  71510 303251312      241311        syn-C2H3C(O)NH2, v=0
  184145.3448  0.0028 -4.0082 3  554.5414125  71510 303621844      621745        syn-C2H3C(O)NH2, v=0
  184222.8968  0.0037 -6.8207 3  298.2297 59  71510 3032929 0      3028 3        syn-C2H3C(O)NH2, v=0
  184222.8968  0.0037 -6.8207 3  298.2297 59  71510 3032929 1      3028 2        syn-C2H3C(O)NH2, v=0
  184390.6537  0.0151 -6.5976 3  825.7015161  71510 303801268      811171        syn-C2H3C(O)NH2, v=0
  184390.6616  0.0151 -6.5976 3  825.7015161  71510 303801368      811071        syn-C2H3C(O)NH2, v=0
  184426.9724  0.0200 -3.6011 3  177.6076 67 -71510 303331419      331320        syn-C2H3C(O)NH2, v=0
  184433.9313  0.0200 -3.6010 3  177.6074 67 -71510 303331420      331321        syn-C2H3C(O)NH2, v=0
  184453.1612  0.0200 -4.3501 3  290.7873 91 -71510 303451332      441431        syn-C2H3C(O)NH2, v=0
  184477.9670  0.0009 -5.4702 3   82.7294 51  71510 30325 620      24 619        syn-C2H3C(O)NH2, v=0
  184530.1744  0.0200 -3.5037 3   85.4868 53 -71510 30326 422      25 521        syn-C2H3C(O)NH2, v=0
  184535.9015  0.0010 -5.6045 3  107.3463 51  71510 303251214      241213        syn-C2H3C(O)NH2, v=0
  184535.9779  0.0010 -5.6045 3  107.3463 51  71510 303251213      241212        syn-C2H3C(O)NH2, v=0
  184574.1040  0.0160 -6.0280 3  681.2503101  71510 303504010      513913        syn-C2H3C(O)NH2, v=0
  184574.1040  0.0160 -6.0280 3  681.2503101  71510 303504011      513912        syn-C2H3C(O)NH2, v=0
  184582.7699  0.0200 -3.8423 3  450.1897113 -71510 303561641      561542        syn-C2H3C(O)NH2, v=0
  184609.8489  0.0231 -5.9671 3 1167.2168173  71510 303863353      853452        syn-C2H3C(O)NH2, v=0
  184609.8489  0.0231 -5.9671 3 1167.2168173  71510 303863354      853451        syn-C2H3C(O)NH2, v=0
  184717.2439  0.0676 -6.6797 3 1169.6012139  71510 303695019      704922        syn-C2H3C(O)NH2, v=0
  184717.2439  0.0676 -6.6797 3 1169.6012139  71510 303695020      704921        syn-C2H3C(O)NH2, v=0
  184776.0043  0.0200 -3.8623 3  464.6628115 -71510 303571642      571543        syn-C2H3C(O)NH2, v=0
  184831.4103  0.0200 -3.2442 3   90.3251 59 -71510 30329 128      28 227        syn-C2H3C(O)NH2, v=0
  184831.4164  0.0009 -5.3986 3   90.3251 59  71510 30329 228      28 227        syn-C2H3C(O)NH2, v=0
  184831.4233  0.0009 -5.3986 3   90.3251 59  71510 30329 128      28 127        syn-C2H3C(O)NH2, v=0
  184831.4103  0.0200 -3.2442 3   90.3251 59 -71510 30329 228      28 127        syn-C2H3C(O)NH2, v=0
  184832.6494  0.0200 -3.1872 3   90.8448 61 -71510 30330 030      29 129        syn-C2H3C(O)NH2, v=0
  184832.6444  0.0009 -5.3793 3   90.8448 61  71510 30330 130      29 129        syn-C2H3C(O)NH2, v=0
  184832.6445  0.0009 -5.3793 3   90.8448 61  71510 30330 030      29 029        syn-C2H3C(O)NH2, v=0
  184832.6494  0.0200 -3.1872 3   90.8448 61 -71510 30330 130      29 029        syn-C2H3C(O)NH2, v=0
  184862.9072  0.0023 -5.9745 3   22.0932 27  71510 30313 5 9      13 212        syn-C2H3C(O)NH2, v=0
  184866.1897  0.0200 -3.3103 3   89.2809 57 -71510 30328 226      27 325        syn-C2H3C(O)NH2, v=0
  184866.7693  0.0009 -5.4172 3   89.2809 57  71510 30328 326      27 325        syn-C2H3C(O)NH2, v=0
  184867.3142  0.0009 -5.4172 3   89.2808 57  71510 30328 226      27 225        syn-C2H3C(O)NH2, v=0
  184867.8312  0.0200 -3.3103 3   89.2808 57 -71510 30328 326      27 225        syn-C2H3C(O)NH2, v=0
  184904.2848  0.0016 -3.7320 3  327.2874 99  71510 303491039      49 940        syn-C2H3C(O)NH2, v=0
  184944.7347  0.0200 -3.6632 3  302.1234 91 -71510 303451531      451432        syn-C2H3C(O)NH2, v=0
  184951.2863  0.0247 -5.0134 3 1149.9015181  71510 303902466      902367        syn-C2H3C(O)NH2, v=0
  184969.8851  0.0200 -3.3912 3   87.6822 55 -71510 30327 324      26 423        syn-C2H3C(O)NH2, v=0
  184987.9024  0.0200 -3.6485 3   88.8829 53 -71510 30326 521      25 620        syn-C2H3C(O)NH2, v=0
  184995.6445  0.0009 -5.4345 3   87.6822 55  71510 30327 424      26 423        syn-C2H3C(O)NH2, v=0
  184997.6132  0.0047 -5.7620 3   32.0983 33  71510 30316 412      16 115        syn-C2H3C(O)NH2, v=0
  185017.9733  0.0009 -5.4344 3   87.6806 55  71510 30327 324      26 323        syn-C2H3C(O)NH2, v=0
  185043.6519  0.0200 -3.3908 3   87.6806 55 -71510 30327 424      26 323        syn-C2H3C(O)NH2, v=0
  185095.4047  0.0010 -5.5705 3  102.0129 51  71510 303251115      241114        syn-C2H3C(O)NH2, v=0
  185095.4857  0.0200 -3.8209 3  435.9627111 -71510 303551640      551541        syn-C2H3C(O)NH2, v=0
  185096.9355  0.0010 -5.5704 3  102.0130 51  71510 303251114      241113        syn-C2H3C(O)NH2, v=0
  185105.4623  0.0078 -6.7115 3  125.5798 61  71510 30330 822      31 527        syn-C2H3C(O)NH2, v=0
  185108.0646  0.0200 -3.7526 3  358.3369103 -71510 303511240      511141        syn-C2H3C(O)NH2, v=0
  185173.3015  0.0273 -6.0791 3 1225.5593177  71510 303883455      873552        syn-C2H3C(O)NH2, v=0
  185173.3016  0.0273 -6.0791 3 1225.5593177  71510 303883454      873553        syn-C2H3C(O)NH2, v=0
  185206.8894  0.0009 -5.4504 3   85.4868 53  71510 30326 522      25 521        syn-C2H3C(O)NH2, v=0
  185251.1023  0.0099 -4.4453 3  825.2068153  71510 303762155      762056        syn-C2H3C(O)NH2, v=0
  185258.5123  0.0200 -3.6016 3  169.4211 65 -71510 303321418      321319        syn-C2H3C(O)NH2, v=0
  185261.6608  0.0200 -3.6016 3  169.4210 65 -71510 303321419      321320        syn-C2H3C(O)NH2, v=0
  185268.4571  0.0136 -5.9976 3  638.5724 97  71510 3034839 9      493812        syn-C2H3C(O)NH2, v=0
  185268.4571  0.0136 -5.9976 3  638.5724 97  71510 303483910      493811        syn-C2H3C(O)NH2, v=0
  185367.7201  0.0203 -5.2903 3 1303.6930193  71510 303962571      962472        syn-C2H3C(O)NH2, v=0
  185421.1300  0.0375 -4.8690 3 1067.6140175  71510 303872265      872166        syn-C2H3C(O)NH2, v=0
  185491.1389  0.0597 -6.5892 3 1113.0875135  71510 303674918      684821        syn-C2H3C(O)NH2, v=0
  185491.1389  0.0597 -6.5892 3 1113.0875135  71510 303674919      684820        syn-C2H3C(O)NH2, v=0
  185508.5678  0.0028 -4.7904 3   19.1641 27  71510 30313 310      12 211        syn-C2H3C(O)NH2, v=0
  185575.2510  0.0050 -6.4295 3  186.2303 81  71510 30340 337      41 240        syn-C2H3C(O)NH2, v=0
  185575.2550  0.0050 -6.4295 3  186.2303 81  71510 30340 437      41 140        syn-C2H3C(O)NH2, v=0
  185690.1990  0.0009 -5.4479 3   85.4481 53  71510 30326 422      25 421        syn-C2H3C(O)NH2, v=0
  185735.6162  0.0012 -5.4836 3   80.1377 49  71510 30324 717      23 716        syn-C2H3C(O)NH2, v=0
  185756.1153  0.0321 -6.1940 3 1285.3304181  71510 303903556      893653        syn-C2H3C(O)NH2, v=0
  185756.1154  0.0321 -6.1940 3 1285.3304181  71510 303903555      893654        syn-C2H3C(O)NH2, v=0
  185780.0728  0.0200 -3.8804 3  479.3740117 -71510 303581643      581544        syn-C2H3C(O)NH2, v=0
  185850.1041  0.0010 -5.5392 3   97.1867 51  71510 303251016      241015        syn-C2H3C(O)NH2, v=0
  185852.5420  0.0200 -3.6509 3  290.8234 89 -71510 303441529      441430        syn-C2H3C(O)NH2, v=0
  185858.8826  0.0045 -6.2940 3  422.7424107  71510 303531836      541539        syn-C2H3C(O)NH2, v=0
  185873.5947  0.0010 -5.5391 3   97.1874 51  71510 303251015      241014        syn-C2H3C(O)NH2, v=0
  185881.9278  0.0063 -6.3446 3  643.7489143  71510 303711061      72 964        syn-C2H3C(O)NH2, v=0
  185881.9371  0.0063 -6.3446 3  643.7489143  71510 303711161      72 864        syn-C2H3C(O)NH2, v=0
  185928.8161  0.0033 -6.1255 3  346.4317107  71510 30353 647      54 550        syn-C2H3C(O)NH2, v=0
  185928.8257  0.0033 -6.1255 3  346.4317107  71510 30353 747      54 450        syn-C2H3C(O)NH2, v=0
  185953.2065  0.0115 -5.9775 3  597.3313 93  71510 3034638 8      473711        syn-C2H3C(O)NH2, v=0
  185953.2065  0.0115 -5.9775 3  597.3313 93  71510 3034638 9      473710        syn-C2H3C(O)NH2, v=0
  186004.8178  0.0200 -3.6039 3  161.4941 63 -71510 303311417      311318        syn-C2H3C(O)NH2, v=0
  186006.2033  0.0200 -3.6039 3  161.4941 63 -71510 303311418      311319        syn-C2H3C(O)NH2, v=0
  186019.2498  0.0026 -6.2126 3  179.8500 69  71510 303341321      351026        syn-C2H3C(O)NH2, v=0
  186021.1667  0.0107 -5.4498 3  639.8970137  71510 303681653      671750        syn-C2H3C(O)NH2, v=0
  186057.5980  0.0176 -5.2418 3 1278.4331191  71510 303952570      952471        syn-C2H3C(O)NH2, v=0
  186081.2540  0.0200 -3.5728 3   23.8854 19 -71510 303 9 9 0       8 8 1        syn-C2H3C(O)NH2, v=0
  186081.2540  0.0200 -3.5728 3   23.8854 19 -71510 303 9 9 1       8 8 0        syn-C2H3C(O)NH2, v=0
  186116.6189  0.0034 -6.2749 3  171.3992 67  71510 303331321      341024        syn-C2H3C(O)NH2, v=0
  186166.1633  0.0021 -3.8730 3  144.2660 71  71510 30335 332      35 233        syn-C2H3C(O)NH2, v=0
  186166.2908  0.0021 -3.8730 3  144.2660 71  71510 30335 432      35 333        syn-C2H3C(O)NH2, v=0
  186185.8930  0.0200 -3.7983 3  421.9889109 -71510 303541639      541540        syn-C2H3C(O)NH2, v=0
  186256.9505  0.0525 -6.5036 3 1058.0017131  71510 303654817      664720        syn-C2H3C(O)NH2, v=0
  186256.9505  0.0525 -6.5036 3 1058.0017131  71510 303654818      664719        syn-C2H3C(O)NH2, v=0
  186294.0200  0.0200 -3.7518 3  381.8516103 -71510 303511635      511536        syn-C2H3C(O)NH2, v=0
  186356.6759  0.0374 -6.3120 3 1346.5289185  71510 303923656      913755        syn-C2H3C(O)NH2, v=0
  186356.6759  0.0374 -6.3120 3 1346.5289185  71510 303923657      913754        syn-C2H3C(O)NH2, v=0
  186366.8928  0.0200 -3.4945 3   85.4481 53 -71510 30326 522      25 421        syn-C2H3C(O)NH2, v=0
  186432.7180  0.0066 -6.3877 3  327.2975 97  71510 303481335      491040        syn-C2H3C(O)NH2, v=0
  186451.0207  0.0038 -6.1788 3  483.9756125  71510 30362 854      63 757        syn-C2H3C(O)NH2, v=0
  186451.0307  0.0038 -6.1788 3  483.9756125  71510 30362 954      63 657        syn-C2H3C(O)NH2, v=0
  186485.3369  0.0200 -3.6303 3   24.9837 23 -71510 30311 8 4      10 7 3        syn-C2H3C(O)NH2, v=0
  186485.3369  0.0200 -3.6303 3   24.9837 23 -71510 30311 8 3      10 7 4        syn-C2H3C(O)NH2, v=0
  186562.4627  0.0056 -6.7987 3  145.8247 73  71510 30336 234      37 137        syn-C2H3C(O)NH2, v=0
  186562.4646  0.0056 -6.7987 3  145.8247 73  71510 30336 334      37 037        syn-C2H3C(O)NH2, v=0
  186628.0917  0.0097 -5.9695 3  557.5278 89  71510 3034437 7      453610        syn-C2H3C(O)NH2, v=0
  186628.0917  0.0097 -5.9695 3  557.5278 89  71510 3034437 8      4536 9        syn-C2H3C(O)NH2, v=0
  186631.2116  0.0246 -6.7617 3  934.8465171  71510 303851372      861275        syn-C2H3C(O)NH2, v=0
  186631.2169  0.0246 -6.7617 3  934.8465171  71510 303851472      861175        syn-C2H3C(O)NH2, v=0
  186633.0283  0.0200 -3.6936 3   27.5838 27 -71510 30313 7 7      12 6 6        syn-C2H3C(O)NH2, v=0
  186674.4054  0.0200 -3.6082 3  153.8253 61 -71510 303301416      301317        syn-C2H3C(O)NH2, v=0
  186674.9978  0.0008 -3.6082 3  153.8253 61  71510 303301417      301318        syn-C2H3C(O)NH2, v=0
  186680.7401  0.0200 -3.6934 3   27.5824 27 -71510 30313 7 6      12 6 7        syn-C2H3C(O)NH2, v=0
  186813.2515  0.0200 -3.6466 3  290.7873 89 -71510 303441530      441431        syn-C2H3C(O)NH2, v=0
  186846.4638  0.0010 -5.5102 3   92.8842 51  71510 30325 917      24 916        syn-C2H3C(O)NH2, v=0
  186852.7742  0.0200 -4.4459 3  362.6304101 -71510 303501535      491634        syn-C2H3C(O)NH2, v=0
  186957.4769  0.0020 -4.7446 3   68.0122 45  71510 30322 715      22 418        syn-C2H3C(O)NH2, v=0
  186973.5912  0.0434 -6.4330 3 1409.1536189  71510 303943757      933856        syn-C2H3C(O)NH2, v=0
  186973.5912  0.0434 -6.4330 3 1409.1536189  71510 303943758      933855        syn-C2H3C(O)NH2, v=0
  186984.4992  0.0019 -5.1558 3   47.3623 37  71510 30318 711      18 414        syn-C2H3C(O)NH2, v=0
  186986.2712  0.0160 -4.4614 3  834.1156155  71510 303771958      771859        syn-C2H3C(O)NH2, v=0
  187014.5608  0.0460 -6.4233 3 1004.3448127  71510 303634716      644619        syn-C2H3C(O)NH2, v=0
  187014.5608  0.0460 -6.4233 3 1004.3448127  71510 303634717      644618        syn-C2H3C(O)NH2, v=0
  187069.4697  0.0049 -4.1261 3  628.8230135  71510 303671651      671552        syn-C2H3C(O)NH2, v=0
  187076.2338  0.0014 -3.7223 3  327.2975 99  71510 303491139      491040        syn-C2H3C(O)NH2, v=0
  187111.0088  0.0010 -5.5090 3   92.8929 51  71510 30325 916      24 915        syn-C2H3C(O)NH2, v=0
  187245.0514  0.0038 -6.2429 3  363.5373 99  71510 303491733      501436        syn-C2H3C(O)NH2, v=0
  187274.5133  0.0200 -3.6146 3  146.4136 59 -71510 303291415      291316        syn-C2H3C(O)NH2, v=0
  187274.5133  0.0200 -3.6146 3  146.4136 59 -71510 303291416      291317        syn-C2H3C(O)NH2, v=0
  187292.8311  0.0082 -5.9759 3  519.1627 85  71510 3034236 6      4335 9        syn-C2H3C(O)NH2, v=0
  187292.8311  0.0082 -5.9759 3  519.1627 85  71510 3034236 7      4335 8        syn-C2H3C(O)NH2, v=0
  187323.9814  0.0015 -6.5023 3    6.3485 17  71510 303 8 4 4       7 1 7        syn-C2H3C(O)NH2, v=0
  187412.8092  0.0224 -4.7893 3 1028.1603171  71510 303852362      852263        syn-C2H3C(O)NH2, v=0
  187412.9130  0.0026 -4.2697 3  109.9470 65  71510 30332 131      32 032        syn-C2H3C(O)NH2, v=0
  187412.9136  0.0026 -4.2697 3  109.9470 65  71510 30332 231      32 132        syn-C2H3C(O)NH2, v=0
  187492.9685  0.0009 -5.4691 3   85.8130 51  71510 30325 719      24 718        syn-C2H3C(O)NH2, v=0
  187497.3421  0.0200 -3.7892 3   31.7329 31 -71510 30315 6 9      14 510        syn-C2H3C(O)NH2, v=0
  187504.8642  0.0033 -6.2252 3  212.7279 75  71510 303371424      381127        syn-C2H3C(O)NH2, v=0
  187605.6560  0.0500 -6.5570 3 1473.2032193  71510 303963858      953957        syn-C2H3C(O)NH2, v=0
  187605.6560  0.0500 -6.5570 3 1473.2032193  71510 303963859      953956        syn-C2H3C(O)NH2, v=0
  187664.9911  0.0200 -3.8964 3  494.3156119 -71510 303591644      591545        syn-C2H3C(O)NH2, v=0
  187672.2159  0.0097 -6.5700 3  564.7012127  71510 303631746      641451        syn-C2H3C(O)NH2, v=0
  187715.2745  0.0200 -3.7751 3  408.2748107 -71510 303531638      531539        syn-C2H3C(O)NH2, v=0
  187763.8410  0.0401 -6.3484 3  952.1179123  71510 303614615      624518        syn-C2H3C(O)NH2, v=0
  187763.8410  0.0401 -6.3484 3  952.1179123  71510 303614616      624517        syn-C2H3C(O)NH2, v=0
  187803.2739  0.0010 -5.4848 3   89.1151 51  71510 30325 818      24 817        syn-C2H3C(O)NH2, v=0
  187811.2346  0.0200 -3.6231 3  139.2579 57 -71510 303281414      281315        syn-C2H3C(O)NH2, v=0
  187811.2346  0.0200 -3.6231 3  139.2579 57 -71510 303281415      281316        syn-C2H3C(O)NH2, v=0
  187862.6718  0.0014 -6.8925 3  297.4524 95  71510 30347 938      47 939        syn-C2H3C(O)NH2, v=0
  187930.7134  0.0019 -6.8737 3  166.6484 75  71510 30337 433      37 434        syn-C2H3C(O)NH2, v=0
  187930.7466  0.0019 -3.7872 3  166.6484 75  71510 30337 433      37 334        syn-C2H3C(O)NH2, v=0
  187931.5352  0.0019 -3.7872 3  166.6484 75  71510 30337 533      37 434        syn-C2H3C(O)NH2, v=0
  187931.5683  0.0019 -6.8737 3  166.6484 75  71510 30337 533      37 334        syn-C2H3C(O)NH2, v=0
  187947.1210  0.0070 -6.0002 3  482.2365 81  71510 3034035 5      4134 8        syn-C2H3C(O)NH2, v=0
  187947.1210  0.0070 -6.0002 3  482.2365 81  71510 3034035 6      4134 7        syn-C2H3C(O)NH2, v=0
  187951.8599  0.0200 -3.7037 3  297.4494 95 -71510 30347 938      47 839        syn-C2H3C(O)NH2, v=0
  188012.5511  0.0034 -6.2129 3  308.7985 91  71510 303451630      461333        syn-C2H3C(O)NH2, v=0
  188038.3014  0.0200 -3.6337 3  279.7434 87 -71510 303431528      431429        syn-C2H3C(O)NH2, v=0
  188080.8924  0.0031 -4.0322 3  142.0310 65  71510 30332 824      31 923        syn-C2H3C(O)NH2, v=0
  188116.4934  0.0032 -6.2060 3  258.5281 83  71510 303411527      421230        syn-C2H3C(O)NH2, v=0
  188129.0176  0.0200 -3.8711 3  473.0987117 -71510 303581544      581445        syn-C2H3C(O)NH2, v=0
  188215.8673  0.0017 -3.8287 3  437.9034113  71510 303561443      561344        syn-C2H3C(O)NH2, v=0
  188251.8230  0.0574 -6.6840 3 1538.6765197  71510 303983959      974058        syn-C2H3C(O)NH2, v=0
  188251.8230  0.0574 -6.6840 3 1538.6765197  71510 303983960      974057        syn-C2H3C(O)NH2, v=0
  188271.9927  0.0200 -3.7643 3  371.0146105 -71510 303521141      521042        syn-C2H3C(O)NH2, v=0
  188274.5285  0.0037 -6.1602 3  291.4420 99  71510 30349 544      50 447        syn-C2H3C(O)NH2, v=0
  188274.5347  0.0037 -6.1602 3  291.4420 99  71510 30349 644      50 347        syn-C2H3C(O)NH2, v=0
  188290.3756  0.0200 -3.6340 3  132.3572 55 -71510 303271413      271314        syn-C2H3C(O)NH2, v=0
  188290.3756  0.0200 -3.6340 3  132.3572 55 -71510 303271414      271315        syn-C2H3C(O)NH2, v=0
  188326.3215  0.0200 -4.3863 3  313.8388 95 -71510 303471335      461432        syn-C2H3C(O)NH2, v=0
  188366.7947  0.1442 -6.6835 3 1247.0444191  71510 303952274      942371        syn-C2H3C(O)NH2, v=0
  188392.2109  0.0029 -6.4659 3  101.9030 51  71510 303251114      26 819        syn-C2H3C(O)NH2, v=0
  188486.5106  0.0101 -6.4688 3  740.7152153  71510 303761165      771068        syn-C2H3C(O)NH2, v=0
  188486.5169  0.0101 -6.4688 3  740.7152153  71510 303761265      77 968        syn-C2H3C(O)NH2, v=0
  188504.6511  0.0349 -6.2792 3  901.3219119  71510 303594514      604417        syn-C2H3C(O)NH2, v=0
  188504.6511  0.0349 -6.2792 3  901.3219119  71510 303594515      604416        syn-C2H3C(O)NH2, v=0
  188581.1710  0.0200 -3.6313 3  279.7231 87 -71510 303431529      431430        syn-C2H3C(O)NH2, v=0
  188590.6342  0.0061 -6.0477 3  446.7499 77  71510 3033834 4      3933 7        syn-C2H3C(O)NH2, v=0
  188590.6342  0.0061 -6.0477 3  446.7499 77  71510 3033834 5      3933 6        syn-C2H3C(O)NH2, v=0
  188605.7663  0.0009 -3.7918 3   35.6495 33  71510 30316 611      15 510        syn-C2H3C(O)NH2, v=0
  188657.7406  0.0010 -5.4538 3   78.0253 49  71510 30324 618      23 617        syn-C2H3C(O)NH2, v=0
  188660.3171  0.0026 -4.2339 3  226.9284 81  71510 303401129      391228        syn-C2H3C(O)NH2, v=0
  188715.2881  0.0200 -3.7004 3  297.4524 95 -71510 303471038      47 939        syn-C2H3C(O)NH2, v=0
  188717.0236  0.0200 -3.6474 3  125.7105 53 -71510 303261412      261313        syn-C2H3C(O)NH2, v=0
  188717.0236  0.0200 -3.6474 3  125.7105 53 -71510 303261413      261314        syn-C2H3C(O)NH2, v=0
  188749.2723  0.0009 -5.4463 3   82.2835 51  71510 30325 520      24 519        syn-C2H3C(O)NH2, v=0
  188804.5117  0.0013 -6.8885 3  297.4494 95  71510 303471038      47 839        syn-C2H3C(O)NH2, v=0
  188911.1793  0.0657 -6.8140 3 1605.5722201  71510 303A04060      994159        syn-C2H3C(O)NH2, v=0
  188911.1793  0.0657 -6.8140 3 1605.5722201  71510 303A04061      994158        syn-C2H3C(O)NH2, v=0
  188963.4839  0.0026 -6.1677 3  222.1388 77  71510 303381424      391129        syn-C2H3C(O)NH2, v=0
  188973.7919  0.0031 -6.7720 3   68.6592 41  71510 303201011      21 714        syn-C2H3C(O)NH2, v=0
  188979.7669  0.0044 -4.7731 3  390.3700107  71510 303531341      521438        syn-C2H3C(O)NH2, v=0
  189095.8737  0.0200 -3.6638 3  119.3170 51 -71510 303251411      251312        syn-C2H3C(O)NH2, v=0
  189095.8737  0.0200 -3.6638 3  119.3170 51 -71510 303251412      251313        syn-C2H3C(O)NH2, v=0
  189219.7393  0.0017 -6.8384 3  190.3071 79  71510 30339 534      39 535        syn-C2H3C(O)NH2, v=0
  189219.9991  0.0200 -3.7339 3  190.3071 79 -71510 30339 534      39 435        syn-C2H3C(O)NH2, v=0
  189223.0196  0.0053 -6.1271 3  412.7035 73  71510 3033633 3      3732 6        syn-C2H3C(O)NH2, v=0
  189223.0196  0.0053 -6.1271 3  412.7035 73  71510 3033633 4      3732 5        syn-C2H3C(O)NH2, v=0
  189224.0349  0.0200 -3.7339 3  190.3071 79 -71510 30339 634      39 535        syn-C2H3C(O)NH2, v=0
  189224.2298  0.0017 -6.8384 3  190.3071 79  71510 30339 634      39 435        syn-C2H3C(O)NH2, v=0
  189236.8390  0.0302 -6.2163 3  851.9579115  71510 303574413      584316        syn-C2H3C(O)NH2, v=0
  189236.8390  0.0302 -6.2163 3  851.9579115  71510 303574414      584315        syn-C2H3C(O)NH2, v=0
  189289.7907  0.0466 -5.3253 3 1329.1247195  71510 303972572      972473        syn-C2H3C(O)NH2, v=0
  189290.1813  0.0057 -4.2593 3  722.7089143  71510 303712051      711952        syn-C2H3C(O)NH2, v=0
  189377.0976  0.0276 -5.8145 3  820.1366155  71510 303771860      761957        syn-C2H3C(O)NH2, v=0
  189431.1480  0.0200 -3.6834 3  113.1758 49 -71510 303241410      241311        syn-C2H3C(O)NH2, v=0
  189431.1480  0.0200 -3.6834 3  113.1758 49 -71510 303241411      241312        syn-C2H3C(O)NH2, v=0
  189478.4125  0.0034 -6.1399 3  418.9623117  71510 30358 751      59 654        syn-C2H3C(O)NH2, v=0
  189478.4197  0.0034 -6.1399 3  418.9623117  71510 30358 851      59 554        syn-C2H3C(O)NH2, v=0
  189482.2661  0.0047 -6.2556 3  568.7369135  71510 30367 958      68 861        syn-C2H3C(O)NH2, v=0
  189482.2732  0.0047 -6.2556 3  568.7369135  71510 303671058      68 761        syn-C2H3C(O)NH2, v=0
  189512.0733  0.0013 -6.8547 3  268.8163 91  71510 30345 837      45 838        syn-C2H3C(O)NH2, v=0
  189524.1796  0.0695 -6.2279 3 1022.5568173  71510 303862067      852164        syn-C2H3C(O)NH2, v=0
  189535.9088  0.0013 -3.6897 3  268.8155 91  71510 30345 837      45 738        syn-C2H3C(O)NH2, v=0
  189547.4911  0.0200 -3.7518 3  394.8256105 -71510 303521637      521538        syn-C2H3C(O)NH2, v=0
  189637.0284  0.0014 -6.8211 3  226.6654 53  71510 3032625 1      2525 0        syn-C2H3C(O)NH2, v=0
  189637.0284  0.0014 -6.8211 3  226.6654 53  71510 3032625 2      2525 1        syn-C2H3C(O)NH2, v=0
  189708.2544  0.0014 -6.5042 3  215.1042 53  71510 3032624 2      2524 1        syn-C2H3C(O)NH2, v=0
  189708.2544  0.0014 -6.5042 3  215.1042 53  71510 3032624 3      2524 2        syn-C2H3C(O)NH2, v=0
  189726.6889  0.0200 -3.7069 3  107.2861 47 -71510 3032314 9      231310        syn-C2H3C(O)NH2, v=0
  189726.6889  0.0200 -3.7069 3  107.2861 47 -71510 303231410      231311        syn-C2H3C(O)NH2, v=0
  189776.9796  0.0200 -3.7867 3  403.8813109 -71510 303541342      541243        syn-C2H3C(O)NH2, v=0
  189778.8577  0.0200 -3.6886 3  268.8163 91 -71510 30345 937      45 838        syn-C2H3C(O)NH2, v=0
  189782.6177  0.0011 -5.4757 3   89.2012 51  71510 30325 817      24 816        syn-C2H3C(O)NH2, v=0
  189786.9979  0.0013 -6.3135 3  204.0162 53  71510 3032623 3      2523 2        syn-C2H3C(O)NH2, v=0
  189786.9979  0.0013 -6.3135 3  204.0162 53  71510 3032623 4      2523 3        syn-C2H3C(O)NH2, v=0
  189802.7096  0.0013 -6.8534 3  268.8155 91  71510 30345 937      45 738        syn-C2H3C(O)NH2, v=0
  189843.9009  0.0048 -6.2541 3  380.0980 69  71510 3033432 2      3531 5        syn-C2H3C(O)NH2, v=0
  189843.9009  0.0048 -6.2541 3  380.0980 69  71510 3033432 3      3531 4        syn-C2H3C(O)NH2, v=0
  189874.7626  0.0013 -6.1750 3  193.4018 53  71510 3032622 4      2522 3        syn-C2H3C(O)NH2, v=0
  189874.7626  0.0013 -6.1750 3  193.4018 53  71510 3032622 5      2522 4        syn-C2H3C(O)NH2, v=0
  189931.3687  0.0200 -3.6189 3  268.9411 85 -71510 303421527      421428        syn-C2H3C(O)NH2, v=0
  189960.2394  0.0260 -6.1601 3  804.0266111  71510 303554312      564215        syn-C2H3C(O)NH2, v=0
  189960.2394  0.0260 -6.1601 3  804.0266111  71510 303554313      564214        syn-C2H3C(O)NH2, v=0
  189973.4265  0.0012 -6.0656 3  183.2616 53  71510 3032621 5      2521 4        syn-C2H3C(O)NH2, v=0
  189973.4265  0.0012 -6.0656 3  183.2616 53  71510 3032621 6      2521 5        syn-C2H3C(O)NH2, v=0
  189978.5620  0.0015 -6.8263 3  215.2299 83  71510 30341 635      41 636        syn-C2H3C(O)NH2, v=0
  189979.7687  0.0015 -3.7029 3  215.2299 83  71510 30341 635      41 536        syn-C2H3C(O)NH2, v=0
  189986.0705  0.0200 -3.7348 3  101.6472 45 -71510 3032214 8      2213 9        syn-C2H3C(O)NH2, v=0
  189986.0705  0.0200 -3.7348 3  101.6472 45 -71510 3032214 9      221310        syn-C2H3C(O)NH2, v=0
  189997.6827  0.0015 -3.7028 3  215.2299 83  71510 30341 735      41 636        syn-C2H3C(O)NH2, v=0
  189998.8894  0.0015 -6.8262 3  215.2299 83  71510 30341 735      41 536        syn-C2H3C(O)NH2, v=0
  190033.4053  0.0550 -5.1747 3 1247.0444189  71510 303942470      942371        syn-C2H3C(O)NH2, v=0
  190037.4554  0.0024 -4.0010 3  130.3472 69  71510 30334 232      34 133        syn-C2H3C(O)NH2, v=0
  190037.4633  0.0024 -4.0010 3  130.3472 69  71510 30334 332      34 233        syn-C2H3C(O)NH2, v=0
  190050.3149  0.0031 -4.9914 3  679.0234135  71510 303672345      662442        syn-C2H3C(O)NH2, v=0
  190053.3022  0.0031 -4.9914 3  679.0234135  71510 303672344      662443        syn-C2H3C(O)NH2, v=0
  190058.6924  0.0024 -4.9106 3  635.9860131  71510 303652244      642341        syn-C2H3C(O)NH2, v=0
  190067.2145  0.0024 -4.9106 3  635.9860131  71510 303652243      642342        syn-C2H3C(O)NH2, v=0
  190085.3615  0.0012 -5.9752 3  173.5960 53  71510 3032620 6      2520 5        syn-C2H3C(O)NH2, v=0
  190085.3615  0.0012 -5.9752 3  173.5960 53  71510 3032620 7      2520 6        syn-C2H3C(O)NH2, v=0
  190113.3242  0.0037 -4.0279 3  572.0779129  71510 303641549      641450        syn-C2H3C(O)NH2, v=0
  190124.0074  0.0014 -6.8325 3  241.4041 87  71510 30343 736      43 737        syn-C2H3C(O)NH2, v=0
  190129.7144  0.0200 -3.6891 3  241.4039 87 -71510 30343 736      43 637        syn-C2H3C(O)NH2, v=0
  190135.0049  0.0039 -5.0751 3  723.5020139  71510 303692446      682543        syn-C2H3C(O)NH2, v=0
  190136.0362  0.0039 -5.0751 3  723.5020139  71510 303692445      682544        syn-C2H3C(O)NH2, v=0
  190177.6786  0.0200 -4.8327 3  594.3909127 -71510 303632143      622240        syn-C2H3C(O)NH2, v=0
  190199.4813  0.0200 -3.6888 3  241.4041 87 -71510 30343 836      43 737        syn-C2H3C(O)NH2, v=0
  190199.8510  0.0043 -6.2513 3  240.9694 91  71510 30345 441      46 344        syn-C2H3C(O)NH2, v=0
  190199.8547  0.0043 -6.2513 3  240.9694 91  71510 30345 541      46 244        syn-C2H3C(O)NH2, v=0
  190201.5782  0.0020 -4.8326 3  594.3909127  71510 303632142      622241        syn-C2H3C(O)NH2, v=0
  190205.1970  0.0014 -6.8321 3  241.4039 87  71510 30343 836      43 637        syn-C2H3C(O)NH2, v=0
  190212.7252  0.0200 -3.7682 3   96.2583 43 -71510 3032114 7      2113 8        syn-C2H3C(O)NH2, v=0
  190212.7252  0.0200 -3.7682 3   96.2583 43 -71510 3032114 8      2113 9        syn-C2H3C(O)NH2, v=0
  190213.6007  0.0011 -5.8980 3  164.4057 53  71510 3032619 7      2519 6        syn-C2H3C(O)NH2, v=0
  190213.6007  0.0011 -5.8980 3  164.4057 53  71510 3032619 8      2519 7        syn-C2H3C(O)NH2, v=0
  190230.6514  0.0200 -3.6175 3  268.9301 85 -71510 303421528      421429        syn-C2H3C(O)NH2, v=0
  190287.5459  0.0322 -4.7248 3  993.9031169  71510 303842163      842064        syn-C2H3C(O)NH2, v=0
  190298.1230  0.0050 -5.1617 3  769.4205143  71510 303712547      702644        syn-C2H3C(O)NH2, v=0
  190298.4741  0.0050 -5.1617 3  769.4205143  71510 303712546      702645        syn-C2H3C(O)NH2, v=0
  190336.7321  0.0046 -6.4238 3   22.6158 29  71510 30314 311      14 014        syn-C2H3C(O)NH2, v=0
  190362.0778  0.0011 -5.8310 3  155.6916 53  71510 3032618 8      2518 7        syn-C2H3C(O)NH2, v=0
  190362.0778  0.0011 -5.8310 3  155.6916 53  71510 3032618 9      2518 8        syn-C2H3C(O)NH2, v=0
  190380.5386  0.0200 -3.7207 3  368.8632101 -71510 303501634      501535        syn-C2H3C(O)NH2, v=0
  190409.6660  0.0200 -3.8084 3   91.1188 41 -71510 3032014 6      2013 7        syn-C2H3C(O)NH2, v=0
  190409.6660  0.0200 -3.8084 3   91.1188 41 -71510 3032014 7      2013 8        syn-C2H3C(O)NH2, v=0
  190426.7154  0.0018 -4.7577 3  554.2397123  71510 303612042      602139        syn-C2H3C(O)NH2, v=0
  190452.8772  0.0044 -6.4619 3  348.9338 65  71510 3033231 1      3330 4        syn-C2H3C(O)NH2, v=0
  190452.8772  0.0044 -6.4619 3  348.9338 65  71510 3033231 2      3330 3        syn-C2H3C(O)NH2, v=0
  190458.5572  0.0200 -3.9104 3  509.4799121 -71510 303601645      601546        syn-C2H3C(O)NH2, v=0
  190469.9262  0.0200 -3.8382 3  456.7200113 -71510 303561739      561640        syn-C2H3C(O)NH2, v=0
  190492.4234  0.0018 -4.7574 3  554.2396123  71510 303612041      602140        syn-C2H3C(O)NH2, v=0
  190527.7831  0.0063 -5.2512 3  816.7777147  71510 303732648      722745        syn-C2H3C(O)NH2, v=0
  190527.9012  0.0063 -5.2512 3  816.7777147  71510 303732647      722746        syn-C2H3C(O)NH2, v=0
  190535.9780  0.0011 -5.7719 3  147.4547 53  71510 3032617 9      2517 8        syn-C2H3C(O)NH2, v=0
  190535.9780  0.0011 -5.7719 3  147.4547 53  71510 303261710      2517 9        syn-C2H3C(O)NH2, v=0
  190579.8088  0.0200 -3.8575 3   86.2281 39 -71510 3031914 5      1913 6        syn-C2H3C(O)NH2, v=0
  190579.8088  0.0200 -3.8575 3   86.2281 39 -71510 3031914 6      1913 7        syn-C2H3C(O)NH2, v=0
  190651.6847  0.0021 -3.8101 3  417.3678111  71510 303551243      551144        syn-C2H3C(O)NH2, v=0
  190660.7164  0.0016 -6.7545 3   13.1196 19  71510 303 9 6 4       9 3 7        syn-C2H3C(O)NH2, v=0
  190674.6731  0.0223 -6.1111 3  757.5291107  71510 303534211      544114        syn-C2H3C(O)NH2, v=0
  190674.6731  0.0223 -6.1111 3  757.5291107  71510 303534212      544113        syn-C2H3C(O)NH2, v=0
  190717.3220  0.0863 -6.8358 3 1268.9188145  71510 303725220      735123        syn-C2H3C(O)NH2, v=0
  190717.3220  0.0863 -6.8358 3 1268.9188145  71510 303725221      735122        syn-C2H3C(O)NH2, v=0
  190725.8336  0.0200 -3.9186 3   81.5855 37 -71510 3031814 4      1813 5        syn-C2H3C(O)NH2, v=0
  190725.8336  0.0200 -3.9186 3   81.5855 37 -71510 3031814 5      1813 6        syn-C2H3C(O)NH2, v=0
  190742.2653  0.0011 -5.7192 3  139.6966 53  71510 303261610      2516 9        syn-C2H3C(O)NH2, v=0
  190742.2653  0.0011 -5.7192 3  139.6966 53  71510 303261611      251610        syn-C2H3C(O)NH2, v=0
  190814.3912  0.0079 -5.3437 3  865.5724151  71510 303752749      742846        syn-C2H3C(O)NH2, v=0
  190814.4305  0.0079 -5.3437 3  865.5724151  71510 303752748      742847        syn-C2H3C(O)NH2, v=0
  190822.7687  0.0017 -4.6855 3  515.5339119  71510 303591941      582038        syn-C2H3C(O)NH2, v=0
  190850.1675  0.0200 -3.9971 3   77.1906 35 -71510 3031714 3      1713 4        syn-C2H3C(O)NH2, v=0
  190850.1675  0.0200 -3.9971 3   77.1906 35 -71510 3031714 4      1713 5        syn-C2H3C(O)NH2, v=0
  190886.2755  0.0200 -3.4536 3   91.6646 55 -71510 30327 423      26 522        syn-C2H3C(O)NH2, v=0
  190888.0413  0.0200 -3.2122 3   96.4904 61 -71510 30330 129      29 228        syn-C2H3C(O)NH2, v=0
  190888.0349  0.0009 -5.3687 3   96.4904 61  71510 30330 229      29 228        syn-C2H3C(O)NH2, v=0
  190888.0382  0.0009 -5.3687 3   96.4904 61  71510 30330 129      29 128        syn-C2H3C(O)NH2, v=0
  190888.0413  0.0200 -3.2122 3   96.4904 61 -71510 30330 229      29 128        syn-C2H3C(O)NH2, v=0
  190890.1478  0.0009 -5.3500 3   97.0102 63  71510 30331 031      30 030        syn-C2H3C(O)NH2, v=0
  190890.1534  0.0200 -3.1573 3   97.0102 63 -71510 30331 031      30 130        syn-C2H3C(O)NH2, v=0
  190890.1534  0.0200 -3.1573 3   97.0102 63 -71510 30331 131      30 030        syn-C2H3C(O)NH2, v=0
  190890.1478  0.0009 -5.3500 3   97.0102 63  71510 30331 131      30 130        syn-C2H3C(O)NH2, v=0
  190918.8509  0.0200 -3.2754 3   95.4474 59 -71510 30329 227      28 326        syn-C2H3C(O)NH2, v=0
  190919.1561  0.0009 -5.3866 3   95.4474 59  71510 30329 327      28 326        syn-C2H3C(O)NH2, v=0
  190919.4318  0.0009 -5.3866 3   95.4473 59  71510 30329 227      28 226        syn-C2H3C(O)NH2, v=0
  190919.6995  0.0200 -3.2754 3   95.4473 59 -71510 30329 327      28 226        syn-C2H3C(O)NH2, v=0
  190921.4786  0.0166 -6.6149 3  844.3784163  71510 303811269      821172        syn-C2H3C(O)NH2, v=0
  190921.4829  0.0166 -6.6149 3  844.3784163  71510 303811369      821072        syn-C2H3C(O)NH2, v=0
  190943.8426  0.0009 -5.4352 3   88.8829 53  71510 30326 621      25 620        syn-C2H3C(O)NH2, v=0
  190955.3196  0.0200 -4.1031 3   73.0427 33 -71510 3031614 2      1613 3        syn-C2H3C(O)NH2, v=0
  190955.3196  0.0200 -4.1031 3   73.0427 33 -71510 3031614 3      1613 4        syn-C2H3C(O)NH2, v=0
  190990.5044  0.0010 -5.6720 3  132.4190 53  71510 303261511      251510        syn-C2H3C(O)NH2, v=0
  190990.5044  0.0010 -5.6720 3  132.4190 53  71510 303261512      251511        syn-C2H3C(O)NH2, v=0
  190999.4530  0.0017 -4.6847 3  515.5336119  71510 303591940      582039        syn-C2H3C(O)NH2, v=0
  191022.8709  0.0200 -3.3517 3   93.8530 57 -71510 30328 325      27 424        syn-C2H3C(O)NH2, v=0
  191036.4476  0.0009 -5.4033 3   93.8530 57  71510 30328 425      27 424        syn-C2H3C(O)NH2, v=0
  191043.2633  0.0200 -4.2597 3   69.1413 31 -71510 3031514 1      1513 2        syn-C2H3C(O)NH2, v=0
  191043.2633  0.0200 -4.2597 3   69.1413 31 -71510 3031514 2      1513 3        syn-C2H3C(O)NH2, v=0
  191048.5285  0.0009 -5.4032 3   93.8521 57  71510 30328 325      27 324        syn-C2H3C(O)NH2, v=0
  191049.5227  0.0041 -6.8473 3  319.2114 61  71510 3033030 0      3129 3        syn-C2H3C(O)NH2, v=0
  191049.5227  0.0041 -6.8473 3  319.2114 61  71510 3033030 1      3129 2        syn-C2H3C(O)NH2, v=0
  191062.2223  0.0200 -3.3515 3   93.8521 57 -71510 30328 425      27 324        syn-C2H3C(O)NH2, v=0
  191063.0519  0.0334 -5.1807 3 1253.3832189  71510 303942569      942470        syn-C2H3C(O)NH2, v=0
  191116.1265  0.0200 -4.5405 3   65.4861 29 -71510 3031414 0      1413 1        syn-C2H3C(O)NH2, v=0
  191116.1265  0.0200 -4.5405 3   65.4861 29 -71510 3031414 1      1413 2        syn-C2H3C(O)NH2, v=0
  191150.1761  0.0099 -5.4391 3  915.8035155  71510 303772850      762947        syn-C2H3C(O)NH2, v=0
  191150.1890  0.0099 -5.4391 3  915.8035155  71510 303772849      762948        syn-C2H3C(O)NH2, v=0
  191153.3634  0.0206 -6.8700 3  890.4350157  71510 303782454      792159        syn-C2H3C(O)NH2, v=0
  191264.0056  0.0016 -6.4808 3   15.5495 21  71510 30310 6 5      10 3 8        syn-C2H3C(O)NH2, v=0
  191274.4285  0.0009 -5.4183 3   91.6646 55  71510 30327 523      26 522        syn-C2H3C(O)NH2, v=0
  191277.9886  0.0026 -6.1509 3  268.8962 85  71510 303421527      431232        syn-C2H3C(O)NH2, v=0
  191294.1925  0.0010 -5.6294 3  125.6246 53  71510 303261413      251412        syn-C2H3C(O)NH2, v=0
  191294.1928  0.0010 -5.6294 3  125.6246 53  71510 303261412      251411        syn-C2H3C(O)NH2, v=0
  191367.9080  0.0016 -4.6164 3  478.2755115  71510 303571840      561937        syn-C2H3C(O)NH2, v=0
  191379.9457  0.0191 -6.0702 3  712.4662103  71510 303514110      524013        syn-C2H3C(O)NH2, v=0
  191379.9457  0.0191 -6.0702 3  712.4662103  71510 303514111      524012        syn-C2H3C(O)NH2, v=0
  191501.3694  0.0766 -6.7389 3 1210.0365141  71510 303705119      715022        syn-C2H3C(O)NH2, v=0
  191501.3694  0.0766 -6.7389 3 1210.0365141  71510 303705120      715021        syn-C2H3C(O)NH2, v=0
  191528.7974  0.0121 -5.5375 3  967.4699159  71510 303792951      783048        syn-C2H3C(O)NH2, v=0
  191528.8016  0.0121 -5.5375 3  967.4699159  71510 303792950      783049        syn-C2H3C(O)NH2, v=0
  191559.5719  0.0200 -3.7288 3  381.6453103 -71510 303511636      511537        syn-C2H3C(O)NH2, v=0
  191562.9593  0.0009 -5.4169 3   91.6421 55  71510 30327 423      26 422        syn-C2H3C(O)NH2, v=0
  191593.6228  0.0200 -3.6060 3  258.4127 83 -71510 303411526      411427        syn-C2H3C(O)NH2, v=0
  191630.9870  0.0077 -5.1945 3  549.8527127  71510 303631549      621646        syn-C2H3C(O)NH2, v=0
  191664.7074  0.0050 -6.4323 3  195.0214 83  71510 30341 338      42 241        syn-C2H3C(O)NH2, v=0
  191664.7094  0.0050 -6.4323 3  195.0214 83  71510 30341 438      42 141        syn-C2H3C(O)NH2, v=0
  191673.0332  0.0010 -5.5908 3  119.3170 53  71510 303261314      251313        syn-C2H3C(O)NH2, v=0
  191673.0418  0.0010 -5.5908 3  119.3170 53  71510 303261313      251312        syn-C2H3C(O)NH2, v=0
  191718.4952  0.0030 -3.9421 3  517.9111123  71510 303611447      611348        syn-C2H3C(O)NH2, v=0
  191754.5780  0.0200 -3.6053 3  258.4068 83 -71510 303411527      411428        syn-C2H3C(O)NH2, v=0
  191764.2717  0.0200 -4.3745 3  331.6517 97 -71510 303481434      471533        syn-C2H3C(O)NH2, v=0
  191773.0246  0.0156 -4.5742 3  913.2658161  71510 303802258      802159        syn-C2H3C(O)NH2, v=0
  191830.8034  0.0017 -4.6142 3  478.2746115  71510 303571839      561938        syn-C2H3C(O)NH2, v=0
  191836.4114  0.0015 -4.3986 3  343.7839 99  71510 303491436      481533        syn-C2H3C(O)NH2, v=0
  191859.5964  0.0025 -3.8694 3  466.3369117  71510 303581345      581246        syn-C2H3C(O)NH2, v=0
  191900.6880  0.0200 -3.7485 3  371.0335105 -71510 303521241      521142        syn-C2H3C(O)NH2, v=0
  191941.3334  0.0200 -4.0937 3  627.1295133 -71510 303661947      661848        syn-C2H3C(O)NH2, v=0
  191945.0381  0.0147 -5.6389 3 1020.5704163  71510 303813052      803149        syn-C2H3C(O)NH2, v=0
  191945.0394  0.0147 -5.6389 3 1020.5704163  71510 303813051      803150        syn-C2H3C(O)NH2, v=0
  191951.1338  0.0200 -3.4485 3   91.6421 55 -71510 30327 523      26 422        syn-C2H3C(O)NH2, v=0
  192012.6190  0.0285 -5.4715 3 1413.6922201  71510 303A02674      A02575        syn-C2H3C(O)NH2, v=0
  192019.3303  0.0016 -4.5509 3  442.4667111  71510 303551739      541836        syn-C2H3C(O)NH2, v=0
  192075.8469  0.0162 -6.0383 3  668.8386 99  71510 3034940 9      503912        syn-C2H3C(O)NH2, v=0
  192075.8469  0.0162 -6.0383 3  668.8386 99  71510 303494010      503911        syn-C2H3C(O)NH2, v=0
  192112.0072  0.0026 -5.2976 3   14.4281 25  71510 30312 210      11 111        syn-C2H3C(O)NH2, v=0
  192152.4498  0.0034 -6.1329 3  358.4528109  71510 30354 648      55 551        syn-C2H3C(O)NH2, v=0
  192152.4547  0.0034 -6.1329 3  358.4528109  71510 30354 748      55 451        syn-C2H3C(O)NH2, v=0
  192157.0331  0.0010 -5.5557 3  113.5017 53  71510 303261215      251214        syn-C2H3C(O)NH2, v=0
  192157.2300  0.0010 -5.5557 3  113.5017 53  71510 303261214      251213        syn-C2H3C(O)NH2, v=0
  192271.4286  0.0022 -3.8612 3  152.0478 73  71510 30336 333      36 234        syn-C2H3C(O)NH2, v=0
  192271.4929  0.0022 -3.8612 3  152.0478 73  71510 30336 433      36 334        syn-C2H3C(O)NH2, v=0
  192277.3719  0.0679 -6.6467 3 1152.5802137  71510 303685018      694921        syn-C2H3C(O)NH2, v=0
  192277.3719  0.0679 -6.6467 3 1152.5802137  71510 303685019      694920        syn-C2H3C(O)NH2, v=0
  192311.5478  0.0068 -6.3586 3  660.2087145  71510 303721062      73 965        syn-C2H3C(O)NH2, v=0
  192311.5528  0.0068 -6.3586 3  660.2087145  71510 303721162      73 865        syn-C2H3C(O)NH2, v=0
  192317.0243  0.0112 -4.3347 3  768.8419149  71510 303741856      741757        syn-C2H3C(O)NH2, v=0
  192345.3409  0.0218 -5.4217 3 1387.3885199  71510 303992673      992574        syn-C2H3C(O)NH2, v=0
  192388.0039  0.0125 -6.6630 3  638.1903135  71510 303671849      681554        syn-C2H3C(O)NH2, v=0
  192394.5698  0.0178 -5.7433 3 1075.1039167  71510 303833153      823250        syn-C2H3C(O)NH2, v=0
  192394.5703  0.0178 -5.7433 3 1075.1039167  71510 303833152      823251        syn-C2H3C(O)NH2, v=0
  192409.0924  0.0200 -3.9525 3  538.4712123 -71510 303611843      611744        syn-C2H3C(O)NH2, v=0
  192414.5111  0.0011 -3.7900 3   39.7531 35  71510 30317 612      16 511        syn-C2H3C(O)NH2, v=0
  192440.3520  0.0029 -6.7600 3   68.5435 41  71510 303201010      21 715        syn-C2H3C(O)NH2, v=0
  192493.0116  0.0016 -6.2544 3   18.2090 23  71510 30311 6 6      11 3 9        syn-C2H3C(O)NH2, v=0
  192542.8875  0.0022 -5.3259 3   42.7001 35  71510 30317 710      17 413        syn-C2H3C(O)NH2, v=0
  192562.8850  0.0200 -3.7229 3  339.3637101 -71510 303501040      50 941        syn-C2H3C(O)NH2, v=0
  192621.4907  0.0056 -6.8002 3  153.6063 75  71510 30337 235      38 138        syn-C2H3C(O)NH2, v=0
  192621.4916  0.0056 -6.8002 3  153.6063 75  71510 30337 335      38 038        syn-C2H3C(O)NH2, v=0
  192626.7308  0.0016 -4.4903 3  408.1109107  71510 303531638      521735        syn-C2H3C(O)NH2, v=0
  192650.5409  0.0135 -6.7275 3  803.5688149  71510 303742351      752056        syn-C2H3C(O)NH2, v=0
  192753.4292  0.0042 -4.9804 3   59.8241 43  71510 30321 615      21 318        syn-C2H3C(O)NH2, v=0
  192762.1492  0.0138 -6.0167 3  626.6473 95  71510 3034739 8      483811        syn-C2H3C(O)NH2, v=0
  192762.1492  0.0138 -6.0167 3  626.6473 95  71510 3034739 9      483810        syn-C2H3C(O)NH2, v=0
  192776.8607  0.0039 -6.1894 3  498.2166127  71510 30363 855      64 758        syn-C2H3C(O)NH2, v=0
  192776.8660  0.0039 -6.1894 3  498.2166127  71510 30363 955      64 658        syn-C2H3C(O)NH2, v=0
  192793.6197  0.0010 -5.5234 3  108.1870 53  71510 303261116      251115        syn-C2H3C(O)NH2, v=0
  192797.1728  0.0010 -5.5233 3  108.1871 53  71510 303261115      251114        syn-C2H3C(O)NH2, v=0
  192819.4199  0.0015 -4.4374 3  375.2136103  71510 303511537      501634        syn-C2H3C(O)NH2, v=0
  192873.7732  0.0212 -5.8506 3 1131.0693171  71510 303853254      843351        syn-C2H3C(O)NH2, v=0
  192873.7733  0.0212 -5.8506 3 1131.0693171  71510 303853253      843352        syn-C2H3C(O)NH2, v=0
  192889.3187  0.0059 -4.9654 3  466.6646117  71510 303581445      571542        syn-C2H3C(O)NH2, v=0
  193007.3290  0.0067 -6.4378 3  237.5139 83  71510 303411130      42 835        syn-C2H3C(O)NH2, v=0
  193021.2142  0.0027 -6.1584 3  320.1207 93  71510 303461630      471335        syn-C2H3C(O)NH2, v=0
  193045.2250  0.0599 -6.5596 3 1096.5510133  71510 303664917      674820        syn-C2H3C(O)NH2, v=0
  193045.2250  0.0599 -6.5596 3 1096.5510133  71510 303664918      674819        syn-C2H3C(O)NH2, v=0
  193068.8549  0.0200 -3.5950 3  248.1550 81 -71510 303401525      401426        syn-C2H3C(O)NH2, v=0
  193144.3562  0.0074 -6.4166 3  383.9274105  71510 303521438      531143        syn-C2H3C(O)NH2, v=0
  193153.3113  0.0200 -3.5946 3  248.1519 81 -71510 303401526      401427        syn-C2H3C(O)NH2, v=0
  193195.2241  0.0017 -4.5454 3  442.4642111  71510 303551738      541837        syn-C2H3C(O)NH2, v=0
  193197.2907  0.0269 -6.7813 3  954.7311173  71510 303861373      871276        syn-C2H3C(O)NH2, v=0
  193197.2935  0.0269 -6.7813 3  954.7311173  71510 303861473      871176        syn-C2H3C(O)NH2, v=0
  193283.5549  0.0200 -3.8771 3  487.8684119 -71510 303591545      591446        syn-C2H3C(O)NH2, v=0
  193332.1893  0.0028 -6.3270 3  134.2277 59  71510 303291217      30 922        syn-C2H3C(O)NH2, v=0
  193375.7988  0.0200 -3.5465 3   26.0786 21 -71510 30310 9 2       9 8 1        syn-C2H3C(O)NH2, v=0
  193375.7988  0.0200 -3.5465 3   26.0786 21 -71510 30310 9 1       9 8 2        syn-C2H3C(O)NH2, v=0
  193379.5994  0.0251 -5.9610 3 1188.4653175  71510 303873354      863453        syn-C2H3C(O)NH2, v=0
  193379.5994  0.0251 -5.9610 3 1188.4653175  71510 303873355      863452        syn-C2H3C(O)NH2, v=0
  193438.6071  0.0117 -6.0072 3  585.8930 91  71510 3034538 7      463710        syn-C2H3C(O)NH2, v=0
  193438.6071  0.0117 -6.0072 3  585.8930 91  71510 3034538 8      4637 9        syn-C2H3C(O)NH2, v=0
  193465.3959  0.0027 -4.2563 3  116.7185 67  71510 30333 132      33 033        syn-C2H3C(O)NH2, v=0
  193465.3962  0.0027 -4.2563 3  116.7185 67  71510 30333 232      33 133        syn-C2H3C(O)NH2, v=0
  193500.0458  0.0200 -3.5698 3   95.2521 55 -71510 30327 522      26 621        syn-C2H3C(O)NH2, v=0
  193525.4816  0.0200 -3.7304 3  105.2881 57 -71510 30328 622      27 721        syn-C2H3C(O)NH2, v=0
  193540.3592  0.0543 -5.0214 3 1167.4457183  71510 303912368      912269        syn-C2H3C(O)NH2, v=0
  193564.0383  0.0322 -4.9437 3 1126.1566179  71510 303892465      892366        syn-C2H3C(O)NH2, v=0
  193648.5590  0.0200 -3.7065 3  368.7368101 -71510 303501635      501536        syn-C2H3C(O)NH2, v=0
  193650.9929  0.0010 -5.4934 3  103.3860 53  71510 303261017      251016        syn-C2H3C(O)NH2, v=0
  193699.9618  0.0010 -5.4932 3  103.3874 53  71510 303261016      251015        syn-C2H3C(O)NH2, v=0
  193709.1340  0.0200 -3.6682 3   30.7922 29 -71510 30314 7 8      13 6 7        syn-C2H3C(O)NH2, v=0
  193723.7367  0.0033 -6.4522 3   19.6844 27  71510 30313 410      13 113        syn-C2H3C(O)NH2, v=0
  193748.0574  0.0009 -3.6020 3   27.6756 25  71510 30312 8 5      11 7 4        syn-C2H3C(O)NH2, v=0
  193748.4787  0.0009 -3.6020 3   27.6756 25  71510 30312 8 4      11 7 5        syn-C2H3C(O)NH2, v=0
  193760.0844  0.0200 -3.6936 3  356.1770 99 -71510 303491633      491534        syn-C2H3C(O)NH2, v=0
  193804.8149  0.0527 -6.4775 3 1041.9499129  71510 303644816      654719        syn-C2H3C(O)NH2, v=0
  193804.8149  0.0527 -6.4775 3 1041.9499129  71510 303644817      654718        syn-C2H3C(O)NH2, v=0
  193833.6552  0.0088 -6.5990 3  721.1459141  71510 303702248      711953        syn-C2H3C(O)NH2, v=0
  193836.6002  0.0200 -3.6677 3   30.7884 29 -71510 30314 7 7      13 6 8        syn-C2H3C(O)NH2, v=0
  193909.4640  0.0296 -6.0744 3 1247.2910179  71510 303893456      883553        syn-C2H3C(O)NH2, v=0
  193909.4641  0.0296 -6.0744 3 1247.2910179  71510 303893455      883554        syn-C2H3C(O)NH2, v=0
  193918.6344  0.0200 -3.7171 3  339.3697101 -71510 303501140      501041        syn-C2H3C(O)NH2, v=0
  193932.1900  0.0012 -6.7485 3    6.2638 15  71510 303 7 5 3       6 2 4        syn-C2H3C(O)NH2, v=0
  194084.0340  0.0009 -5.4187 3   88.5795 53  71510 30326 521      25 520        syn-C2H3C(O)NH2, v=0
  194087.2436  0.0019 -6.8610 3  175.0373 77  71510 30338 434      38 435        syn-C2H3C(O)NH2, v=0
  194087.2602  0.0019 -3.7768 3  175.0373 77  71510 30338 434      38 335        syn-C2H3C(O)NH2, v=0
  194087.6696  0.0019 -3.7768 3  175.0373 77  71510 30338 534      38 435        syn-C2H3C(O)NH2, v=0
  194087.6861  0.0019 -6.8610 3  175.0373 77  71510 30338 534      38 335        syn-C2H3C(O)NH2, v=0
  194104.9557  0.0099 -6.0121 3  546.5764 87  71510 3034337 6      4436 9        syn-C2H3C(O)NH2, v=0
  194104.9557  0.0099 -6.0121 3  546.5764 87  71510 3034337 7      4436 8        syn-C2H3C(O)NH2, v=0
  194143.9844  0.0200 -3.9225 3  524.8601123 -71510 303611646      611547        syn-C2H3C(O)NH2, v=0
  194183.1138  0.0254 -6.8513 3  851.3160153  71510 303762453      772156        syn-C2H3C(O)NH2, v=0
  194237.1233  0.0023 -4.2614 3  263.1862 87  71510 303431231      421330        syn-C2H3C(O)NH2, v=0
  194242.7305  0.0031 -6.1874 3  375.8102101  71510 303501733      511438        syn-C2H3C(O)NH2, v=0
  194303.1217  0.0033 -6.5468 3   95.5317 49  71510 303241114      25 817        syn-C2H3C(O)NH2, v=0
  194388.3277  0.0200 -3.5857 3  238.1654 79 -71510 303391524      391425        syn-C2H3C(O)NH2, v=0
  194389.8175  0.0200 -3.8303 3  452.0507115 -71510 303571444      571345        syn-C2H3C(O)NH2, v=0
  194431.5507  0.0200 -3.5855 3  238.1639 79 -71510 303391525      391426        syn-C2H3C(O)NH2, v=0
  194445.1031  0.0038 -6.1664 3  302.4537101  71510 30350 545      51 448        syn-C2H3C(O)NH2, v=0
  194445.1062  0.0038 -6.1664 3  302.4537101  71510 30350 645      51 348        syn-C2H3C(O)NH2, v=0
  194461.1630  0.0346 -6.1907 3 1307.5449183  71510 303913556      903655        syn-C2H3C(O)NH2, v=0
  194461.1630  0.0346 -6.1907 3 1307.5449183  71510 303913557      903654        syn-C2H3C(O)NH2, v=0
  194473.8772  0.0026 -3.8685 3  122.9906 61  71510 30330 723      29 822        syn-C2H3C(O)NH2, v=0
  194550.3644  0.0016 -6.0663 3   21.0929 25  71510 30312 6 7      12 310        syn-C2H3C(O)NH2, v=0
  194556.0180  0.0462 -6.4010 3  988.7780125  71510 303624715      634618        syn-C2H3C(O)NH2, v=0
  194556.0180  0.0462 -6.4010 3  988.7780125  71510 303624716      634617        syn-C2H3C(O)NH2, v=0
  194612.6303  0.0200 -3.9012 3  515.8330121 -71510 303601744      601645        syn-C2H3C(O)NH2, v=0
  194679.7618  0.0009 -5.4305 3   92.0671 53  71510 30326 720      25 719        syn-C2H3C(O)NH2, v=0
  194682.5238  0.0060 -6.4848 3  643.1703133  71510 303662145      671850        syn-C2H3C(O)NH2, v=0
  194738.2854  0.0010 -5.4656 3   99.1167 53  71510 30326 918      25 917        syn-C2H3C(O)NH2, v=0
  194760.9099  0.0084 -6.0351 3  508.6983 83  71510 3034136 5      4235 8        syn-C2H3C(O)NH2, v=0
  194760.9099  0.0084 -6.0351 3  508.6983 83  71510 3034136 6      4235 7        syn-C2H3C(O)NH2, v=0
  194768.9253  0.0019 -4.0278 3   33.2563 33  71510 30316 511      15 412        syn-C2H3C(O)NH2, v=0
  194815.5059  0.0016 -4.3908 3  325.7893 97  71510 303481336      471433        syn-C2H3C(O)NH2, v=0
  194824.7901  0.0200 -3.9239 3  531.3360123 -71510 303611745      611646        syn-C2H3C(O)NH2, v=0
  194892.4277  0.0028 -4.7328 3   73.6368 47  71510 30323 716      23 419        syn-C2H3C(O)NH2, v=0
  194917.2098  0.0012 -5.4331 3   86.3332 51  71510 30325 718      24 717        syn-C2H3C(O)NH2, v=0
  194955.4932  0.0111 -6.4852 3  758.3840155  71510 303771166      781069        syn-C2H3C(O)NH2, v=0
  194955.4966  0.0111 -6.4852 3  758.3840155  71510 303771266      78 969        syn-C2H3C(O)NH2, v=0
  194985.0434  0.0034 -6.2359 3  435.9627109  71510 303541836      551541        syn-C2H3C(O)NH2, v=0
  194997.3676  0.0200 -3.6964 3  308.9018 97 -71510 30348 939      48 840        syn-C2H3C(O)NH2, v=0
  195020.9585  0.0013 -3.7912 3   44.1523 37  71510 30318 613      17 512        syn-C2H3C(O)NH2, v=0
  195032.8066  0.0402 -6.3101 3 1369.2260187  71510 303933657      923756        syn-C2H3C(O)NH2, v=0
  195032.8066  0.0402 -6.3101 3 1369.2260187  71510 303933658      923755        syn-C2H3C(O)NH2, v=0
  195071.1011  0.0027 -5.9205 3   25.2260 29  71510 30314 510      14 213        syn-C2H3C(O)NH2, v=0
  195134.4311  0.0200 -3.8769 3  500.5754119 -71510 303591743      591644        syn-C2H3C(O)NH2, v=0
  195174.6797  0.0046 -6.3857 3  569.6457125  71510 303622042      631747        syn-C2H3C(O)NH2, v=0
  195228.4231  0.0010 -5.4635 3   99.1343 53  71510 30326 917      25 916        syn-C2H3C(O)NH2, v=0
  195284.9683  0.0039 -6.3024 3  500.5754117  71510 303581939      591644        syn-C2H3C(O)NH2, v=0
  195298.7001  0.0404 -6.3302 3  937.0363121  71510 303604614      614517        syn-C2H3C(O)NH2, v=0
  195298.7001  0.0404 -6.3302 3  937.0363121  71510 303604615      614516        syn-C2H3C(O)NH2, v=0
  195406.1637  0.0072 -6.0812 3  472.2592 79  71510 3033935 4      4034 7        syn-C2H3C(O)NH2, v=0
  195406.1637  0.0072 -6.0812 3  472.2592 79  71510 3033935 5      4034 6        syn-C2H3C(O)NH2, v=0
  195449.5295  0.0017 -6.8262 3  199.3043 81  71510 30340 535      40 536        syn-C2H3C(O)NH2, v=0
  195449.6638  0.0200 -3.7247 3  199.3043 81 -71510 30340 535      40 436        syn-C2H3C(O)NH2, v=0
  195451.8344  0.0200 -3.7247 3  199.3043 81 -71510 30340 635      40 536        syn-C2H3C(O)NH2, v=0
  195451.9194  0.0017 -6.8262 3  199.3043 81  71510 30340 635      40 436        syn-C2H3C(O)NH2, v=0
  195457.3394  0.0200 -3.6944 3  308.9035 97 -71510 303481039      48 940        syn-C2H3C(O)NH2, v=0
  195503.2329  0.0200 -4.4766 3  408.1043107 -71510 303531637      521736        syn-C2H3C(O)NH2, v=0
  195569.1382  0.0010 -5.4423 3   95.3796 53  71510 30326 819      25 818        syn-C2H3C(O)NH2, v=0
  195574.8402  0.0200 -3.5780 3  228.4420 77 -71510 303381523      381424        syn-C2H3C(O)NH2, v=0
  195596.3609  0.0200 -3.5779 3  228.4412 77 -71510 303381524      381425        syn-C2H3C(O)NH2, v=0
  195622.7670  0.0465 -6.4324 3 1432.3331191  71510 303953758      943857        syn-C2H3C(O)NH2, v=0
  195622.7670  0.0465 -6.4324 3 1432.3331191  71510 303953759      943856        syn-C2H3C(O)NH2, v=0
  195641.7963  0.0200 -3.7763 3   35.4573 33 -71510 30316 610      15 511        syn-C2H3C(O)NH2, v=0
  195734.7500  0.0200 -3.6852 3  356.1014 99 -71510 303491634      491535        syn-C2H3C(O)NH2, v=0
  195745.3395  0.0035 -6.1496 3  432.1941119  71510 30359 752      60 655        syn-C2H3C(O)NH2, v=0
  195745.3432  0.0035 -6.1496 3  432.1941119  71510 30359 852      60 555        syn-C2H3C(O)NH2, v=0
  195850.5098  0.0050 -6.2686 3  584.1880137  71510 30368 959      69 862        syn-C2H3C(O)NH2, v=0
  195850.5135  0.0050 -6.2686 3  584.1880137  71510 303681059      69 762        syn-C2H3C(O)NH2, v=0
  195873.0796  0.0200 -3.9448 3  547.0767125 -71510 303621746      621647        syn-C2H3C(O)NH2, v=0
  195883.9730  0.0200 -3.7982 3  442.3745111 -71510 303551738      551639        syn-C2H3C(O)NH2, v=0
  195912.3696  0.0031 -4.0672 3  171.0210 71  71510 30335 926      341025        syn-C2H3C(O)NH2, v=0
  196025.3030  0.0009 -5.4153 3   84.3183 51  71510 30325 619      24 618        syn-C2H3C(O)NH2, v=0
  196032.7157  0.0351 -6.2657 3  886.7257117  71510 303584513      594416        syn-C2H3C(O)NH2, v=0
  196032.7157  0.0351 -6.2657 3  886.7257117  71510 303584514      594415        syn-C2H3C(O)NH2, v=0
  196040.3889  0.0063 -6.1593 3  437.2598 75  71510 3033734 3      3833 6        syn-C2H3C(O)NH2, v=0
  196040.3889  0.0063 -6.1593 3  437.2598 75  71510 3033734 4      3833 5        syn-C2H3C(O)NH2, v=0
  196051.3600  0.0251 -4.5832 3  922.6944163  71510 303812061      811962        syn-C2H3C(O)NH2, v=0
  196106.8844  0.0024 -3.9891 3  137.7246 71  71510 30335 233      35 134        syn-C2H3C(O)NH2, v=0
  196106.8883  0.0024 -3.9891 3  137.7246 71  71510 30335 333      35 234        syn-C2H3C(O)NH2, v=0
  196216.3973  0.0013 -6.8418 3  279.6499 93  71510 30346 838      46 839        syn-C2H3C(O)NH2, v=0
  196229.6380  0.0200 -3.6826 3  279.6495 93 -71510 30346 838      46 739        syn-C2H3C(O)NH2, v=0
  196229.6357  0.0535 -6.5578 3 1496.8648195  71510 303973859      963958        syn-C2H3C(O)NH2, v=0
  196229.6357  0.0535 -6.5578 3 1496.8648195  71510 303973860      963957        syn-C2H3C(O)NH2, v=0
  196239.1379  0.0077 -6.6032 3  161.8079 69  71510 30334 925      35 630        syn-C2H3C(O)NH2, v=0
  196262.8631  0.0200 -3.8515 3  485.5710117 -71510 303581742      581643        syn-C2H3C(O)NH2, v=0
  196263.3381  0.0015 -4.9628 3   16.3973 25  71510 30312 4 9      11 110        syn-C2H3C(O)NH2, v=0
  196301.4744  0.0091 -4.3736 3  805.2613151  71510 303752154      752055        syn-C2H3C(O)NH2, v=0
  196311.0011  0.0015 -6.8143 3  224.8370 85  71510 30342 636      42 637        syn-C2H3C(O)NH2, v=0
  196311.6270  0.0200 -3.6947 3  224.8370 85 -71510 30342 636      42 537        syn-C2H3C(O)NH2, v=0
  196321.4835  0.0200 -3.6947 3  224.8370 85 -71510 30342 736      42 637        syn-C2H3C(O)NH2, v=0
  196322.1241  0.0015 -6.8142 3  224.8370 85  71510 30342 736      42 537        syn-C2H3C(O)NH2, v=0
  196323.7007  0.0044 -6.2563 3  250.9718 93  71510 30346 442      47 345        syn-C2H3C(O)NH2, v=0
  196323.7026  0.0044 -6.2563 3  250.9718 93  71510 30346 542      47 245        syn-C2H3C(O)NH2, v=0
  196329.4086  0.0019 -3.7095 3   70.2480 47  71510 30323 618      22 517        syn-C2H3C(O)NH2, v=0
  196371.4387  0.0200 -3.6820 3  279.6499 93 -71510 30346 938      46 839        syn-C2H3C(O)NH2, v=0
  196384.6514  0.0013 -6.8411 3  279.6495 93  71510 30346 938      46 739        syn-C2H3C(O)NH2, v=0
  196392.9136  0.0648 -5.5080 3 1440.1628203  71510 303A12675      A12576        syn-C2H3C(O)NH2, v=0
  196478.8465  0.0017 -3.7553 3  383.9162107  71510 303531142      531043        syn-C2H3C(O)NH2, v=0
  196479.0679  0.0015 -3.7911 3   48.8429 39  71510 30319 614      18 513        syn-C2H3C(O)NH2, v=0
  196496.2786  0.0200 -3.7854 3  417.4017111 -71510 303551343      551244        syn-C2H3C(O)NH2, v=0
  196536.7901  0.0019 -3.7446 3   64.5355 45  71510 30322 617      21 516        syn-C2H3C(O)NH2, v=0
  196597.2792  0.0200 -3.6699 3  343.7839 97 -71510 303481632      481533        syn-C2H3C(O)NH2, v=0
  196603.4542  0.0013 -6.8203 3  251.6232 89  71510 30344 737      44 738        syn-C2H3C(O)NH2, v=0
  196606.5446  0.0200 -3.6817 3  251.6231 89 -71510 30344 737      44 638        syn-C2H3C(O)NH2, v=0
  196645.4106  0.0200 -3.5719 3  218.9828 75 -71510 303371522      371423        syn-C2H3C(O)NH2, v=0
  196646.0480  0.0013 -3.6815 3  251.6232 89  71510 30344 837      44 738        syn-C2H3C(O)NH2, v=0
  196649.1362  0.0013 -6.8201 3  251.6231 89  71510 30344 837      44 638        syn-C2H3C(O)NH2, v=0
  196655.8831  0.0200 -3.5719 3  218.9824 75 -71510 303371523      371424        syn-C2H3C(O)NH2, v=0
  196661.9187  0.0017 -3.6667 3   76.1694 49  71510 30324 619      23 518        syn-C2H3C(O)NH2, v=0
  196663.2353  0.0055 -6.2851 3  403.7007 71  71510 3033533 2      3632 5        syn-C2H3C(O)NH2, v=0
  196663.2353  0.0055 -6.2851 3  403.7007 71  71510 3033533 3      3632 4        syn-C2H3C(O)NH2, v=0
  196733.9951  0.0037 -4.6400 3  376.7851105  71510 303521340      511437        syn-C2H3C(O)NH2, v=0
  196757.9069  0.0304 -6.2078 3  837.8473113  71510 303564412      574315        syn-C2H3C(O)NH2, v=0
  196757.9069  0.0304 -6.2078 3  837.8473113  71510 303564413      574314        syn-C2H3C(O)NH2, v=0
  196852.1894  0.0613 -6.6862 3 1562.8199199  71510 303993960      984059        syn-C2H3C(O)NH2, v=0
  196852.1894  0.0613 -6.6862 3 1562.8199199  71510 303993961      984058        syn-C2H3C(O)NH2, v=0
  196893.7764  0.0019 -3.7700 3   59.0510 43  71510 30321 616      20 515        syn-C2H3C(O)NH2, v=0
  196912.1186  0.0015 -6.8265 3  245.0230 55  71510 3032726 1      2626 0        syn-C2H3C(O)NH2, v=0
  196912.1186  0.0015 -6.8265 3  245.0230 55  71510 3032726 2      2626 1        syn-C2H3C(O)NH2, v=0
  196915.3045  0.0074 -4.2162 3  706.1085143  71510 303711754      711655        syn-C2H3C(O)NH2, v=0
  196944.4966  0.0200 -3.1822 3  102.8577 63 -71510 30331 130      30 229        syn-C2H3C(O)NH2, v=0
  196944.4993  0.0009 -5.3405 3  102.8577 63  71510 30331 230      30 229        syn-C2H3C(O)NH2, v=0
  196944.5009  0.0009 -5.3405 3  102.8577 63  71510 30331 130      30 129        syn-C2H3C(O)NH2, v=0
  196944.4966  0.0200 -3.1822 3  102.8577 63 -71510 30331 230      30 129        syn-C2H3C(O)NH2, v=0
  196947.4012  0.0009 -5.3225 3  103.3776 65  71510 30332 032      31 031        syn-C2H3C(O)NH2, v=0
  196947.3871  0.0200 -3.1293 3  103.3776 65 -71510 30332 032      31 131        syn-C2H3C(O)NH2, v=0
  196947.3871  0.0200 -3.1293 3  103.3776 65 -71510 30332 132      31 031        syn-C2H3C(O)NH2, v=0
  196947.4012  0.0009 -5.3225 3  103.3776 65  71510 30332 132      31 131        syn-C2H3C(O)NH2, v=0
  196951.3771  0.0186 -6.7695 3  716.1393143  71510 303711952      721657        syn-C2H3C(O)NH2, v=0
  196971.7389  0.0009 -3.2427 3  101.8157 61  71510 30330 228      29 327        syn-C2H3C(O)NH2, v=0
  196971.8761  0.0009 -5.3578 3  101.8157 61  71510 30330 328      29 327        syn-C2H3C(O)NH2, v=0
  196972.0146  0.0009 -5.3578 3  101.8157 61  71510 30330 228      29 227        syn-C2H3C(O)NH2, v=0
  196972.1518  0.0009 -3.2427 3  101.8157 61  71510 30330 328      29 227        syn-C2H3C(O)NH2, v=0
  196983.8568  0.0014 -6.5084 3  232.9910 55  71510 3032725 2      2625 1        syn-C2H3C(O)NH2, v=0
  196983.8568  0.0014 -6.5084 3  232.9910 55  71510 3032725 3      2625 2        syn-C2H3C(O)NH2, v=0
  196998.7661  0.0017 -3.7850 3   53.8142 41  71510 30320 615      19 514        syn-C2H3C(O)NH2, v=0
  197057.2593  0.0028 -4.3907 3   27.5139 31  71510 30315 411      14 312        syn-C2H3C(O)NH2, v=0
  197062.6970  0.0014 -6.3163 3  221.4321 55  71510 3032724 3      2624 2        syn-C2H3C(O)NH2, v=0
  197062.6970  0.0014 -6.3163 3  221.4321 55  71510 3032724 4      2624 3        syn-C2H3C(O)NH2, v=0
  197070.7468  0.0200 -3.3148 3  100.2253 59 -71510 30329 326      28 425        syn-C2H3C(O)NH2, v=0
  197077.9275  0.0009 -5.3739 3  100.2253 59  71510 30329 426      28 425        syn-C2H3C(O)NH2, v=0
  197084.3952  0.0009 -5.3739 3  100.2248 59  71510 30329 326      28 325        syn-C2H3C(O)NH2, v=0
  197091.5697  0.0200 -3.3148 3  100.2248 59 -71510 30329 426      28 325        syn-C2H3C(O)NH2, v=0
  197101.4898  0.0200 -3.4084 3   98.0449 57 -71510 30328 424      27 523        syn-C2H3C(O)NH2, v=0
  197133.9247  0.0439 -5.3592 3 1361.2900197  71510 303982672      982573        syn-C2H3C(O)NH2, v=0
  197150.0043  0.0013 -6.1765 3  210.3468 55  71510 3032723 4      2623 3        syn-C2H3C(O)NH2, v=0
  197150.0043  0.0013 -6.1765 3  210.3468 55  71510 3032723 5      2623 4        syn-C2H3C(O)NH2, v=0
  197247.4672  0.0013 -6.0658 3  199.7353 55  71510 3032722 5      2622 4        syn-C2H3C(O)NH2, v=0
  197247.4672  0.0013 -6.0658 3  199.7353 55  71510 3032722 6      2622 5        syn-C2H3C(O)NH2, v=0
  197274.3301  0.0049 -6.4917 3  371.5825 67  71510 3033332 1      3431 4        syn-C2H3C(O)NH2, v=0
  197274.3301  0.0049 -6.4917 3  371.5825 67  71510 3033332 2      3431 3        syn-C2H3C(O)NH2, v=0
  197275.0394  0.0009 -5.4030 3   95.2521 55  71510 30327 622      26 621        syn-C2H3C(O)NH2, v=0
  197320.8935  0.0009 -5.3884 3   98.0449 57  71510 30328 524      27 523        syn-C2H3C(O)NH2, v=0
  197357.1963  0.0012 -5.9740 3  189.5984 55  71510 3032721 6      2621 5        syn-C2H3C(O)NH2, v=0
  197357.1963  0.0012 -5.9740 3  189.5984 55  71510 3032721 7      2621 6        syn-C2H3C(O)NH2, v=0
  197427.2650  0.0183 -6.6335 3  863.2556165  71510 303821270      831173        syn-C2H3C(O)NH2, v=0
  197427.2673  0.0183 -6.6335 3  863.2556165  71510 303821370      831073        syn-C2H3C(O)NH2, v=0
  197460.7281  0.0027 -6.2338 3  171.0210 67  71510 303331320      341025        syn-C2H3C(O)NH2, v=0
  197474.1033  0.0263 -6.1573 3  790.4019109  71510 303544311      554214        syn-C2H3C(O)NH2, v=0
  197474.1033  0.0263 -6.1573 3  790.4019109  71510 303544312      554213        syn-C2H3C(O)NH2, v=0
  197481.8594  0.0012 -5.8956 3  179.9365 55  71510 3032720 7      2620 6        syn-C2H3C(O)NH2, v=0
  197481.8594  0.0012 -5.8956 3  179.9365 55  71510 3032720 8      2620 7        syn-C2H3C(O)NH2, v=0
  197489.3615  0.0699 -6.8175 3 1630.1971203  71510 303A14061      A04160        syn-C2H3C(O)NH2, v=0
  197489.3615  0.0699 -6.8175 3 1630.1971203  71510 303A14062      A04159        syn-C2H3C(O)NH2, v=0
  197489.6336  0.0009 -5.3876 3   98.0319 57  71510 30328 424      27 423        syn-C2H3C(O)NH2, v=0
  197522.1856  0.0155 -6.7098 3  766.4305145  71510 303722350      732053        syn-C2H3C(O)NH2, v=0
  197613.3876  0.0200 -3.5675 3  209.7863 73 -71510 303361521      361422        syn-C2H3C(O)NH2, v=0
  197618.3129  0.0200 -3.5675 3  209.7861 73 -71510 303361522      361423        syn-C2H3C(O)NH2, v=0
  197624.8718  0.0011 -5.8272 3  170.7505 55  71510 3032719 8      2619 7        syn-C2H3C(O)NH2, v=0
  197624.8718  0.0011 -5.8272 3  170.7505 55  71510 3032719 9      2619 8        syn-C2H3C(O)NH2, v=0
  197634.8709  0.0017 -5.9113 3   24.1961 27  71510 30313 6 8      13 311        syn-C2H3C(O)NH2, v=0
  197643.1972  0.0767 -5.3479 3 1354.6973197  71510 303982573      982474        syn-C2H3C(O)NH2, v=0
  197709.0414  0.0200 -3.4056 3   98.0319 57 -71510 30328 524      27 423        syn-C2H3C(O)NH2, v=0
  197749.8856  0.0051 -6.4360 3  204.0144 85  71510 30342 339      43 242        syn-C2H3C(O)NH2, v=0
  197749.8866  0.0051 -6.4360 3  204.0144 85  71510 30342 439      43 142        syn-C2H3C(O)NH2, v=0
  197760.8843  0.0200 -3.6650 3  343.7398 97 -71510 303481633      481534        syn-C2H3C(O)NH2, v=0
  197790.6692  0.0011 -5.7667 3  162.0414 55  71510 3032718 9      2618 8        syn-C2H3C(O)NH2, v=0
  197790.6692  0.0011 -5.7667 3  162.0414 55  71510 303271810      2618 9        syn-C2H3C(O)NH2, v=0
  197823.7478  0.0200 -3.9637 3  563.0470127 -71510 303631747      631648        syn-C2H3C(O)NH2, v=0
  197845.4367  0.0016 -3.6193 3   82.2835 51  71510 30325 620      24 519        syn-C2H3C(O)NH2, v=0
  197858.4287  0.0200 -3.8255 3  470.8262115 -71510 303571741      571642        syn-C2H3C(O)NH2, v=0
  197985.1095  0.0011 -5.7127 3  153.8103 55  71510 303271710      2617 9        syn-C2H3C(O)NH2, v=0
  197985.1095  0.0011 -5.7127 3  153.8103 55  71510 303271711      261710        syn-C2H3C(O)NH2, v=0
  198012.1193  0.0050 -5.3470 3   47.2092 39  71510 30319 514      19 217        syn-C2H3C(O)NH2, v=0
  198093.9028  0.0012 -6.3640 3    8.0837 17  71510 303 8 5 4       7 2 5        syn-C2H3C(O)NH2, v=0
  198181.1201  0.0226 -6.1148 3  744.3905105  71510 303524210      534113        syn-C2H3C(O)NH2, v=0
  198181.1201  0.0226 -6.1148 3  744.3905105  71510 303524211      534112        syn-C2H3C(O)NH2, v=0
  198188.5136  0.0238 -4.7151 3 1005.7671169  71510 303842361      842262        syn-C2H3C(O)NH2, v=0
  198216.0803  0.0011 -5.6641 3  146.0591 55  71510 303271611      261610        syn-C2H3C(O)NH2, v=0
  198216.0803  0.0011 -5.6641 3  146.0591 55  71510 303271612      261611        syn-C2H3C(O)NH2, v=0
  198279.2840  0.0865 -6.8006 3 1251.1753143  71510 303715219      725122        syn-C2H3C(O)NH2, v=0
  198279.2840  0.0865 -6.8006 3 1251.1753143  71510 303715220      725121        syn-C2H3C(O)NH2, v=0
  198364.3079  0.0035 -6.1414 3  370.6755111  71510 30355 649      56 552        syn-C2H3C(O)NH2, v=0
  198364.3104  0.0035 -6.1414 3  370.6755111  71510 30355 749      56 452        syn-C2H3C(O)NH2, v=0
  198371.7356  0.0022 -3.8509 3  160.0315 75  71510 30337 334      37 235        syn-C2H3C(O)NH2, v=0
  198371.7679  0.0022 -3.8509 3  160.0315 75  71510 30337 434      37 335        syn-C2H3C(O)NH2, v=0
  198489.4429  0.0200 -3.5646 3  200.8511 71 -71510 303351520      351421        syn-C2H3C(O)NH2, v=0
  198491.7212  0.0200 -3.5646 3  200.8510 71 -71510 303351521      351422        syn-C2H3C(O)NH2, v=0
  198494.4530  0.0010 -5.6202 3  138.7897 55  71510 303271512      261511        syn-C2H3C(O)NH2, v=0
  198494.4530  0.0010 -5.6202 3  138.7897 55  71510 303271513      261512        syn-C2H3C(O)NH2, v=0
  198583.9049  0.0033 -6.3915 3  126.8735 57  71510 303281217      29 920        syn-C2H3C(O)NH2, v=0
  198614.2797  0.0264 -5.6125 3 1500.7618207  71510 303A32776      A32677        syn-C2H3C(O)NH2, v=0
  198651.7719  0.0397 -5.6637 3 1528.1080209  71510 303A42777      A42678        syn-C2H3C(O)NH2, v=0
  198662.8783  0.0019 -3.9330 3  540.4500125  71510 303621647      621548        syn-C2H3C(O)NH2, v=0
  198678.2739  0.0057 -6.8026 3  161.5898 77  71510 30338 236      39 139        syn-C2H3C(O)NH2, v=0
  198678.2743  0.0057 -6.8026 3  161.5898 77  71510 30338 336      39 039        syn-C2H3C(O)NH2, v=0
  198693.5882  0.0012 -5.4284 3   95.5317 53  71510 30326 818      25 817        syn-C2H3C(O)NH2, v=0
  198720.1034  0.0074 -6.3739 3  676.8693147  71510 303731063      74 966        syn-C2H3C(O)NH2, v=0
  198720.1060  0.0074 -6.3739 3  676.8693147  71510 303731163      74 866        syn-C2H3C(O)NH2, v=0
  198795.6182  0.0200 -3.7456 3  383.9274107 -71510 303531242      531143        syn-C2H3C(O)NH2, v=0
  198835.6445  0.0010 -5.5803 3  132.0054 55  71510 303271414      261413        syn-C2H3C(O)NH2, v=0
  198835.6454  0.0010 -5.5803 3  132.0054 55  71510 303271413      261412        syn-C2H3C(O)NH2, v=0
  198864.4136  0.0029 -6.5309 3   95.3796 49  71510 303241113      25 818        syn-C2H3C(O)NH2, v=0
  198878.7580  0.0193 -6.0814 3  699.8138101  71510 3035041 9      514012        syn-C2H3C(O)NH2, v=0
  198878.7580  0.0193 -6.0814 3  699.8138101  71510 303504110      514011        syn-C2H3C(O)NH2, v=0
  198898.1941  0.0475 -4.8679 3 1090.3322177  71510 303882266      882167        syn-C2H3C(O)NH2, v=0
  199020.4305  0.0200 -3.6490 3  331.6769 95 -71510 303471631      471532        syn-C2H3C(O)NH2, v=0
  199038.7400  0.0023 -5.5069 3   38.2692 33  71510 30316 7 9      16 412        syn-C2H3C(O)NH2, v=0
  199044.4011  0.0157 -5.5291 3  717.7806145  71510 303721756      711853        syn-C2H3C(O)NH2, v=0
  199057.5528  0.0769 -6.7068 3 1192.7769139  71510 303695118      705021        syn-C2H3C(O)NH2, v=0
  199057.5528  0.0769 -6.7068 3 1192.7769139  71510 303695119      705020        syn-C2H3C(O)NH2, v=0
  199062.8029  0.0200 -3.8823 3  502.8399121 -71510 303601546      601447        syn-C2H3C(O)NH2, v=0
  199086.0809  0.0041 -6.2013 3  512.6589129  71510 30364 856      65 759        syn-C2H3C(O)NH2, v=0
  199086.0837  0.0041 -6.2013 3  512.6589129  71510 30364 956      65 659        syn-C2H3C(O)NH2, v=0
  199262.3184  0.0010 -5.5439 3  125.7105 55  71510 303271315      261314        syn-C2H3C(O)NH2, v=0
  199262.3418  0.0010 -5.5439 3  125.7105 55  71510 303271314      261313        syn-C2H3C(O)NH2, v=0
  199282.4779  0.0200 -3.5634 3  192.1759 69 -71510 303341519      341420        syn-C2H3C(O)NH2, v=0
  199283.5013  0.0200 -3.5634 3  192.1758 69 -71510 303341520      341421        syn-C2H3C(O)NH2, v=0
  199438.6696  0.0200 -3.9030 3  522.7461121 -71510 303601842      601743        syn-C2H3C(O)NH2, v=0
  199450.4349  0.0019 -4.4144 3  338.0483 99  71510 303491337      481434        syn-C2H3C(O)NH2, v=0
  199455.9955  0.0009 -5.3922 3   95.0534 55  71510 30327 522      26 521        syn-C2H3C(O)NH2, v=0
  199462.5521  0.1962 -6.8365 3 1354.6973199  71510 303992377      982474        syn-C2H3C(O)NH2, v=0
  199508.1330  0.0044 -5.0582 3  740.6605141  71510 303702447      692544        syn-C2H3C(O)NH2, v=0
  199510.1328  0.0044 -5.0582 3  740.6605141  71510 303702446      692545        syn-C2H3C(O)NH2, v=0
  199517.0283  0.0027 -4.2443 3  123.6921 69  71510 30334 133      34 034        syn-C2H3C(O)NH2, v=0
  199517.0285  0.0027 -4.2443 3  123.6921 69  71510 30334 233      34 134        syn-C2H3C(O)NH2, v=0
  199524.6796  0.0019 -4.4051 3  375.1962103  71510 303511536      501635        syn-C2H3C(O)NH2, v=0
  199527.7549  0.0035 -4.9729 3  695.6993137  71510 303682346      672443        syn-C2H3C(O)NH2, v=0
  199533.4714  0.0035 -4.9729 3  695.6993137  71510 303682345      672444        syn-C2H3C(O)NH2, v=0
  199566.8018  0.0165 -6.0583 3  656.6727 97  71510 3034840 8      493911        syn-C2H3C(O)NH2, v=0
  199566.8018  0.0165 -6.0583 3  656.6727 97  71510 3034840 9      493910        syn-C2H3C(O)NH2, v=0
  199570.5002  0.0020 -3.8005 3  431.0984113  71510 303561244      561145        syn-C2H3C(O)NH2, v=0
  199571.6932  0.0049 -4.1924 3  704.1723141  71510 303702050      701951        syn-C2H3C(O)NH2, v=0
  199579.9435  0.0056 -5.1463 3  787.0619145  71510 303722548      712645        syn-C2H3C(O)NH2, v=0
  199580.6329  0.0056 -5.1463 3  787.0619145  71510 303722547      712646        syn-C2H3C(O)NH2, v=0
  199622.1577  0.0083 -6.4629 3  445.0329113  71510 303561541      571246        syn-C2H3C(O)NH2, v=0
  199646.3832  0.0448 -5.1095 3 1228.5845187  71510 303932568      932469        syn-C2H3C(O)NH2, v=0
  199655.9028  0.0027 -4.8906 3  652.1795133  71510 303662245      652342        syn-C2H3C(O)NH2, v=0
  199671.9776  0.0027 -4.8905 3  652.1795133  71510 303662244      652343        syn-C2H3C(O)NH2, v=0
  199689.9978  0.0200 -3.6462 3  331.6517 95 -71510 303471632      471533        syn-C2H3C(O)NH2, v=0
  199729.1211  0.0071 -5.2373 3  834.9021149  71510 303742649      732746        syn-C2H3C(O)NH2, v=0
  199729.3556  0.0071 -5.2373 3  834.9021149  71510 303742648      732747        syn-C2H3C(O)NH2, v=0
  199737.2958  0.0293 -6.8024 3  974.8158175  71510 303871374      881277        syn-C2H3C(O)NH2, v=0
  199737.2974  0.0293 -6.8024 3  974.8158175  71510 303871474      881177        syn-C2H3C(O)NH2, v=0
  199782.7055  0.0200 -3.7992 3  456.3467113 -71510 303561740      561641        syn-C2H3C(O)NH2, v=0
  199809.2703  0.0010 -5.5105 3  119.9114 55  71510 303271216      261215        syn-C2H3C(O)NH2, v=0
  199809.7556  0.0010 -5.5105 3  119.9114 55  71510 303271215      261214        syn-C2H3C(O)NH2, v=0
  199827.6097  0.0682 -6.6179 3 1135.8048135  71510 303675017      684920        syn-C2H3C(O)NH2, v=0
  199827.6097  0.0682 -6.6179 3 1135.8048135  71510 303675018      684919        syn-C2H3C(O)NH2, v=0
  199852.3501  0.0021 -5.2938 3   14.4265 25  71510 30312 310      11 011        syn-C2H3C(O)NH2, v=0
  199912.3427  0.0022 -4.8111 3  610.1027129  71510 303642144      632241        syn-C2H3C(O)NH2, v=0
  199935.7764  0.0200 -3.7167 3  351.6366103 -71510 303511041      51 942        syn-C2H3C(O)NH2, v=0
  199944.2713  0.0089 -5.3313 3  884.1800153  71510 303762750      752847        syn-C2H3C(O)NH2, v=0
  199944.3501  0.0089 -5.3313 3  884.1800153  71510 303762749      752848        syn-C2H3C(O)NH2, v=0
  199956.7174  0.0022 -4.8109 3  610.1026129  71510 303642143      632242        syn-C2H3C(O)NH2, v=0
  200000.0653  0.0007 -3.5639 3  183.7594 67  71510 303331518      331419        syn-C2H3C(O)NH2, v=0
  200000.5017  0.0007 -3.5639 3  183.7594 67  71510 303331519      331420        syn-C2H3C(O)NH2, v=0
  200040.0102  0.0200 -3.5704 3   88.5795 53 -71510 30326 621      25 520        syn-C2H3C(O)NH2, v=0
  200116.2836  0.0022 -4.2917 3  302.1234 93  71510 303461333      451432        syn-C2H3C(O)NH2, v=0
  200216.1712  0.0110 -5.4282 3  934.8944157  71510 303782851      772948        syn-C2H3C(O)NH2, v=0
  200216.1974  0.0110 -5.4282 3  934.8944157  71510 303782850      772949        syn-C2H3C(O)NH2, v=0
  200234.6964  0.0019 -6.8498 3  183.6280 79  71510 30339 435      39 436        syn-C2H3C(O)NH2, v=0
  200234.7047  0.0019 -3.7678 3  183.6280 79  71510 30339 435      39 336        syn-C2H3C(O)NH2, v=0
  200234.9160  0.0019 -3.7678 3  183.6280 79  71510 30339 535      39 436        syn-C2H3C(O)NH2, v=0
  200234.9242  0.0019 -6.8498 3  183.6280 79  71510 30339 535      39 336        syn-C2H3C(O)NH2, v=0
  200245.0198  0.0140 -6.0473 3  614.9680 93  71510 3034639 7      473810        syn-C2H3C(O)NH2, v=0
  200245.0198  0.0140 -6.0473 3  614.9680 93  71510 3034639 8      4738 9        syn-C2H3C(O)NH2, v=0
  200281.0695  0.0049 -4.1082 3  645.9326137  71510 303681652      681553        syn-C2H3C(O)NH2, v=0
  200316.9569  0.0019 -4.7344 3  569.4704125  71510 303622043      612140        syn-C2H3C(O)NH2, v=0
  200342.3539  0.0200 -3.7633 3  428.3469109 -71510 303541737      541638        syn-C2H3C(O)NH2, v=0
  200420.7681  0.0095 -6.5833 3  685.9921137  71510 303682247      691950        syn-C2H3C(O)NH2, v=0
  200436.9069  0.0019 -4.7339 3  569.4702125  71510 303622042      612141        syn-C2H3C(O)NH2, v=0
  200531.1734  0.0010 -5.4796 3  114.6179 55  71510 303271117      261116        syn-C2H3C(O)NH2, v=0
  200537.3142  0.0134 -5.5280 3  987.0440161  71510 303802952      793049        syn-C2H3C(O)NH2, v=0
  200537.3229  0.0134 -5.5280 3  987.0440161  71510 303802951      793050        syn-C2H3C(O)NH2, v=0
  200539.0837  0.0010 -5.4796 3  114.6181 55  71510 303271116      261115        syn-C2H3C(O)NH2, v=0
  200556.3606  0.0015 -4.3842 3  356.1770101  71510 303501437      491534        syn-C2H3C(O)NH2, v=0
  200589.3449  0.0602 -6.5343 3 1080.2600131  71510 303654916      664819        syn-C2H3C(O)NH2, v=0
  200589.3449  0.0602 -6.5343 3 1080.2600131  71510 303654917      664818        syn-C2H3C(O)NH2, v=0
  200606.7474  0.0039 -6.1737 3  313.6672103  71510 30351 546      52 449        syn-C2H3C(O)NH2, v=0
  200606.7490  0.0039 -6.1737 3  313.6672103  71510 30351 646      52 349        syn-C2H3C(O)NH2, v=0
  200648.9341  0.0200 -3.5662 3  175.6007 65 -71510 303321517      321418        syn-C2H3C(O)NH2, v=0
  200648.9341  0.0200 -3.5662 3  175.6007 65 -71510 303321518      321419        syn-C2H3C(O)NH2, v=0
  200656.7340  0.0200 -3.6460 3   34.2586 31 -71510 30315 7 9      14 6 8        syn-C2H3C(O)NH2, v=0
  200665.9232  0.0200 -3.5205 3   28.5179 23 -71510 30311 9 3      10 8 2        syn-C2H3C(O)NH2, v=0
  200665.9232  0.0200 -3.5205 3   28.5179 23 -71510 30311 9 2      10 8 3        syn-C2H3C(O)NH2, v=0
  200700.0245  0.0019 -3.9806 3  579.2392129  71510 303641748      641649        syn-C2H3C(O)NH2, v=0
  200712.7999  0.0200 -4.0347 3  610.0045131 -71510 303651946      651847        syn-C2H3C(O)NH2, v=0
  200769.7208  0.0200 -3.7132 3  351.6400103 -71510 303511141      511042        syn-C2H3C(O)NH2, v=0
  200863.6362  0.0026 -6.1766 3  212.2827 75  71510 303371423      381128        syn-C2H3C(O)NH2, v=0
  200881.5129  0.0018 -4.6608 3  530.2844121  71510 303601942      592039        syn-C2H3C(O)NH2, v=0
  200899.7398  0.0029 -4.5359 3  363.5373103  71510 303511339      501436        syn-C2H3C(O)NH2, v=0
  200901.5425  0.0162 -5.6309 3 1040.6277165  71510 303823053      813150        syn-C2H3C(O)NH2, v=0
  200901.5453  0.0162 -5.6309 3 1040.6277165  71510 303823052      813151        syn-C2H3C(O)NH2, v=0
  200913.1627  0.0119 -6.0508 3  574.7003 89  71510 3034438 6      4537 9        syn-C2H3C(O)NH2, v=0
  200913.1627  0.0119 -6.0508 3  574.7003 89  71510 3034438 7      4537 8        syn-C2H3C(O)NH2, v=0
  200944.2322  0.0018 -3.8319 3  466.3959117  71510 303581445      581346        syn-C2H3C(O)NH2, v=0
  200968.5182  0.0200 -3.6450 3   34.2495 31 -71510 30315 7 8      14 6 9        syn-C2H3C(O)NH2, v=0
  200988.5811  0.0200 -3.5754 3   30.6171 27 -71510 30313 8 6      12 7 5        syn-C2H3C(O)NH2, v=0
  200990.1834  0.0200 -3.5754 3   30.6170 27 -71510 30313 8 5      12 7 6        syn-C2H3C(O)NH2, v=0
  201049.0128  0.1006 -6.3578 3 1120.3163181  71510 303902170      892267        syn-C2H3C(O)NH2, v=0
  201124.4094  0.0200 -3.6303 3  319.8504 93 -71510 303461630      461531        syn-C2H3C(O)NH2, v=0
  201170.2133  0.0200 -3.5044 3  101.8325 57 -71510 30328 523      27 622        syn-C2H3C(O)NH2, v=0
  201197.9997  0.0018 -4.6594 3  530.2838121  71510 303601941      592040        syn-C2H3C(O)NH2, v=0
  201234.7079  0.0200 -3.5703 3  167.6986 63 -71510 303311516      311417        syn-C2H3C(O)NH2, v=0
  201234.7079  0.0200 -3.5703 3  167.6986 63 -71510 303311517      311418        syn-C2H3C(O)NH2, v=0
  201303.7621  0.0195 -5.7367 3 1095.6443169  71510 303843154      833251        syn-C2H3C(O)NH2, v=0
  201303.7631  0.0195 -5.7367 3 1095.6443169  71510 303843153      833252        syn-C2H3C(O)NH2, v=0
  201342.6399  0.0530 -6.4561 3 1026.1437127  71510 303634815      644718        syn-C2H3C(O)NH2, v=0
  201342.6399  0.0530 -6.4561 3 1026.1437127  71510 303634816      644717        syn-C2H3C(O)NH2, v=0
  201402.0700  0.0122 -6.5028 3  776.2535157  71510 303781167      791070        syn-C2H3C(O)NH2, v=0
  201402.0718  0.0122 -6.5028 3  776.2535157  71510 303781267      79 970        syn-C2H3C(O)NH2, v=0
  201497.3720  0.0010 -5.4508 3  109.8455 55  71510 303271018      261017        syn-C2H3C(O)NH2, v=0
  201500.8324  0.0200 -3.6287 3  319.8363 93 -71510 303461631      461532        syn-C2H3C(O)NH2, v=0
  201544.5111  0.0430 -5.9201 3  907.9721163  71510 303811963      802060        syn-C2H3C(O)NH2, v=0
  201547.8343  0.0068 -6.4239 3  286.2001 91  71510 303451233      46 938        syn-C2H3C(O)NH2, v=0
  201570.9627  0.0101 -6.0722 3  535.8706 85  71510 3034237 5      4336 8        syn-C2H3C(O)NH2, v=0
  201570.9627  0.0101 -6.0722 3  535.8706 85  71510 3034237 6      4336 7        syn-C2H3C(O)NH2, v=0
  201588.5695  0.0017 -4.5904 3  492.5470117  71510 303581841      571938        syn-C2H3C(O)NH2, v=0
  201595.4776  0.0010 -5.4504 3  109.8486 55  71510 303271017      261016        syn-C2H3C(O)NH2, v=0
  201662.6157  0.0023 -4.4615 3  350.6274101  71510 303501338      491435        syn-C2H3C(O)NH2, v=0
  201662.7873  0.0765 -5.1853 3 1271.7064191  71510 303952471      952372        syn-C2H3C(O)NH2, v=0
  201663.8571  0.0017 -6.8155 3  208.5031 83  71510 30341 536      41 537        syn-C2H3C(O)NH2, v=0
  201663.9090  0.0200 -3.7168 3  208.5031 83 -71510 30341 536      41 437        syn-C2H3C(O)NH2, v=0
  201665.0760  0.0200 -3.7168 3  208.5031 83 -71510 30341 636      41 537        syn-C2H3C(O)NH2, v=0
  201665.1212  0.0017 -6.8155 3  208.5031 83  71510 30341 636      41 437        syn-C2H3C(O)NH2, v=0
  201675.1298  0.0200 -3.8583 3  480.9015119 -71510 303591346      591247        syn-C2H3C(O)NH2, v=0
  201676.4200  0.0009 -5.3954 3   98.5609 55  71510 30327 721      26 720        syn-C2H3C(O)NH2, v=0
  201739.7249  0.0231 -5.8454 3 1152.0927173  71510 303863255      853352        syn-C2H3C(O)NH2, v=0
  201739.7252  0.0231 -5.8454 3 1152.0927173  71510 303863254      853353        syn-C2H3C(O)NH2, v=0
  201762.8867  0.0200 -3.5764 3  160.0521 61 -71510 303301515      301416        syn-C2H3C(O)NH2, v=0
  201762.8867  0.0200 -3.5764 3  160.0521 61 -71510 303301516      301417        syn-C2H3C(O)NH2, v=0
  201781.9715  0.0179 -4.4472 3  854.0034157  71510 303781959      781860        syn-C2H3C(O)NH2, v=0
  201896.5198  0.0200 -3.6911 3  320.5528 99 -71510 30349 940      49 841        syn-C2H3C(O)NH2, v=0
  201908.8622  0.0200 -3.7732 3  442.1368111 -71510 303551739      551640        syn-C2H3C(O)NH2, v=0
  201922.8580  0.0032 -6.2868 3  162.6856 65  71510 303321320      331023        syn-C2H3C(O)NH2, v=0
  201927.8652  0.0018 -5.7856 3   27.5139 29  71510 30314 6 9      14 312        syn-C2H3C(O)NH2, v=0
  201958.3674  0.0012 -6.0202 3   10.1633 19  71510 303 9 5 5       8 2 6        syn-C2H3C(O)NH2, v=0
  201998.5200  0.0037 -6.1603 3  445.6274121  71510 30360 753      61 656        syn-C2H3C(O)NH2, v=0
  201998.5219  0.0037 -6.1603 3  445.6274121  71510 30360 853      61 556        syn-C2H3C(O)NH2, v=0
  202087.3658  0.0465 -6.3837 3  973.4567123  71510 303614714      624617        syn-C2H3C(O)NH2, v=0
  202087.3658  0.0465 -6.3837 3  973.4567123  71510 303614715      624616        syn-C2H3C(O)NH2, v=0
  202154.6728  0.0013 -6.8132 3    5.9896 15  71510 303 7 5 2       6 2 5        syn-C2H3C(O)NH2, v=0
  202170.4234  0.0200 -3.6900 3  320.5538 99 -71510 303491040      49 941        syn-C2H3C(O)NH2, v=0
  202174.1473  0.0025 -3.9786 3  145.3040 73  71510 30336 234      36 135        syn-C2H3C(O)NH2, v=0
  202174.1491  0.0025 -3.9786 3  145.3040 73  71510 30336 334      36 235        syn-C2H3C(O)NH2, v=0
  202182.5826  0.0034 -4.0122 3  588.3302131  71510 303651550      651451        syn-C2H3C(O)NH2, v=0
  202200.4662  0.0053 -6.2828 3  599.8401139  71510 30369 960      70 863        syn-C2H3C(O)NH2, v=0
  202200.4681  0.0053 -6.2828 3  599.8401139  71510 303691060      70 763        syn-C2H3C(O)NH2, v=0
  202205.8613  0.0273 -5.9572 3 1209.9716177  71510 303883356      873453        syn-C2H3C(O)NH2, v=0
  202205.8614  0.0273 -5.9572 3 1209.9716177  71510 303883355      873454        syn-C2H3C(O)NH2, v=0
  202218.1329  0.0086 -6.1170 3  498.4793 81  71510 3034036 4      4135 7        syn-C2H3C(O)NH2, v=0
  202218.1329  0.0086 -6.1170 3  498.4793 81  71510 3034036 5      4135 6        syn-C2H3C(O)NH2, v=0
  202238.0682  0.0200 -3.5846 3  152.6604 59 -71510 303291514      291415        syn-C2H3C(O)NH2, v=0
  202238.0682  0.0200 -3.5846 3  152.6604 59 -71510 303291515      291416        syn-C2H3C(O)NH2, v=0
  202284.6822  0.0030 -4.1061 3  202.6850 77  71510 303381028      371127        syn-C2H3C(O)NH2, v=0
  202344.7888  0.0017 -4.5242 3  456.2613113  71510 303561740      551837        syn-C2H3C(O)NH2, v=0
  202400.2757  0.0018 -4.5868 3  492.5454117  71510 303581840      571939        syn-C2H3C(O)NH2, v=0
  202441.2590  0.0045 -6.2623 3  261.1760 95  71510 30347 443      48 346        syn-C2H3C(O)NH2, v=0
  202441.2600  0.0045 -6.2623 3  261.1760 95  71510 30347 543      48 246        syn-C2H3C(O)NH2, v=0
  202606.3075  0.0027 -3.9289 3  533.3157125  71510 303621448      621349        syn-C2H3C(O)NH2, v=0
  202617.6228  0.0015 -6.8040 3  234.6453 87  71510 30343 637      43 638        syn-C2H3C(O)NH2, v=0
  202618.0009  0.0200 -3.6879 3  234.6453 87 -71510 30343 637      43 538        syn-C2H3C(O)NH2, v=0
  202623.3577  0.0200 -3.6879 3  234.6453 87 -71510 30343 737      43 638        syn-C2H3C(O)NH2, v=0
  202623.6660  0.0014 -6.8039 3  234.6453 87  71510 30343 737      43 538        syn-C2H3C(O)NH2, v=0
  202647.9220  0.0010 -5.4242 3  105.6125 55  71510 30327 919      26 918        syn-C2H3C(O)NH2, v=0
  202655.4001  0.0016 -4.4144 3  388.0657105  71510 303521538      511635        syn-C2H3C(O)NH2, v=0
  202664.7570  0.0200 -3.5952 3  145.5226 57 -71510 303281513      281414        syn-C2H3C(O)NH2, v=0
  202664.7570  0.0200 -3.5952 3  145.5226 57 -71510 303281514      281415        syn-C2H3C(O)NH2, v=0
  202699.1514  0.0320 -6.0720 3 1269.2799181  71510 303903456      893555        syn-C2H3C(O)NH2, v=0
  202699.1514  0.0320 -6.0720 3 1269.2799181  71510 303903457      893554        syn-C2H3C(O)NH2, v=0
  202760.0479  0.0009 -5.3830 3   90.8570 53  71510 30326 620      25 619        syn-C2H3C(O)NH2, v=0
  202823.3835  0.0407 -6.3175 3  922.2003119  71510 303594613      604516        syn-C2H3C(O)NH2, v=0
  202823.3835  0.0407 -6.3175 3  922.2003119  71510 303594614      604515        syn-C2H3C(O)NH2, v=0
  202839.0145  0.0012 -6.8311 3  290.6834 95  71510 30347 839      47 840        syn-C2H3C(O)NH2, v=0
  202846.3301  0.0200 -3.6773 3  290.6832 95 -71510 30347 839      47 740        syn-C2H3C(O)NH2, v=0
  202854.3666  0.0074 -6.1938 3  462.5273 77  71510 3033835 3      3934 6        syn-C2H3C(O)NH2, v=0
  202854.3666  0.0074 -6.1938 3  462.5273 77  71510 3033835 4      3934 5        syn-C2H3C(O)NH2, v=0
  202855.9168  0.0066 -6.4724 3  610.0045129  71510 303642144      651847        syn-C2H3C(O)NH2, v=0
  202891.0787  0.0016 -4.4641 3  421.4317109  71510 303541639      531736        syn-C2H3C(O)NH2, v=0
  202905.4866  0.0018 -6.3791 3    8.0630 19  71510 303 9 4 5       8 1 8        syn-C2H3C(O)NH2, v=0
  202928.2317  0.0200 -3.6770 3  290.6834 95 -71510 30347 939      47 840        syn-C2H3C(O)NH2, v=0
  202935.5136  0.0012 -6.8307 3  290.6832 95  71510 30347 939      47 740        syn-C2H3C(O)NH2, v=0
  202977.2231  0.0200 -3.6135 3  308.3001 91 -71510 303451629      451530        syn-C2H3C(O)NH2, v=0
  203000.8181  0.0200 -3.1540 3  109.4271 65 -71510 30332 131      31 230        syn-C2H3C(O)NH2, v=0
  203000.7871  0.0009 -5.3141 3  109.4271 65  71510 30332 231      31 230        syn-C2H3C(O)NH2, v=0
  203000.7878  0.0009 -5.3141 3  109.4271 65  71510 30332 131      31 130        syn-C2H3C(O)NH2, v=0
  203000.8181  0.0200 -3.1540 3  109.4271 65 -71510 30332 231      31 130        syn-C2H3C(O)NH2, v=0
  203004.3954  0.0009 -5.2966 3  109.9470 67  71510 30333 033      32 032        syn-C2H3C(O)NH2, v=0
  203004.4118  0.0200 -3.1029 3  109.9470 67 -71510 30333 033      32 132        syn-C2H3C(O)NH2, v=0
  203004.4118  0.0200 -3.1029 3  109.9470 67 -71510 30333 133      32 032        syn-C2H3C(O)NH2, v=0
  203004.3954  0.0009 -5.2966 3  109.9470 67  71510 30333 133      32 132        syn-C2H3C(O)NH2, v=0
  203024.8990  0.0200 -3.2120 3  108.3860 63 -71510 30331 229      30 328        syn-C2H3C(O)NH2, v=0
  203024.8468  0.0009 -5.3308 3  108.3860 63  71510 30331 329      30 328        syn-C2H3C(O)NH2, v=0
  203024.9161  0.0009 -5.3308 3  108.3860 63  71510 30331 229      30 228        syn-C2H3C(O)NH2, v=0
  203024.8990  0.0200 -3.2120 3  108.3860 63 -71510 30331 329      30 228        syn-C2H3C(O)NH2, v=0
  203038.5244  0.0013 -6.8101 3  262.0429 91  71510 30345 738      45 739        syn-C2H3C(O)NH2, v=0
  203040.1927  0.0200 -3.6758 3  262.0428 91 -71510 30345 738      45 639        syn-C2H3C(O)NH2, v=0
  203046.8167  0.0200 -3.6083 3  138.6379 55 -71510 303271512      271413        syn-C2H3C(O)NH2, v=0
  203046.8167  0.0200 -3.6083 3  138.6379 55 -71510 303271513      271414        syn-C2H3C(O)NH2, v=0
  203062.3727  0.0200 -3.6757 3  262.0429 91 -71510 30345 838      45 739        syn-C2H3C(O)NH2, v=0
  203064.0193  0.0013 -6.8100 3  262.0428 91  71510 30345 838      45 639        syn-C2H3C(O)NH2, v=0
  203116.7181  0.0200 -3.2805 3  106.7991 61 -71510 30330 327      29 426        syn-C2H3C(O)NH2, v=0
  203120.4657  0.0009 -5.3463 3  106.7991 61  71510 30330 427      29 426        syn-C2H3C(O)NH2, v=0
  203123.8956  0.0009 -5.3463 3  106.7988 61  71510 30330 327      29 326        syn-C2H3C(O)NH2, v=0
  203127.6319  0.0200 -3.2805 3  106.7988 61 -71510 30330 427      29 326        syn-C2H3C(O)NH2, v=0
  203168.0860  0.0564 -5.5488 3 1473.6162205  71510 303A22775      A22676        syn-C2H3C(O)NH2, v=0
  203177.9632  0.0146 -4.5001 3  892.2608159  71510 303792257      792158        syn-C2H3C(O)NH2, v=0
  203184.0766  0.0200 -3.6127 3  308.2925 91 -71510 303451630      451531        syn-C2H3C(O)NH2, v=0
  203217.0244  0.0373 -6.1897 3 1330.0163185  71510 303923557      913656        syn-C2H3C(O)NH2, v=0
  203217.0244  0.0373 -6.1897 3 1330.0163185  71510 303923558      913655        syn-C2H3C(O)NH2, v=0
  203231.0083  0.0200 -3.5222 3   95.0534 55 -71510 30327 622      26 521        syn-C2H3C(O)NH2, v=0
  203233.3984  0.0200 -3.3673 3  104.6268 59 -71510 30329 425      28 524        syn-C2H3C(O)NH2, v=0
  203241.4547  0.0010 -5.4033 3  101.9030 55  71510 30327 820      26 819        syn-C2H3C(O)NH2, v=0
  203355.8602  0.0009 -5.3602 3  104.6268 59  71510 30329 525      28 524        syn-C2H3C(O)NH2, v=0
  203388.0276  0.0200 -3.6243 3  132.0054 53 -71510 303261511      261412        syn-C2H3C(O)NH2, v=0
  203388.0276  0.0200 -3.6243 3  132.0054 53 -71510 303261512      261413        syn-C2H3C(O)NH2, v=0
  203391.4641  0.0200 -3.7848 3  431.1190113 -71510 303561344      561245        syn-C2H3C(O)NH2, v=0
  203452.8365  0.0009 -5.3598 3  104.6195 59  71510 30329 425      28 424        syn-C2H3C(O)NH2, v=0
  203479.3372  0.0064 -6.3182 3  428.0150 73  71510 3033634 2      3733 5        syn-C2H3C(O)NH2, v=0
  203479.3372  0.0064 -6.3182 3  428.0150 73  71510 3033634 3      3733 4        syn-C2H3C(O)NH2, v=0
  203497.2954  0.0886 -5.7016 3 1555.6159211  71510 303A52778      A52679        syn-C2H3C(O)NH2, v=0
  203499.2336  0.0009 -5.3733 3  101.8325 57  71510 30328 623      27 622        syn-C2H3C(O)NH2, v=0
  203518.2477  0.0010 -5.4205 3  105.6464 55  71510 30327 918      26 917        syn-C2H3C(O)NH2, v=0
  203550.5424  0.0354 -6.2580 3  872.3752115  71510 303574512      584415        syn-C2H3C(O)NH2, v=0
  203550.5424  0.0354 -6.2580 3  872.3752115  71510 303574513      584414        syn-C2H3C(O)NH2, v=0
  203575.2707  0.0200 -3.3658 3  104.6195 59 -71510 30329 525      28 424        syn-C2H3C(O)NH2, v=0
  203612.2060  0.0025 -6.1493 3  258.0118 83  71510 303411526      421231        syn-C2H3C(O)NH2, v=0
  203691.7089  0.0200 -3.6436 3  125.6246 51 -71510 303251510      251411        syn-C2H3C(O)NH2, v=0
  203691.7089  0.0200 -3.6436 3  125.6246 51 -71510 303251511      251412        syn-C2H3C(O)NH2, v=0
  203757.2794  0.0432 -6.3105 3 1392.1797189  71510 303943658      933757        syn-C2H3C(O)NH2, v=0
  203757.2794  0.0432 -6.3105 3 1392.1797189  71510 303943659      933756        syn-C2H3C(O)NH2, v=0
  203831.1025  0.0052 -6.4407 3  213.2093 87  71510 30343 340      44 243        syn-C2H3C(O)NH2, v=0
  203831.1030  0.0052 -6.4407 3  213.2093 87  71510 30343 440      44 143        syn-C2H3C(O)NH2, v=0
  203870.8972  0.0011 -5.3873 3   92.8349 53  71510 30326 719      25 718        syn-C2H3C(O)NH2, v=0
  203909.4666  0.0200 -6.6535 3  882.3332167  71510 303831271      841174        syn-C2H3C(O)NH2, v=0
  203909.4679  0.0200 -6.6535 3  882.3332167  71510 303831371      841074        syn-C2H3C(O)NH2, v=0
  203923.0254  0.0200 -3.9422 3  556.2448127 -71510 303631648      631549        syn-C2H3C(O)NH2, v=0
  203961.0260  0.0200 -3.6666 3  119.4945 49 -71510 3032415 9      241410        syn-C2H3C(O)NH2, v=0
  203961.0260  0.0200 -3.6666 3  119.4945 49 -71510 303241510      241411        syn-C2H3C(O)NH2, v=0
  204040.4848  0.0012 -3.7326 3  414.6256107  71510 303531736      531637        syn-C2H3C(O)NH2, v=0
  204092.6976  0.0057 -6.5237 3  394.9431 69  71510 3033433 1      3532 4        syn-C2H3C(O)NH2, v=0
  204092.6976  0.0057 -6.5237 3  394.9431 69  71510 3033433 2      3532 3        syn-C2H3C(O)NH2, v=0
  204129.5184  0.0011 -3.7477 3  428.1994109  71510 303541738      541639        syn-C2H3C(O)NH2, v=0
  204198.9837  0.0200 -3.6942 3  113.6147 47 -71510 3032315 8      2314 9        syn-C2H3C(O)NH2, v=0
  204198.9837  0.0200 -3.6942 3  113.6147 47 -71510 3032315 9      231410        syn-C2H3C(O)NH2, v=0
  204257.6618  0.0015 -6.5153 3  251.5913 57  71510 3032826 2      2726 1        syn-C2H3C(O)NH2, v=0
  204257.6618  0.0015 -6.5153 3  251.5913 57  71510 3032826 3      2726 2        syn-C2H3C(O)NH2, v=0
  204268.6799  0.0307 -6.2059 3  823.9824111  71510 303554411      564314        syn-C2H3C(O)NH2, v=0
  204268.6799  0.0307 -6.2059 3  823.9824111  71510 303554412      564313        syn-C2H3C(O)NH2, v=0
  204280.9114  0.0016 -3.7498 3  397.0121109  71510 303541143      541044        syn-C2H3C(O)NH2, v=0
  204318.0227  0.0498 -6.4342 3 1455.7688193  71510 303963759      953858        syn-C2H3C(O)NH2, v=0
  204318.0227  0.0498 -6.4342 3 1455.7688193  71510 303963760      953857        syn-C2H3C(O)NH2, v=0
  204336.7071  0.0014 -6.3219 3  239.5617 57  71510 3032825 3      2725 2        syn-C2H3C(O)NH2, v=0
  204336.7071  0.0014 -6.3219 3  239.5617 57  71510 3032825 4      2725 3        syn-C2H3C(O)NH2, v=0
  204347.7684  0.0029 -6.3713 3  126.6813 57  71510 303281216      29 921        syn-C2H3C(O)NH2, v=0
  204356.9109  0.0018 -4.5151 3  456.2567113  71510 303561739      551838        syn-C2H3C(O)NH2, v=0
  204408.0143  0.0031 -6.2215 3  202.9678 73  71510 303361423      371126        syn-C2H3C(O)NH2, v=0
  204408.2340  0.0200 -3.7273 3  107.9844 45 -71510 3032215 7      2214 8        syn-C2H3C(O)NH2, v=0
  204408.2340  0.0200 -3.7273 3  107.9844 45 -71510 3032215 8      2214 9        syn-C2H3C(O)NH2, v=0
  204423.7204  0.0014 -6.1808 3  228.0054 57  71510 3032824 4      2724 3        syn-C2H3C(O)NH2, v=0
  204423.7204  0.0014 -6.1808 3  228.0054 57  71510 3032824 5      2724 4        syn-C2H3C(O)NH2, v=0
  204467.5513  0.0022 -3.8417 3  168.2170 77  71510 30338 335      38 236        syn-C2H3C(O)NH2, v=0
  204467.5674  0.0022 -3.8417 3  168.2170 77  71510 30338 435      38 336        syn-C2H3C(O)NH2, v=0
  204480.3012  0.0200 -3.9956 3  595.6462131 -71510 303651749      651650        syn-C2H3C(O)NH2, v=0
  204504.9920  0.0350 -4.8676 3 1102.7059177  71510 303882464      882365        syn-C2H3C(O)NH2, v=0
  204520.2279  0.0013 -6.0689 3  216.9230 57  71510 3032823 5      2723 4        syn-C2H3C(O)NH2, v=0
  204520.2279  0.0013 -6.0689 3  216.9230 57  71510 3032823 6      2723 5        syn-C2H3C(O)NH2, v=0
  204533.3571  0.0200 -3.9743 3  585.9338129 -71510 303641847      641748        syn-C2H3C(O)NH2, v=0
  204565.2086  0.0037 -6.1509 3  383.0998113  71510 30356 650      57 553        syn-C2H3C(O)NH2, v=0
  204565.2098  0.0037 -6.1509 3  383.0998113  71510 30356 750      57 453        syn-C2H3C(O)NH2, v=0
  204591.3793  0.0200 -3.7672 3  102.6031 43 -71510 3032115 6      2114 7        syn-C2H3C(O)NH2, v=0
  204591.3793  0.0200 -3.7672 3  102.6031 43 -71510 3032115 7      2114 8        syn-C2H3C(O)NH2, v=0
  204597.4892  0.0200 -3.7711 3   39.4296 35 -71510 30317 611      16 512        syn-C2H3C(O)NH2, v=0
  204627.2577  0.0200 -3.5986 3  297.0228 89 -71510 303441628      441529        syn-C2H3C(O)NH2, v=0
  204628.1190  0.0013 -5.9757 3  206.3148 57  71510 3032822 6      2722 5        syn-C2H3C(O)NH2, v=0
  204628.1190  0.0013 -5.9757 3  206.3148 57  71510 3032822 7      2722 6        syn-C2H3C(O)NH2, v=0
  204732.9722  0.0058 -6.8060 3  169.7753 79  71510 30339 237      40 140        syn-C2H3C(O)NH2, v=0
  204732.9724  0.0058 -6.8060 3  169.7753 79  71510 30339 337      40 040        syn-C2H3C(O)NH2, v=0
  204738.3442  0.0200 -3.5981 3  297.0187 89 -71510 303441629      441530        syn-C2H3C(O)NH2, v=0
  204749.7571  0.0012 -5.8960 3  196.1815 57  71510 3032821 7      2721 6        syn-C2H3C(O)NH2, v=0
  204749.7571  0.0012 -5.8960 3  196.1815 57  71510 3032821 8      2721 7        syn-C2H3C(O)NH2, v=0
  204750.8218  0.0200 -3.8160 3   97.4702 41 -71510 3032015 5      2014 6        syn-C2H3C(O)NH2, v=0
  204750.8218  0.0200 -3.8160 3   97.4702 41 -71510 3032015 6      2014 7        syn-C2H3C(O)NH2, v=0
  204769.8025  0.0200 -3.9997 3  602.4670131 -71510 303651848      651749        syn-C2H3C(O)NH2, v=0
  204802.5366  0.0053 -6.3777 3  538.4712121  71510 303602041      611744        syn-C2H3C(O)NH2, v=0
  204866.6740  0.0314 -5.8142 3 1618.5473215  71510 303A72879      A72780        syn-C2H3C(O)NH2, v=0
  204874.9589  0.0200 -3.6279 3  112.2423 59 -71510 30329 623      28 722        syn-C2H3C(O)NH2, v=0
  204888.1323  0.0012 -5.8262 3  186.5238 57  71510 3032820 8      2720 7        syn-C2H3C(O)NH2, v=0
  204888.1323  0.0012 -5.8262 3  186.5238 57  71510 3032820 9      2720 8        syn-C2H3C(O)NH2, v=0
  204888.7772  0.0200 -3.8769 3   92.5852 39 -71510 3031915 4      1914 5        syn-C2H3C(O)NH2, v=0
  204888.7772  0.0200 -3.8769 3   92.5852 39 -71510 3031915 5      1914 6        syn-C2H3C(O)NH2, v=0
  204897.6173  0.0572 -6.5609 3 1520.7822197  71510 303983860      973959        syn-C2H3C(O)NH2, v=0
  204897.6173  0.0572 -6.5609 3 1520.7822197  71510 303983861      973958        syn-C2H3C(O)NH2, v=0
  204945.2091  0.0009 -5.3665 3  101.7066 57  71510 30328 523      27 522        syn-C2H3C(O)NH2, v=0
  204977.6207  0.0265 -6.1618 3  777.0229107  71510 303534310      544213        syn-C2H3C(O)NH2, v=0
  204977.6207  0.0265 -6.1618 3  777.0229107  71510 303534311      544212        syn-C2H3C(O)NH2, v=0
  205007.3841  0.0200 -3.9553 3   87.9475 37 -71510 3031815 3      1814 4        syn-C2H3C(O)NH2, v=0
  205007.3841  0.0200 -3.9553 3   87.9475 37 -71510 3031815 4      1814 5        syn-C2H3C(O)NH2, v=0
  205047.0772  0.0011 -5.7644 3  177.3426 57  71510 3032819 9      2719 8        syn-C2H3C(O)NH2, v=0
  205047.0772  0.0011 -5.7644 3  177.3426 57  71510 303281910      2719 9        syn-C2H3C(O)NH2, v=0
  205058.1501  0.0200 -3.9473 3  569.6457127 -71510 303631846      631747        syn-C2H3C(O)NH2, v=0
  205106.8919  0.0378 -4.7172 3 1015.7152171  71510 303852164      852065        syn-C2H3C(O)NH2, v=0
  205108.5813  0.0200 -4.0613 3   83.5566 35 -71510 3031715 2      1714 3        syn-C2H3C(O)NH2, v=0
  205108.5813  0.0200 -4.0613 3   83.5566 35 -71510 3031715 3      1714 4        syn-C2H3C(O)NH2, v=0
  205108.8875  0.0081 -6.3904 3  693.7308149  71510 303741064      75 967        syn-C2H3C(O)NH2, v=0
  205108.8889  0.0081 -6.3904 3  693.7308149  71510 303741164      75 867        syn-C2H3C(O)NH2, v=0
  205153.8347  0.0051 -4.8051 3  451.6916115  71510 303571444      561541        syn-C2H3C(O)NH2, v=0
  205194.2270  0.0012 -4.2180 3   79.4122 33  71510 3031615 1      1614 2        syn-C2H3C(O)NH2, v=0
  205194.2270  0.0012 -4.2180 3   79.4122 33  71510 3031615 2      1614 3        syn-C2H3C(O)NH2, v=0
  205231.5777  0.0011 -5.7091 3  168.6390 57  71510 303281810      2718 9        syn-C2H3C(O)NH2, v=0
  205231.5777  0.0011 -5.7091 3  168.6390 57  71510 303281811      271810        syn-C2H3C(O)NH2, v=0
  205256.3890  0.1048 -5.5323 3 1466.7696205  71510 303A22676      A22577        syn-C2H3C(O)NH2, v=0
  205266.0750  0.0012 -4.4990 3   75.5138 31  71510 3031515 0      1514 1        syn-C2H3C(O)NH2, v=0
  205266.0750  0.0012 -4.4990 3   75.5138 31  71510 3031515 1      1514 2        syn-C2H3C(O)NH2, v=0
  205285.5134  0.0200 -3.8593 3  507.3558119 -71510 303591841      591742        syn-C2H3C(O)NH2, v=0
  205285.8939  0.0548 -5.8667 3 1646.9342217  71510 303A82880      A82781        syn-C2H3C(O)NH2, v=0
  205343.6258  0.0200 -3.8872 3  518.0106123 -71510 303611547      611448        syn-C2H3C(O)NH2, v=0
  205379.7646  0.0042 -6.2144 3  527.3024131  71510 30365 857      66 760        syn-C2H3C(O)NH2, v=0
  205379.7660  0.0042 -6.2144 3  527.3024131  71510 30365 957      66 660        syn-C2H3C(O)NH2, v=0
  205448.2324  0.0011 -5.6592 3  160.4144 57  71510 303281711      271710        syn-C2H3C(O)NH2, v=0
  205448.2324  0.0011 -5.6592 3  160.4144 57  71510 303281712      271711        syn-C2H3C(O)NH2, v=0
  205494.6422  0.0653 -6.6906 3 1587.2188201  71510 303A03961      994060        syn-C2H3C(O)NH2, v=0
  205494.6422  0.0653 -6.6906 3 1587.2188201  71510 303A03962      994059        syn-C2H3C(O)NH2, v=0
  205567.8557  0.0028 -4.2334 3  130.8676 71  71510 30335 134      35 035        syn-C2H3C(O)NH2, v=0
  205567.8558  0.0028 -4.2334 3  130.8676 71  71510 30335 234      35 135        syn-C2H3C(O)NH2, v=0
  205658.2051  0.0097 -5.2603 3  622.2220135  71510 303671652      661749        syn-C2H3C(O)NH2, v=0
  205661.3374  0.0052 -5.8118 3   35.8400 35  71510 30317 413      17 116        syn-C2H3C(O)NH2, v=0
  205665.6688  0.0608 -5.2865 3 1335.4387195  71510 303972671      972572        syn-C2H3C(O)NH2, v=0
  205677.1755  0.0228 -6.1268 3  731.4975103  71510 3035142 9      524112        syn-C2H3C(O)NH2, v=0
  205677.1755  0.0228 -6.1268 3  731.4975103  71510 303514210      524111        syn-C2H3C(O)NH2, v=0
  205705.9519  0.0011 -5.6140 3  152.6708 57  71510 303281612      271611        syn-C2H3C(O)NH2, v=0
  205705.9519  0.0011 -5.6140 3  152.6708 57  71510 303281613      271612        syn-C2H3C(O)NH2, v=0
  205735.9229  0.0015 -3.7439 3  397.0187109  71510 303541243      541144        syn-C2H3C(O)NH2, v=0
  205766.3502  0.0027 -6.1475 3  308.2071 91  71510 303451629      461334        syn-C2H3C(O)NH2, v=0
  205831.7224  0.0869 -6.7693 3 1233.6771141  71510 303705218      715121        syn-C2H3C(O)NH2, v=0
  205831.7224  0.0869 -6.7693 3 1233.6771141  71510 303705219      715120        syn-C2H3C(O)NH2, v=0
  205839.1071  0.0023 -5.6932 3   34.0870 31  71510 30315 7 8      15 411        syn-C2H3C(O)NH2, v=0
  205847.9599  0.0029 -3.9026 3  150.0866 67  71510 30333 825      32 924        syn-C2H3C(O)NH2, v=0
  205867.0369  0.0200 -4.0233 3  619.2370133 -71510 303661849      661750        syn-C2H3C(O)NH2, v=0
  205894.0566  0.0093 -6.5253 3  510.6102121  71510 303601644      611349        syn-C2H3C(O)NH2, v=0
  205894.0830  0.0012 -5.7058 3   12.4921 21  71510 30310 5 6       9 2 7        syn-C2H3C(O)NH2, v=0
  206004.5327  0.0031 -4.7846 3   22.0932 29  71510 30314 311      13 212        syn-C2H3C(O)NH2, v=0
  206017.0664  0.0010 -5.5728 3  145.4108 57  71510 303281514      271513        syn-C2H3C(O)NH2, v=0
  206017.0665  0.0010 -5.5728 3  145.4108 57  71510 303281513      271512        syn-C2H3C(O)NH2, v=0
  206107.8595  0.0743 -6.8233 3 1655.0772205  71510 303A24062      A14161        syn-C2H3C(O)NH2, v=0
  206107.8595  0.0743 -6.8233 3 1655.0772205  71510 303A24063      A14160        syn-C2H3C(O)NH2, v=0
  206109.0578  0.0200 -3.5852 3  286.0157 87 -71510 303431627      431528        syn-C2H3C(O)NH2, v=0
  206112.6547  0.0030 -6.1884 3  247.7196 81  71510 303401526      411229        syn-C2H3C(O)NH2, v=0
  206167.3750  0.0200 -3.5850 3  286.0135 87 -71510 303431628      431529        syn-C2H3C(O)NH2, v=0
  206217.9812  0.0200 -3.9192 3  553.6103125 -71510 303621845      621746        syn-C2H3C(O)NH2, v=0
  206232.9391  0.0046 -6.3001 3  471.3954113  71510 303561938      571641        syn-C2H3C(O)NH2, v=0
  206252.6815  0.0318 -6.8247 3  995.1006177  71510 303881375      891278        syn-C2H3C(O)NH2, v=0
  206252.6823  0.0318 -6.8247 3  995.1006177  71510 303881475      891178        syn-C2H3C(O)NH2, v=0
  206360.0677  0.0200 -3.7232 3  414.5363107 -71510 303531737      531638        syn-C2H3C(O)NH2, v=0
  206367.1408  0.0196 -6.1022 3  687.4070 99  71510 3034941 8      504011        syn-C2H3C(O)NH2, v=0
  206367.1408  0.0196 -6.1022 3  687.4070 99  71510 3034941 9      504010        syn-C2H3C(O)NH2, v=0
  206374.1171  0.0200 -3.7600 3  192.4204 81 -71510 30340 436      40 337        syn-C2H3C(O)NH2, v=0
  206374.1171  0.0200 -3.7600 3  192.4204 81 -71510 30340 536      40 437        syn-C2H3C(O)NH2, v=0
  206399.1594  0.0010 -5.5351 3  138.6379 57  71510 303281415      271414        syn-C2H3C(O)NH2, v=0
  206399.1620  0.0010 -5.5351 3  138.6379 57  71510 303281414      271413        syn-C2H3C(O)NH2, v=0
  206428.8081  0.0037 -4.7536 3   79.4475 49  71510 30324 717      24 420        syn-C2H3C(O)NH2, v=0
  206483.0460  0.0022 -4.3258 3  343.7398 99  71510 303491435      481534        syn-C2H3C(O)NH2, v=0
  206489.2716  0.0190 -6.8051 3  870.2768155  71510 303772453      782158        syn-C2H3C(O)NH2, v=0
  206604.1396  0.0773 -6.6787 3 1175.7627137  71510 303685117      695020        syn-C2H3C(O)NH2, v=0
  206604.1396  0.0773 -6.6787 3 1175.7627137  71510 303685118      695019        syn-C2H3C(O)NH2, v=0
  206651.7211  0.0032 -6.6153 3   89.2012 47  71510 303231113      24 816        syn-C2H3C(O)NH2, v=0
  206719.5038  0.0031 -5.8867 3   28.5619 31  71510 30315 511      15 214        syn-C2H3C(O)NH2, v=0
  206728.5007  0.0119 -4.3194 3  787.8476151  71510 303751857      751758        syn-C2H3C(O)NH2, v=0
  206760.0912  0.0040 -6.1820 3  325.0824105  71510 30352 547      53 450        syn-C2H3C(O)NH2, v=0
  206760.0920  0.0040 -6.1820 3  325.0824105  71510 30352 647      53 350        syn-C2H3C(O)NH2, v=0
  206862.1330  0.0074 -6.5315 3  202.5323 77  71510 303381028      39 733        syn-C2H3C(O)NH2, v=0
  206878.2797  0.0010 -5.5005 3  132.3572 57  71510 303281316      271315        syn-C2H3C(O)NH2, v=0
  206878.3406  0.0010 -5.5005 3  132.3572 57  71510 303281315      271314        syn-C2H3C(O)NH2, v=0
  207045.1470  0.0078 -4.3038 3  785.6662149  71510 303742153      742054        syn-C2H3C(O)NH2, v=0
  207047.2978  0.0167 -6.0896 3  644.7523 95  71510 3034740 7      483910        syn-C2H3C(O)NH2, v=0
  207047.2978  0.0167 -6.0896 3  644.7523 95  71510 3034740 8      4839 9        syn-C2H3C(O)NH2, v=0
  207097.0090  0.0200 -3.7129 3  364.1066105 -71510 303521042      52 943        syn-C2H3C(O)NH2, v=0
  207098.4547  0.0031 -6.1828 3  296.9400 89  71510 303441629      451332        syn-C2H3C(O)NH2, v=0
  207116.2920  0.0040 -6.2408 3  408.7799105  71510 303521835      531538        syn-C2H3C(O)NH2, v=0
  207151.8286  0.0200 -3.7053 3  401.2011105 -71510 303521735      521636        syn-C2H3C(O)NH2, v=0
  207274.2549  0.0200 -3.4760 3  101.7066 57 -71510 30328 623      27 522        syn-C2H3C(O)NH2, v=0
  207368.1799  0.0685 -6.5934 3 1119.2748133  71510 303665016      674919        syn-C2H3C(O)NH2, v=0
  207368.1799  0.0685 -6.5934 3 1119.2748133  71510 303665017      674918        syn-C2H3C(O)NH2, v=0
  207376.9823  0.0030 -6.1681 3  362.8668 99  71510 303491732      501437        syn-C2H3C(O)NH2, v=0
  207387.7020  0.0014 -4.6956 3   82.2835 49  71510 30324 816      24 519        syn-C2H3C(O)NH2, v=0
  207399.6335  0.0200 -3.6276 3   37.9871 33 -71510 30316 710      15 6 9        syn-C2H3C(O)NH2, v=0
  207417.9256  0.0034 -6.2010 3  350.6274 97  71510 303481732      491435        syn-C2H3C(O)NH2, v=0
  207447.7107  0.0200 -3.5734 3  275.2766 85 -71510 303421626      421527        syn-C2H3C(O)NH2, v=0
  207477.6291  0.0200 -3.5733 3  275.2755 85 -71510 303421627      421528        syn-C2H3C(O)NH2, v=0
  207494.7094  0.0010 -5.4686 3  126.5763 57  71510 303281217      271216        syn-C2H3C(O)NH2, v=0
  207495.8561  0.0010 -5.4686 3  126.5763 57  71510 303281216      271215        syn-C2H3C(O)NH2, v=0
  207506.2117  0.0679 -5.0227 3 1191.1944185  71510 303922369      922270        syn-C2H3C(O)NH2, v=0
  207536.8834  0.0200 -3.4431 3   30.0924 21 -71510 3031010 0       9 9 1        syn-C2H3C(O)NH2, v=0
  207536.8834  0.0200 -3.4431 3   30.0924 21 -71510 3031010 1       9 9 0        syn-C2H3C(O)NH2, v=0
  207580.5149  0.0021 -5.6866 3   31.0426 31  71510 30315 610      15 313        syn-C2H3C(O)NH2, v=0
  207603.2731  0.0200 -3.7109 3  364.1086105 -71510 303521142      521043        syn-C2H3C(O)NH2, v=0
  207671.4997  0.0200 -4.4423 3  421.4197109 -71510 303541638      531737        syn-C2H3C(O)NH2, v=0
  207691.3363  0.0028 -4.1466 3  237.0241 83  71510 303411130      401229        syn-C2H3C(O)NH2, v=0
  207717.4114  0.0143 -6.0916 3  603.5340 91  71510 3034539 6      4638 9        syn-C2H3C(O)NH2, v=0
  207717.4114  0.0143 -6.0916 3  603.5340 91  71510 3034539 7      4638 8        syn-C2H3C(O)NH2, v=0
  207721.8307  0.0123 -6.6684 3  784.4410147  71510 303732350      742055        syn-C2H3C(O)NH2, v=0
  207767.5664  0.0200 -3.8339 3  480.9380119 -71510 303591446      591347        syn-C2H3C(O)NH2, v=0
  207787.7747  0.0083 -6.7744 3  132.9663 63  71510 30331 823      32 528        syn-C2H3C(O)NH2, v=0
  207827.5589  0.0134 -6.5216 3  794.3236159  71510 303791168      801071        syn-C2H3C(O)NH2, v=0
  207827.5599  0.0134 -6.5216 3  794.3236159  71510 303791268      80 971        syn-C2H3C(O)NH2, v=0
  207864.5551  0.0016 -6.8064 3  217.9034 85  71510 30342 537      42 538        syn-C2H3C(O)NH2, v=0
  207864.5843  0.0016 -3.7103 3  217.9034 85  71510 30342 537      42 438        syn-C2H3C(O)NH2, v=0
  207865.1907  0.0016 -3.7103 3  217.9034 85  71510 30342 637      42 538        syn-C2H3C(O)NH2, v=0
  207865.2199  0.0016 -6.8063 3  217.9034 85  71510 30342 637      42 438        syn-C2H3C(O)NH2, v=0
  207873.0357  0.0200 -3.8903 3  537.8347123 -71510 303611844      611745        syn-C2H3C(O)NH2, v=0
  207880.0748  0.0012 -5.3831 3  102.1594 55  71510 30327 819      26 818        syn-C2H3C(O)NH2, v=0
  207887.2100  0.0022 -4.0449 3  636.2359135  71510 303671850      671751        syn-C2H3C(O)NH2, v=0
  207934.5289  0.0019 -3.7951 3  445.0205115  71510 303571245      571146        syn-C2H3C(O)NH2, v=0
  207948.3068  0.0200 -3.4952 3   31.2042 25 -71510 30312 9 4      11 8 3        syn-C2H3C(O)NH2, v=0
  207948.3068  0.0200 -3.4952 3   31.2042 25 -71510 30312 9 3      11 8 4        syn-C2H3C(O)NH2, v=0
  207991.5359  0.0069 -5.0157 3  533.5122125  71510 303621548      611645        syn-C2H3C(O)NH2, v=0
  208105.5463  0.0200 -3.6254 3   37.9667 33 -71510 30316 7 9      15 610        syn-C2H3C(O)NH2, v=0
  208123.7293  0.0605 -6.5135 3 1064.2146129  71510 303644915      654818        syn-C2H3C(O)NH2, v=0
  208123.7293  0.0605 -6.5135 3 1064.2146129  71510 303644916      654817        syn-C2H3C(O)NH2, v=0
  208198.5159  0.0200 -3.5506 3   33.8094 29 -71510 30314 8 7      13 7 6        syn-C2H3C(O)NH2, v=0
  208203.7796  0.0200 -3.5506 3   33.8092 29 -71510 30314 8 6      13 7 7        syn-C2H3C(O)NH2, v=0
  208226.0425  0.0200 -3.9817 3  593.2290129 -71510 303641945      641846        syn-C2H3C(O)NH2, v=0
  208238.5037  0.0200 -3.4490 3  108.6205 59 -71510 30329 524      28 623        syn-C2H3C(O)NH2, v=0
  208238.8636  0.0038 -6.1721 3  459.2621123  71510 30361 754      62 657        syn-C2H3C(O)NH2, v=0
  208238.8646  0.0038 -6.1721 3  459.2621123  71510 30361 854      62 557        syn-C2H3C(O)NH2, v=0
  208239.4124  0.0025 -3.9692 3  153.0853 75  71510 30337 235      37 136        syn-C2H3C(O)NH2, v=0
  208239.4133  0.0025 -3.9692 3  153.0853 75  71510 30337 335      37 236        syn-C2H3C(O)NH2, v=0
  208267.4471  0.0016 -4.3817 3  368.8632103  71510 303511438      501535        syn-C2H3C(O)NH2, v=0
  208310.5197  0.0010 -5.4389 3  121.3069 57  71510 303281118      271117        syn-C2H3C(O)NH2, v=0
  208327.4549  0.0010 -5.4389 3  121.3074 57  71510 303281117      271116        syn-C2H3C(O)NH2, v=0
  208377.2300  0.0121 -6.1117 3  563.7531 87  71510 3034338 5      4437 8        syn-C2H3C(O)NH2, v=0
  208377.2300  0.0121 -6.1117 3  563.7531 87  71510 3034338 6      4437 7        syn-C2H3C(O)NH2, v=0
  208421.0474  0.0015 -4.6258 3   88.5795 51  71510 30325 817      25 520        syn-C2H3C(O)NH2, v=0
  208480.9407  0.0009 -5.3637 3  105.2881 57  71510 30328 722      27 721        syn-C2H3C(O)NH2, v=0
  208487.8224  0.0033 -6.2090 3  421.9889107  71510 303531835      541540        syn-C2H3C(O)NH2, v=0
  208533.2738  0.0057 -6.2982 3  615.6933141  71510 30370 961      71 864        syn-C2H3C(O)NH2, v=0
  208533.2748  0.0057 -6.2982 3  615.6933141  71510 303701061      71 764        syn-C2H3C(O)NH2, v=0
  208538.8318  0.0200 -3.6997 3  401.1482105 -71510 303521736      521637        syn-C2H3C(O)NH2, v=0
  208552.9736  0.0046 -6.2693 3  271.5820 97  71510 30348 444      49 347        syn-C2H3C(O)NH2, v=0
  208552.9740  0.0046 -6.2693 3  271.5820 97  71510 30348 544      49 247        syn-C2H3C(O)NH2, v=0
  208624.9436  0.0079 -6.5457 3  703.0488139  71510 303692247      701952        syn-C2H3C(O)NH2, v=0
  208662.0190  0.0200 -3.5632 3  264.8036 83 -71510 303411625      411526        syn-C2H3C(O)NH2, v=0
  208677.0156  0.0200 -3.5631 3  264.8030 83 -71510 303411626      411527        syn-C2H3C(O)NH2, v=0
  208685.1855  0.0200 -3.6877 3  332.4028101 -71510 30350 941      50 842        syn-C2H3C(O)NH2, v=0
  208844.6422  0.0040 -4.1302 3  685.9921139  71510 303692049      691950        syn-C2H3C(O)NH2, v=0
  208846.4698  0.0200 -3.6870 3  332.4033101 -71510 303501041      50 942        syn-C2H3C(O)NH2, v=0
  208870.6644  0.0533 -6.4395 3 1010.5830125  71510 303624814      634717        syn-C2H3C(O)NH2, v=0
  208870.6644  0.0533 -6.4395 3 1010.5830125  71510 303624815      634716        syn-C2H3C(O)NH2, v=0
  208886.7734  0.0009 -5.3560 3   97.6203 55  71510 30327 621      26 620        syn-C2H3C(O)NH2, v=0
  208902.0862  0.0014 -6.7953 3  244.6548 89  71510 30344 638      44 639        syn-C2H3C(O)NH2, v=0
  208902.2496  0.0200 -3.6825 3  244.6548 89 -71510 30344 638      44 539        syn-C2H3C(O)NH2, v=0
  208905.1601  0.0200 -3.6825 3  244.6548 89 -71510 30344 738      44 639        syn-C2H3C(O)NH2, v=0
  208905.3478  0.0014 -6.7952 3  244.6548 89  71510 30344 738      44 539        syn-C2H3C(O)NH2, v=0
  208945.4801  0.0037 -6.4467 3   22.6160 29  71510 30314 411      14 114        syn-C2H3C(O)NH2, v=0
  208966.1619  0.0064 -5.1333 3  804.9658147  71510 303732549      722646        syn-C2H3C(O)NH2, v=0
  208967.4974  0.0064 -5.1333 3  804.9658147  71510 303732548      722647        syn-C2H3C(O)NH2, v=0
  208994.8954  0.0028 -6.2621 3  162.4498 65  71510 303321319      331024        syn-C2H3C(O)NH2, v=0
  208996.0219  0.0050 -5.0437 3  758.0823143  71510 303712448      702545        syn-C2H3C(O)NH2, v=0
  208999.8469  0.0050 -5.0436 3  758.0822143  71510 303712447      702546        syn-C2H3C(O)NH2, v=0
  209026.0117  0.0080 -5.2258 3  853.2884151  71510 303752650      742747        syn-C2H3C(O)NH2, v=0
  209026.4715  0.0080 -5.2258 3  853.2884151  71510 303752649      742748        syn-C2H3C(O)NH2, v=0
  209026.4844  0.0103 -6.1550 3  525.4101 83  71510 3034137 4      4236 7        syn-C2H3C(O)NH2, v=0
  209026.4844  0.0103 -6.1550 3  525.4101 83  71510 3034137 5      4236 6        syn-C2H3C(O)NH2, v=0
  209056.8906  0.0200 -3.1276 3  116.1985 67 -71510 30333 132      32 231        syn-C2H3C(O)NH2, v=0
  209056.8779  0.0009 -5.2893 3  116.1985 67  71510 30333 232      32 231        syn-C2H3C(O)NH2, v=0
  209056.8783  0.0009 -5.2893 3  116.1985 67  71510 30333 132      32 131        syn-C2H3C(O)NH2, v=0
  209056.8906  0.0200 -3.1276 3  116.1985 67 -71510 30333 232      32 131        syn-C2H3C(O)NH2, v=0
  209061.1214  0.0009 -5.2724 3  116.7185 69  71510 30334 034      33 033        syn-C2H3C(O)NH2, v=0
  209061.1335  0.0200 -3.0782 3  116.7185 69 -71510 30334 034      33 133        syn-C2H3C(O)NH2, v=0
  209061.1335  0.0200 -3.0782 3  116.7185 69 -71510 30334 134      33 033        syn-C2H3C(O)NH2, v=0
  209061.1214  0.0009 -5.2724 3  116.7185 69  71510 30334 134      33 133        syn-C2H3C(O)NH2, v=0
  209078.0213  0.0200 -3.1833 3  115.1582 65 -71510 30332 230      31 329        syn-C2H3C(O)NH2, v=0
  209077.9915  0.0009 -5.3054 3  115.1582 65  71510 30332 330      31 329        syn-C2H3C(O)NH2, v=0
  209078.0260  0.0009 -5.3054 3  115.1582 65  71510 30332 230      31 229        syn-C2H3C(O)NH2, v=0
  209078.0213  0.0200 -3.1833 3  115.1582 65 -71510 30332 330      31 229        syn-C2H3C(O)NH2, v=0
  209101.7354  0.0200 -4.0090 3  612.2622133 -71510 303661750      661651        syn-C2H3C(O)NH2, v=0
  209132.0670  0.0039 -4.9569 3  712.6392139  71510 303692347      682444        syn-C2H3C(O)NH2, v=0
  209136.7775  0.0037 -6.2684 3  485.5710115  71510 303571938      581643        syn-C2H3C(O)NH2, v=0
  209142.8518  0.0039 -4.9569 3  712.6392139  71510 303692346      682445        syn-C2H3C(O)NH2, v=0
  209162.1173  0.0099 -5.3212 3  903.0489155  71510 303772751      762848        syn-C2H3C(O)NH2, v=0
  209162.2114  0.0200 -3.2485 3  113.5744 63 -71510 30331 328      30 427        syn-C2H3C(O)NH2, v=0
  209162.2735  0.0099 -5.3212 3  903.0489155  71510 303772750      762849        syn-C2H3C(O)NH2, v=0
  209164.1517  0.0009 -5.3204 3  113.5744 63  71510 30331 428      30 427        syn-C2H3C(O)NH2, v=0
  209165.9551  0.0009 -5.3204 3  113.5743 63  71510 30331 328      30 327        syn-C2H3C(O)NH2, v=0
  209167.9091  0.0200 -3.2485 3  113.5743 63 -71510 30331 428      30 327        syn-C2H3C(O)NH2, v=0
  209169.2573  0.0710 -5.7491 3 1590.3561213  71510 303A62878      A62779        syn-C2H3C(O)NH2, v=0
  209177.7384  0.0055 -6.4377 3  626.1040131  71510 303652144      661849        syn-C2H3C(O)NH2, v=0
  209233.0387  0.0030 -6.6065 3   89.1151 47  71510 303231112      24 817        syn-C2H3C(O)NH2, v=0
  209317.9683  0.0200 -3.3295 3  111.4100 61 -71510 30330 426      29 525        syn-C2H3C(O)NH2, v=0
  209357.0045  0.0043 -6.3450 3  553.6103123  71510 303612041      621746        syn-C2H3C(O)NH2, v=0
  209363.5751  0.0122 -5.4196 3  954.2458159  71510 303792852      782949        syn-C2H3C(O)NH2, v=0
  209363.6276  0.0122 -5.4196 3  954.2458159  71510 303792851      782950        syn-C2H3C(O)NH2, v=0
  209367.2705  0.0200 -3.7440 3  130.5079 63 -71510 30331 724      30 823        syn-C2H3C(O)NH2, v=0
  209385.5012  0.0009 -5.3339 3  111.4100 61  71510 30330 526      29 525        syn-C2H3C(O)NH2, v=0
  209387.5070  0.0010 -5.4111 3  116.5668 57  71510 303281019      271018        syn-C2H3C(O)NH2, v=0
  209393.8602  0.0031 -4.8730 3  668.6381135  71510 303672246      662343        syn-C2H3C(O)NH2, v=0
  209402.0298  0.0200 -3.6735 3  301.9169 97 -71510 30348 840      48 741        syn-C2H3C(O)NH2, v=0
  209423.7391  0.0031 -4.8729 3  668.6381135  71510 303672245      662344        syn-C2H3C(O)NH2, v=0
  209437.0935  0.0013 -6.8015 3  272.6634 93  71510 30346 739      46 740        syn-C2H3C(O)NH2, v=0
  209438.0300  0.0200 -3.6713 3  272.6634 93 -71510 30346 739      46 640        syn-C2H3C(O)NH2, v=0
  209440.3994  0.0009 -5.3336 3  111.4059 61  71510 30330 426      29 425        syn-C2H3C(O)NH2, v=0
  209448.9197  0.0012 -3.6734 3  301.9171 97  71510 30348 940      48 841        syn-C2H3C(O)NH2, v=0
  209450.3285  0.0013 -3.6712 3  272.6634 93  71510 30346 839      46 740        syn-C2H3C(O)NH2, v=0
  209451.2149  0.0013 -6.8015 3  272.6634 93  71510 30346 839      46 640        syn-C2H3C(O)NH2, v=0
  209507.9365  0.0200 -3.3287 3  111.4059 61 -71510 30330 526      29 425        syn-C2H3C(O)NH2, v=0
  209515.8273  0.0018 -4.7967 3   76.1694 47  71510 30323 815      23 518        syn-C2H3C(O)NH2, v=0
  209576.6875  0.0010 -5.4103 3  116.5731 57  71510 303281018      271017        syn-C2H3C(O)NH2, v=0
  209608.8519  0.0468 -6.3717 3  958.3810121  71510 303604713      614616        syn-C2H3C(O)NH2, v=0
  209608.8519  0.0468 -6.3717 3  958.3810121  71510 303604714      614615        syn-C2H3C(O)NH2, v=0
  209621.5261  0.0148 -5.5209 3 1006.8781163  71510 303812953      803050        syn-C2H3C(O)NH2, v=0
  209621.5436  0.0148 -5.5209 3 1006.8781163  71510 303812952      803051        syn-C2H3C(O)NH2, v=0
  209643.6097  0.0009 -5.3459 3  108.6205 59  71510 30329 624      28 623        syn-C2H3C(O)NH2, v=0
  209664.8875  0.0088 -6.2304 3  488.5057 79  71510 3033936 3      4035 6        syn-C2H3C(O)NH2, v=0
  209664.8875  0.0088 -6.2304 3  488.5057 79  71510 3033936 4      4035 5        syn-C2H3C(O)NH2, v=0
  209766.3793  0.0200 -3.5543 3  254.5951 81 -71510 303401624      401525        syn-C2H3C(O)NH2, v=0
  209773.6920  0.0200 -3.5543 3  254.5948 81 -71510 303401625      401526        syn-C2H3C(O)NH2, v=0
  209780.5102  0.0073 -6.4316 3  339.3697 99  71510 303491336      501041        syn-C2H3C(O)NH2, v=0
  209786.3566  0.1052 -5.3606 3 1380.3908199  71510 303992574      992475        syn-C2H3C(O)NH2, v=0
  209802.6942  0.0200 -4.7920 3  626.0806131 -71510 303652145      642242        syn-C2H3C(O)NH2, v=0
  209809.5112  0.0200 -3.9505 3  572.2407129 -71510 303641649      641550        syn-C2H3C(O)NH2, v=0
  209813.9705  0.0200 -3.6807 3  388.0657103 -71510 303511734      511635        syn-C2H3C(O)NH2, v=0
  209838.5195  0.0024 -4.0575 3   37.1529 35  71510 30317 512      16 413        syn-C2H3C(O)NH2, v=0
  209854.3224  0.0050 -5.0372 3   64.9981 45  71510 30322 616      22 319        syn-C2H3C(O)NH2, v=0
  209882.5074  0.0013 -3.8612 3  522.3245121  71510 303601843      601744        syn-C2H3C(O)NH2, v=0
  209883.8556  0.0025 -4.7916 3  626.0805131  71510 303652144      642243        syn-C2H3C(O)NH2, v=0
  209908.6387  0.0053 -6.4463 3  222.6061 89  71510 30344 341      45 244        syn-C2H3C(O)NH2, v=0
  209908.6390  0.0053 -6.4463 3  222.6061 89  71510 30344 441      45 144        syn-C2H3C(O)NH2, v=0
  209927.6115  0.0226 -4.6387 3  983.7030167  71510 303832360      832261        syn-C2H3C(O)NH2, v=0
  209928.7236  0.0178 -5.6251 3 1060.9445167  71510 303833054      823151        syn-C2H3C(O)NH2, v=0
  209928.7293  0.0178 -5.6251 3 1060.9445167  71510 303833053      823152        syn-C2H3C(O)NH2, v=0
  210053.5795  0.0018 -4.8799 3   19.1397 27  71510 30313 410      12 111        syn-C2H3C(O)NH2, v=0
  210119.1753  0.0200 -3.8209 3  492.2879117 -71510 303581840      581741        syn-C2H3C(O)NH2, v=0
  210279.1909  0.0213 -5.7323 3 1116.4438171  71510 303853155      843252        syn-C2H3C(O)NH2, v=0
  210279.1928  0.0213 -5.7323 3 1116.4438171  71510 303853154      843253        syn-C2H3C(O)NH2, v=0
  210292.1342  0.0076 -6.3536 3  453.0406 75  71510 3033735 2      3834 5        syn-C2H3C(O)NH2, v=0
  210292.1342  0.0076 -6.3536 3  453.0406 75  71510 3033735 3      3834 4        syn-C2H3C(O)NH2, v=0
  210332.2464  0.0012 -5.4201 3   15.0568 23  71510 30311 5 7      10 2 8        syn-C2H3C(O)NH2, v=0
  210338.1481  0.0410 -6.3105 3  907.6098117  71510 303584612      594515        syn-C2H3C(O)NH2, v=0
  210338.1481  0.0410 -6.3105 3  907.6098117  71510 303584613      594514        syn-C2H3C(O)NH2, v=0
  210369.4150  0.0219 -6.6747 3  901.6111169  71510 303841272      851175        syn-C2H3C(O)NH2, v=0
  210369.4157  0.0219 -6.6747 3  901.6111169  71510 303841372      851075        syn-C2H3C(O)NH2, v=0
  210376.3927  0.0021 -4.7138 3  584.9685127  71510 303632044      622141        syn-C2H3C(O)NH2, v=0
  210386.1831  0.0200 -3.7853 3  445.0329115 -71510 303571345      571246        syn-C2H3C(O)NH2, v=0
  210402.5280  0.0076 -4.2020 3  724.2444145  71510 303721755      721656        syn-C2H3C(O)NH2, v=0
  210553.7415  0.0010 -5.3858 3  112.3721 57  71510 30328 920      27 919        syn-C2H3C(O)NH2, v=0
  210559.3152  0.0200 -3.8338 3  176.6045 79 -71510 30339 336      39 237        syn-C2H3C(O)NH2, v=0
  210559.3152  0.0200 -3.8338 3  176.6045 79 -71510 30339 436      39 337        syn-C2H3C(O)NH2, v=0
  210567.5527  0.0009 -5.3417 3  108.5428 59  71510 30329 524      28 523        syn-C2H3C(O)NH2, v=0
  210591.8866  0.0021 -4.7129 3  584.9680127  71510 303632043      622142        syn-C2H3C(O)NH2, v=0
  210602.1860  0.1191 -5.9062 3 1675.4780219  71510 303A92881      A92782        syn-C2H3C(O)NH2, v=0
  210624.7017  0.0200 -3.6775 3  388.0351103 -71510 303511735      511636        syn-C2H3C(O)NH2, v=0
  210667.9585  0.0252 -5.8425 3 1173.3747175  71510 303873256      863353        syn-C2H3C(O)NH2, v=0
  210667.9591  0.0252 -5.8425 3 1173.3747175  71510 303873255      863354        syn-C2H3C(O)NH2, v=0
  210729.4256  0.0497 -5.0316 3 1204.0774185  71510 303922567      922468        syn-C2H3C(O)NH2, v=0
  210755.8878  0.0038 -6.1615 3  395.7256115  71510 30357 651      58 554        syn-C2H3C(O)NH2, v=0
  210755.8884  0.0038 -6.1615 3  395.7256115  71510 30357 751      58 454        syn-C2H3C(O)NH2, v=0
  210765.6806  0.0200 -3.8523 3  495.6538121 -71510 303601347      601248        syn-C2H3C(O)NH2, v=0
  210772.3128  0.0200 -3.5470 3  244.6495 79 -71510 303391623      391524        syn-C2H3C(O)NH2, v=0
  210775.7746  0.0200 -3.5469 3  244.6494 79 -71510 303391624      391525        syn-C2H3C(O)NH2, v=0
  210783.9410  0.0009 -5.3676 3  108.6824 57  71510 30328 821      27 820        syn-C2H3C(O)NH2, v=0
  210849.0262  0.0200 -4.0646 3  653.4558137 -71510 303681851      681752        syn-C2H3C(O)NH2, v=0
  210907.9010  0.0066 -6.5578 3  419.0153 71  71510 3033534 1      3633 4        syn-C2H3C(O)NH2, v=0
  210907.9010  0.0066 -6.5578 3  419.0153 71  71510 3033534 2      3633 3        syn-C2H3C(O)NH2, v=0
  211058.3981  0.0357 -6.2568 3  858.2701113  71510 303564511      574414        syn-C2H3C(O)NH2, v=0
  211058.3981  0.0357 -6.2568 3  858.2701113  71510 303564512      574413        syn-C2H3C(O)NH2, v=0
  211090.8617  0.0296 -5.9557 3 1231.7360179  71510 303893357      883454        syn-C2H3C(O)NH2, v=0
  211090.8619  0.0296 -5.9557 3 1231.7360179  71510 303893356      883455        syn-C2H3C(O)NH2, v=0
  211104.3522  0.0369 -6.0266 3 1740.7387223  71510 303B12982      B12883        syn-C2H3C(O)NH2, v=0
  211114.7656  0.0019 -4.6388 3  545.3038123  71510 303611943      602040        syn-C2H3C(O)NH2, v=0
  211213.1795  0.0049 -6.4479 3   25.7496 31  71510 30315 312      15 015        syn-C2H3C(O)NH2, v=0
  211226.0447  0.0278 -4.5721 3  943.6105165  71510 303822062      821963        syn-C2H3C(O)NH2, v=0
  211260.7988  0.0013 -6.4906 3    7.6449 17  71510 303 8 5 3       7 2 6        syn-C2H3C(O)NH2, v=0
  211479.0787  0.0089 -6.4081 3  710.7930151  71510 303751065      76 968        syn-C2H3C(O)NH2, v=0
  211479.0794  0.0089 -6.4081 3  710.7930151  71510 303751165      76 868        syn-C2H3C(O)NH2, v=0
  211529.5917  0.0016 -6.5248 3  270.9048 59  71510 3032927 2      2827 1        syn-C2H3C(O)NH2, v=0
  211529.5917  0.0016 -6.5248 3  270.9048 59  71510 3032927 3      2827 2        syn-C2H3C(O)NH2, v=0
  211544.3851  0.0346 -6.0718 3 1291.5266183  71510 303913457      903556        syn-C2H3C(O)NH2, v=0
  211544.3851  0.0346 -6.0718 3 1291.5266183  71510 303913458      903555        syn-C2H3C(O)NH2, v=0
  211608.9418  0.0015 -6.3302 3  258.4046 59  71510 3032926 3      2826 2        syn-C2H3C(O)NH2, v=0
  211608.9418  0.0015 -6.3302 3  258.4046 59  71510 3032926 4      2826 3        syn-C2H3C(O)NH2, v=0
  211617.9167  0.0028 -4.2237 3  138.2452 73  71510 30336 135      36 036        syn-C2H3C(O)NH2, v=0
  211617.9168  0.0028 -4.2237 3  138.2452 73  71510 30336 235      36 136        syn-C2H3C(O)NH2, v=0
  211627.2670  0.0804 -5.4745 3 1446.7138203  71510 303A12774      A12675        syn-C2H3C(O)NH2, v=0
  211658.8931  0.0044 -6.2285 3  542.1471133  71510 30366 858      67 761        syn-C2H3C(O)NH2, v=0
  211658.8938  0.0044 -6.2285 3  542.1471133  71510 30366 958      67 661        syn-C2H3C(O)NH2, v=0
  211672.1620  0.0019 -4.6364 3  545.3027123  71510 303611942      602041        syn-C2H3C(O)NH2, v=0
  211689.2700  0.0200 -3.5411 3  234.9656 77 -71510 303381622      381523        syn-C2H3C(O)NH2, v=0
  211690.8704  0.0200 -3.5410 3  234.9656 77 -71510 303381623      381524        syn-C2H3C(O)NH2, v=0
  211695.8079  0.0014 -6.1878 3  246.3776 59  71510 3032925 4      2825 3        syn-C2H3C(O)NH2, v=0
  211695.8079  0.0014 -6.1878 3  246.3776 59  71510 3032925 5      2825 4        syn-C2H3C(O)NH2, v=0
  211769.4349  0.0310 -6.2111 3  810.3630109  71510 303544410      554313        syn-C2H3C(O)NH2, v=0
  211769.4349  0.0310 -6.2111 3  810.3630109  71510 303544411      554312        syn-C2H3C(O)NH2, v=0
  211780.5375  0.0200 -3.7471 3  410.3035111 -71510 303551144      551045        syn-C2H3C(O)NH2, v=0
  211791.5759  0.0014 -6.0746 3  234.8243 59  71510 3032924 5      2824 4        syn-C2H3C(O)NH2, v=0
  211791.5759  0.0014 -6.0746 3  234.8243 59  71510 3032924 6      2824 5        syn-C2H3C(O)NH2, v=0
  211897.9469  0.0013 -5.9802 3  223.7450 59  71510 3032923 6      2823 5        syn-C2H3C(O)NH2, v=0
  211897.9469  0.0013 -5.9802 3  223.7450 59  71510 3032923 7      2823 6        syn-C2H3C(O)NH2, v=0
  211912.9978  0.0032 -6.4354 3  119.5077 55  71510 303271216      28 919        syn-C2H3C(O)NH2, v=0
  211915.3022  0.0747 -6.0805 3 1770.1648225  71510 303B22983      B22884        syn-C2H3C(O)NH2, v=0
  211965.7491  0.0018 -4.5674 3  507.0894119  71510 303591842      581939        syn-C2H3C(O)NH2, v=0
  211972.6939  0.0200 -3.4323 3  108.5428 59 -71510 30329 624      28 523        syn-C2H3C(O)NH2, v=0
  211977.1157  0.0028 -5.2623 3   16.9551 27  71510 30313 211      12 112        syn-C2H3C(O)NH2, v=0
  211982.5673  0.0110 -6.6028 3  580.6554129  71510 303641747      651452        syn-C2H3C(O)NH2, v=0
  212003.5440  0.0200 -3.8921 3  533.3784125 -71510 303621548      621449        syn-C2H3C(O)NH2, v=0
  212017.0278  0.0013 -5.8991 3  213.1405 59  71510 3032922 7      2822 6        syn-C2H3C(O)NH2, v=0
  212017.0278  0.0013 -5.8991 3  213.1405 59  71510 3032922 8      2822 7        syn-C2H3C(O)NH2, v=0
  212025.5421  0.0402 -6.1909 3 1352.7451187  71510 303933558      923657        syn-C2H3C(O)NH2, v=0
  212025.5421  0.0402 -6.1909 3 1352.7451187  71510 303933559      923656        syn-C2H3C(O)NH2, v=0
  212032.5677  0.0011 -5.3798 3  112.4350 57  71510 30328 919      27 918        syn-C2H3C(O)NH2, v=0
  212063.2961  0.0016 -4.3987 3  401.2011107  71510 303531539      521636        syn-C2H3C(O)NH2, v=0
  212064.2831  0.0246 -5.6229 3  800.1169153  71510 303761859      751956        syn-C2H3C(O)NH2, v=0
  212116.2906  0.0200 -3.8323 3  507.0844119 -71510 303591842      591743        syn-C2H3C(O)NH2, v=0
  212129.6303  0.0200 -3.6584 3  375.2136101 -71510 303501733      501634        syn-C2H3C(O)NH2, v=0
  212151.4562  0.0012 -5.8281 3  203.0112 59  71510 3032921 8      2821 7        syn-C2H3C(O)NH2, v=0
  212151.4562  0.0012 -5.8281 3  203.0112 59  71510 3032921 9      2821 8        syn-C2H3C(O)NH2, v=0
  212304.5730  0.0012 -5.7650 3  193.3581 59  71510 3032920 9      2820 8        syn-C2H3C(O)NH2, v=0
  212304.5730  0.0012 -5.7650 3  193.3581 59  71510 303292010      2820 9        syn-C2H3C(O)NH2, v=0
  212387.1259  0.0022 -5.8833 3   30.1697 29  71510 30314 7 7      14 410        syn-C2H3C(O)NH2, v=0
  212393.1760  0.0010 -5.3471 3   99.6353 55  71510 30327 720      26 719        syn-C2H3C(O)NH2, v=0
  212471.0791  0.0268 -6.1745 3  763.8893105  71510 3035243 9      534212        syn-C2H3C(O)NH2, v=0
  212471.0791  0.0268 -6.1745 3  763.8893105  71510 303524310      534211        syn-C2H3C(O)NH2, v=0
  212480.6663  0.0011 -5.7083 3  184.1822 59  71510 303291910      2819 9        syn-C2H3C(O)NH2, v=0
  212480.6663  0.0011 -5.7083 3  184.1822 59  71510 303291911      281910        syn-C2H3C(O)NH2, v=0
  212506.0483  0.0200 -3.7534 3  201.4147 83 -71510 30341 437      41 338        syn-C2H3C(O)NH2, v=0
  212506.0483  0.0200 -3.7534 3  201.4147 83 -71510 30341 537      41 438        syn-C2H3C(O)NH2, v=0
  212525.2791  0.0200 -3.5366 3  225.5422 75 -71510 303371621      371522        syn-C2H3C(O)NH2, v=0
  212526.0584  0.0200 -3.5366 3  225.5421 75 -71510 303371622      371523        syn-C2H3C(O)NH2, v=0
  212531.7802  0.0465 -6.3130 3 1415.3903191  71510 303953659      943758        syn-C2H3C(O)NH2, v=0
  212531.7802  0.0465 -6.3130 3 1415.3903191  71510 303953660      943757        syn-C2H3C(O)NH2, v=0
  212586.5481  0.0048 -4.0962 3  663.2101139  71510 303691653      691554        syn-C2H3C(O)NH2, v=0
  212593.3242  0.0200 -3.6566 3  375.1962101 -71510 303501734      501635        syn-C2H3C(O)NH2, v=0
  212609.9811  0.0025 -3.9214 3  548.9032127  71510 303631449      631350        syn-C2H3C(O)NH2, v=0
  212619.0444  0.1415 -6.5006 3 1222.5073189  71510 303942273      932370        syn-C2H3C(O)NH2, v=0
  212644.9401  0.0026 -4.1880 3  274.0395 89  71510 303441232      431331        syn-C2H3C(O)NH2, v=0
  212681.2967  0.0015 -3.7436 3  410.3074111  71510 303551244      551145        syn-C2H3C(O)NH2, v=0
  212685.3247  0.0011 -5.6571 3  175.4848 59  71510 303291811      281810        syn-C2H3C(O)NH2, v=0
  212685.3247  0.0011 -5.6571 3  175.4848 59  71510 303291812      281811        syn-C2H3C(O)NH2, v=0
  212756.0364  0.0017 -4.5010 3  470.3293115  71510 303571741      561838        syn-C2H3C(O)NH2, v=0
  212871.3087  0.1407 -5.7277 3 1583.2554213  71510 303A62779      A62680        syn-C2H3C(O)NH2, v=0
  212892.5136  0.0026 -6.1919 3  202.6850 73  71510 303361422      371127        syn-C2H3C(O)NH2, v=0
  212905.6986  0.0041 -6.1912 3  336.6992107  71510 30353 548      54 451        syn-C2H3C(O)NH2, v=0
  212905.6990  0.0041 -6.1912 3  336.6992107  71510 30353 648      54 351        syn-C2H3C(O)NH2, v=0
  212925.9622  0.0011 -5.6106 3  167.2674 59  71510 303291712      281711        syn-C2H3C(O)NH2, v=0
  212925.9622  0.0011 -5.6106 3  167.2674 59  71510 303291713      281712        syn-C2H3C(O)NH2, v=0
  213030.6016  0.0021 -4.5906 3   95.0534 53  71510 30326 818      26 521        syn-C2H3C(O)NH2, v=0
  213060.9063  0.0534 -6.4381 3 1479.4610195  71510 303973760      963859        syn-C2H3C(O)NH2, v=0
  213060.9063  0.0534 -6.4381 3 1479.4610195  71510 303973761      963858        syn-C2H3C(O)NH2, v=0
  213068.7872  0.0017 -4.4427 3  435.0296111  71510 303551640      541737        syn-C2H3C(O)NH2, v=0
  213163.1380  0.0231 -6.1483 3  718.8499101  71510 3035042 8      514111        syn-C2H3C(O)NH2, v=0
  213163.1380  0.0231 -6.1483 3  718.8499101  71510 3035042 9      514110        syn-C2H3C(O)NH2, v=0
  213212.6233  0.0010 -5.5681 3  159.5324 59  71510 303291613      281612        syn-C2H3C(O)NH2, v=0
  213212.6233  0.0010 -5.5681 3  159.5324 59  71510 303291614      281613        syn-C2H3C(O)NH2, v=0
  213278.8609  0.0032 -4.0027 3  604.7589133  71510 303661551      661452        syn-C2H3C(O)NH2, v=0
  213287.4731  0.0200 -3.5337 3  216.3780 73 -71510 303361620      361521        syn-C2H3C(O)NH2, v=0
  213287.4731  0.0200 -3.5337 3  216.3779 73 -71510 303361621      361522        syn-C2H3C(O)NH2, v=0
  213363.4480  0.0019 -4.5614 3  507.0864119  71510 303591841      581940        syn-C2H3C(O)NH2, v=0
  213374.8422  0.0872 -6.7418 3 1216.4243139  71510 303695217      705120        syn-C2H3C(O)NH2, v=0
  213374.8422  0.0872 -6.7418 3 1216.4243139  71510 303695218      705119        syn-C2H3C(O)NH2, v=0
  213396.8420  0.0200 -4.3645 3  388.0351105 -71510 303521537      511636        syn-C2H3C(O)NH2, v=0
  213559.2692  0.0010 -5.5292 3  152.2828 59  71510 303291515      281514        syn-C2H3C(O)NH2, v=0
  213559.2695  0.0010 -5.5292 3  152.2828 59  71510 303291514      281513        syn-C2H3C(O)NH2, v=0
  213611.0267  0.0611 -6.5661 3 1544.9559199  71510 303993861      983960        syn-C2H3C(O)NH2, v=0
  213611.0267  0.0611 -6.5661 3 1544.9559199  71510 303993862      983959        syn-C2H3C(O)NH2, v=0
  213731.4397  0.0651 -6.0393 3 1000.2505171  71510 303852066      842163        syn-C2H3C(O)NH2, v=0
  213817.3526  0.0200 -3.6136 3   41.9832 35 -71510 30317 711      16 610        syn-C2H3C(O)NH2, v=0
  213845.4047  0.0198 -6.1343 3  675.2456 97  71510 3034841 7      494010        syn-C2H3C(O)NH2, v=0
  213845.4047  0.0198 -6.1343 3  675.2456 97  71510 3034841 8      4940 9        syn-C2H3C(O)NH2, v=0
  213892.8015  0.0042 -4.6688 3  437.0469113  71510 303561443      551540        syn-C2H3C(O)NH2, v=0
  213981.5023  0.0200 -3.5324 3  207.4720 71 -71510 303351619      351520        syn-C2H3C(O)NH2, v=0
  213981.5023  0.0200 -3.5324 3  207.4720 71 -71510 303351620      351521        syn-C2H3C(O)NH2, v=0
  213985.9354  0.0010 -5.4934 3  145.5226 59  71510 303291416      281415        syn-C2H3C(O)NH2, v=0
  213985.9425  0.0010 -5.4934 3  145.5226 59  71510 303291415      281414        syn-C2H3C(O)NH2, v=0
  214053.1299  0.0016 -3.7050 3  227.5053 87  71510 30343 538      43 439        syn-C2H3C(O)NH2, v=0
  214053.4480  0.0016 -3.7050 3  227.5053 87  71510 30343 638      43 539        syn-C2H3C(O)NH2, v=0
  214099.9186  0.0200 -3.7111 3  376.7746107 -71510 303531043      53 944        syn-C2H3C(O)NH2, v=0
  214139.1624  0.0013 -3.7867 3  477.5304115  71510 303571839      571740        syn-C2H3C(O)NH2, v=0
  214141.3416  0.0776 -6.6548 3 1158.9939135  71510 303675116      685019        syn-C2H3C(O)NH2, v=0
  214141.3416  0.0776 -6.6548 3 1158.9939135  71510 303675117      685018        syn-C2H3C(O)NH2, v=0
  214150.7507  0.0551 -4.8631 3 1113.1730179  71510 303892267      892168        syn-C2H3C(O)NH2, v=0
  214173.2704  0.0200 -3.6381 3  362.6401 99 -71510 303491732      491633        syn-C2H3C(O)NH2, v=0
  214180.4993  0.0696 -6.6972 3 1611.8736203  71510 303A13962      A04061        syn-C2H3C(O)NH2, v=0
  214180.4993  0.0696 -6.6972 3 1611.8736203  71510 303A13963      A04060        syn-C2H3C(O)NH2, v=0
  214227.1810  0.0023 -4.9221 3   70.2480 45  71510 30322 814      22 517        syn-C2H3C(O)NH2, v=0
  214233.1655  0.0147 -6.5417 3  812.5942161  71510 303801169      811072        syn-C2H3C(O)NH2, v=0
  214233.1660  0.0147 -6.5417 3  812.5942161  71510 303801269      81 972        syn-C2H3C(O)NH2, v=0
  214302.8258  0.0025 -3.9611 3  161.0687 77  71510 30338 236      38 137        syn-C2H3C(O)NH2, v=0
  214302.8263  0.0025 -3.9611 3  161.0687 77  71510 30338 336      38 237        syn-C2H3C(O)NH2, v=0
  214352.0415  0.0021 -4.0609 3  660.4890137  71510 303681950      681851        syn-C2H3C(O)NH2, v=0
  214369.7870  0.0125 -4.4277 3  871.6073157  71510 303782256      782157        syn-C2H3C(O)NH2, v=0
  214403.6823  0.0200 -3.7099 3  376.7757107 -71510 303531143      531044        syn-C2H3C(O)NH2, v=0
  214432.7781  0.0200 -3.6370 3  362.6304 99 -71510 303491733      491634        syn-C2H3C(O)NH2, v=0
  214462.4889  0.0200 -3.8038 3  492.1176117 -71510 303581841      581742        syn-C2H3C(O)NH2, v=0
  214467.1930  0.0039 -6.1850 3  473.0983125  71510 30362 755      63 658        syn-C2H3C(O)NH2, v=0
  214467.1935  0.0039 -6.1850 3  473.0983125  71510 30362 855      63 558        syn-C2H3C(O)NH2, v=0
  214468.3107  0.0025 -4.0213 3  629.0820135  71510 303671751      671652        syn-C2H3C(O)NH2, v=0
  214508.0746  0.0200 -3.9346 3  576.7929127 -71510 303631944      631845        syn-C2H3C(O)NH2, v=0
  214513.9748  0.0018 -4.3941 3  381.8516105  71510 303521439      511536        syn-C2H3C(O)NH2, v=0
  214514.4306  0.0009 -5.3329 3  104.5880 57  71510 30328 622      27 621        syn-C2H3C(O)NH2, v=0
  214517.6576  0.0170 -6.1348 3  633.0772 93  71510 3034640 6      4739 9        syn-C2H3C(O)NH2, v=0
  214517.6576  0.0170 -6.1348 3  633.0772 93  71510 3034640 7      4739 8        syn-C2H3C(O)NH2, v=0
  214522.5499  0.0010 -5.4604 3  139.2579 59  71510 303291317      281316        syn-C2H3C(O)NH2, v=0
  214522.7019  0.0010 -5.4604 3  139.2579 59  71510 303291316      281315        syn-C2H3C(O)NH2, v=0
  214613.0776  0.0007 -3.5327 3  198.8232 69  71510 303341618      341519        syn-C2H3C(O)NH2, v=0
  214613.1340  0.0007 -3.5327 3  198.8232 69  71510 303341619      341520        syn-C2H3C(O)NH2, v=0
  214617.8262  0.0024 -4.0890 3  678.0521139  71510 303691951      691852        syn-C2H3C(O)NH2, v=0
  214659.2442  0.0047 -6.2772 3  282.1898 99  71510 30349 445      50 348        syn-C2H3C(O)NH2, v=0
  214659.2444  0.0047 -6.2772 3  282.1898 99  71510 30349 545      50 248        syn-C2H3C(O)NH2, v=0
  214703.3013  0.0023 -5.6115 3   34.7790 33  71510 30316 611      16 314        syn-C2H3C(O)NH2, v=0
  214726.1287  0.0029 -4.0824 3  670.8896139  71510 303691852      691753        syn-C2H3C(O)NH2, v=0
  214761.5476  0.0200 -3.7758 3   43.6454 37 -71510 30318 612      17 513        syn-C2H3C(O)NH2, v=0
  214764.1933  0.0200 -3.8368 3  495.6762121 -71510 303601447      601348        syn-C2H3C(O)NH2, v=0
  214815.6219  0.0200 -3.5433 3  119.4174 61 -71510 30330 624      29 723        syn-C2H3C(O)NH2, v=0
  214831.1286  0.0200 -3.4206 3   32.5289 23 -71510 3031110 2      10 9 1        syn-C2H3C(O)NH2, v=0
  214831.1286  0.0200 -3.4206 3   32.5289 23 -71510 3031110 1      10 9 2        syn-C2H3C(O)NH2, v=0
  214849.9690  0.0061 -6.3146 3  631.7475143  71510 30371 962      72 865        syn-C2H3C(O)NH2, v=0
  214849.9695  0.0061 -6.3146 3  631.7475143  71510 303711062      72 765        syn-C2H3C(O)NH2, v=0
  214874.1312  0.0019 -4.0313 3  643.1703135  71510 303671949      671850        syn-C2H3C(O)NH2, v=0
  214899.3021  0.0688 -6.5733 3 1102.9903131  71510 303655015      664918        syn-C2H3C(O)NH2, v=0
  214899.3021  0.0688 -6.5733 3 1102.9903131  71510 303655016      664917        syn-C2H3C(O)NH2, v=0
  214900.3677  0.0200 -3.4011 3  115.6135 61 -71510 30330 525      29 624        syn-C2H3C(O)NH2, v=0
  214982.0641  0.0030 -3.9479 3  179.8500 73  71510 30336 927      351026        syn-C2H3C(O)NH2, v=0
  215102.8014  0.0009 -5.3348 3  112.2423 59  71510 30329 723      28 722        syn-C2H3C(O)NH2, v=0
  215112.8025  0.0200 -3.1028 3  123.1718 69 -71510 30334 133      33 232        syn-C2H3C(O)NH2, v=0
  215112.7537  0.0009 -5.2660 3  123.1718 69  71510 30334 233      33 232        syn-C2H3C(O)NH2, v=0
  215112.7538  0.0009 -5.2660 3  123.1718 69  71510 30334 133      33 132        syn-C2H3C(O)NH2, v=0
  215112.8025  0.0200 -3.1028 3  123.1718 69 -71510 30334 233      33 132        syn-C2H3C(O)NH2, v=0
  215117.5702  0.0009 -5.2497 3  123.6921 71  71510 30335 035      34 034        syn-C2H3C(O)NH2, v=0
  215117.5702  0.0009 -3.0551 3  123.6921 71  71510 30335 035      34 134        syn-C2H3C(O)NH2, v=0
  215117.5702  0.0009 -3.0551 3  123.6921 71  71510 30335 135      34 034        syn-C2H3C(O)NH2, v=0
  215117.5702  0.0009 -5.2497 3  123.6921 71  71510 30335 135      34 134        syn-C2H3C(O)NH2, v=0
  215131.2519  0.0200 -3.1564 3  122.1323 67 -71510 30333 231      32 330        syn-C2H3C(O)NH2, v=0
  215131.2414  0.0009 -5.2816 3  122.1323 67  71510 30333 331      32 330        syn-C2H3C(O)NH2, v=0
  215131.2584  0.0009 -5.2816 3  122.1323 67  71510 30333 231      32 230        syn-C2H3C(O)NH2, v=0
  215131.2519  0.0200 -3.1564 3  122.1323 67 -71510 30333 331      32 230        syn-C2H3C(O)NH2, v=0
  215140.7238  0.0877 -5.9602 3 1711.5034221  71510 303B02981      B02882        syn-C2H3C(O)NH2, v=0
  215167.2138  0.0014 -6.7880 3  254.8656 91  71510 30345 639      45 640        syn-C2H3C(O)NH2, v=0
  215167.3038  0.0014 -3.6784 3  254.8656 91  71510 30345 639      45 540        syn-C2H3C(O)NH2, v=0
  215168.8733  0.0014 -3.6783 3  254.8656 91  71510 30345 739      45 640        syn-C2H3C(O)NH2, v=0
  215168.9632  0.0014 -6.7880 3  254.8656 91  71510 30345 739      45 540        syn-C2H3C(O)NH2, v=0
  215179.6599  0.0145 -6.1533 3  592.3455 89  71510 3034439 5      4538 8        syn-C2H3C(O)NH2, v=0
  215179.6599  0.0145 -6.1533 3  592.3455 89  71510 3034439 6      4538 7        syn-C2H3C(O)NH2, v=0
  215187.2350  0.0200 -3.5347 3  190.4307 67 -71510 303331617      331518        syn-C2H3C(O)NH2, v=0
  215187.2350  0.0200 -3.5347 3  190.4307 67 -71510 303331618      331519        syn-C2H3C(O)NH2, v=0
  215207.9501  0.0200 -3.2186 3  120.5514 65 -71510 30332 329      31 428        syn-C2H3C(O)NH2, v=0
  215208.9272  0.0009 -5.2962 3  120.5514 65  71510 30332 429      31 428        syn-C2H3C(O)NH2, v=0
  215209.8680  0.0009 -5.2962 3  120.5513 65  71510 30332 329      31 328        syn-C2H3C(O)NH2, v=0
  215210.8499  0.0200 -3.2186 3  120.5513 65 -71510 30332 429      31 328        syn-C2H3C(O)NH2, v=0
  215215.6109  0.0010 -5.4298 3  133.4976 59  71510 303291218      281217        syn-C2H3C(O)NH2, v=0
  215218.2161  0.0010 -5.4298 3  133.4977 59  71510 303291217      281216        syn-C2H3C(O)NH2, v=0
  215219.1125  0.0200 -3.4710 3   34.1384 27 -71510 30313 9 5      12 8 4        syn-C2H3C(O)NH2, v=0
  215219.1125  0.0200 -3.4710 3   34.1384 27 -71510 30313 9 4      12 8 5        syn-C2H3C(O)NH2, v=0
  215279.0251  0.0029 -6.4240 3  119.3954 55  71510 303271215      28 920        syn-C2H3C(O)NH2, v=0
  215308.7906  0.0009 -3.6093 3   41.9407 35  71510 30317 710      16 611        syn-C2H3C(O)NH2, v=0
  215366.9808  0.0200 -3.5279 3   37.2541 31 -71510 30315 8 8      14 7 7        syn-C2H3C(O)NH2, v=0
  215376.6469  0.0200 -3.2947 3  118.3943 63 -71510 30331 427      30 526        syn-C2H3C(O)NH2, v=0
  215382.6515  0.0200 -3.5279 3   37.2537 31 -71510 30315 8 7      14 7 8        syn-C2H3C(O)NH2, v=0
  215388.1298  0.0200 -3.6858 3  344.4520103 -71510 30351 942      51 843        syn-C2H3C(O)NH2, v=0
  215413.5314  0.0009 -5.3092 3  118.3943 63  71510 30331 527      30 526        syn-C2H3C(O)NH2, v=0
  215444.1999  0.0009 -5.3090 3  118.3921 63  71510 30331 427      30 426        syn-C2H3C(O)NH2, v=0
  215481.0895  0.0200 -3.2943 3  118.3921 63 -71510 30331 527      30 426        syn-C2H3C(O)NH2, v=0
  215482.1365  0.0012 -3.6855 3  344.4523103  71510 303511042      51 943        syn-C2H3C(O)NH2, v=0
  215648.6054  0.0609 -6.4976 3 1048.4145127  71510 303634914      644817        syn-C2H3C(O)NH2, v=0
  215648.6054  0.0609 -6.4976 3 1048.4145127  71510 303634915      644816        syn-C2H3C(O)NH2, v=0
  215708.3057  0.0200 -3.5386 3  182.2936 65 -71510 303321616      321517        syn-C2H3C(O)NH2, v=0
  215708.3057  0.0200 -3.5386 3  182.2936 65 -71510 303321617      321518        syn-C2H3C(O)NH2, v=0
  215732.2064  0.0009 -5.3205 3  115.6135 61  71510 30330 625      29 624        syn-C2H3C(O)NH2, v=0
  215738.5818  0.0011 -5.1681 3   17.8429 25  71510 30312 5 8      11 2 9        syn-C2H3C(O)NH2, v=0
  215768.0958  0.0027 -4.1152 3  695.8515141  71510 303701952      701853        syn-C2H3C(O)NH2, v=0
  215805.3492  0.0200 -3.6681 3  283.4847 95 -71510 30347 740      47 641        syn-C2H3C(O)NH2, v=0
  215812.1862  0.0200 -3.6681 3  283.4847 95 -71510 30347 840      47 741        syn-C2H3C(O)NH2, v=0
  215831.1587  0.0124 -6.1952 3  553.0511 85  71510 3034238 4      4337 7        syn-C2H3C(O)NH2, v=0
  215831.1587  0.0124 -6.1952 3  553.0511 85  71510 3034238 5      4337 6        syn-C2H3C(O)NH2, v=0
  215874.9179  0.0200 -3.7930 3  459.1361117 -71510 303581246      581147        syn-C2H3C(O)NH2, v=0
  215908.2123  0.0012 -3.6712 3  313.3509 99  71510 30349 841      49 742        syn-C2H3C(O)NH2, v=0
  215934.8123  0.0200 -3.6711 3  313.3510 99 -71510 30349 941      49 842        syn-C2H3C(O)NH2, v=0
  215982.7434  0.0054 -6.4528 3  232.2048 91  71510 30345 342      46 245        syn-C2H3C(O)NH2, v=0
  215982.7435  0.0054 -6.4528 3  232.2048 91  71510 30345 442      46 145        syn-C2H3C(O)NH2, v=0
  215997.8932  0.0200 -3.6194 3  350.3417 97 -71510 303481731      481632        syn-C2H3C(O)NH2, v=0
  216059.3270  0.0200 -4.0006 3  626.1040133 -71510 303661948      661849        syn-C2H3C(O)NH2, v=0
  216109.1901  0.0945 -5.1891 3 1296.4844193  71510 303962472      962373        syn-C2H3C(O)NH2, v=0
  216113.1038  0.0025 -6.1535 3  247.3863 81  71510 303401525      411230        syn-C2H3C(O)NH2, v=0
  216130.5325  0.0020 -4.4865 3  470.3211115  71510 303571740      561839        syn-C2H3C(O)NH2, v=0
  216133.7824  0.0010 -5.4011 3  128.2554 59  71510 303291119      281118        syn-C2H3C(O)NH2, v=0
  216140.0695  0.0200 -3.6189 3  350.3364 97 -71510 303481732      481633        syn-C2H3C(O)NH2, v=0
  216168.7220  0.0010 -5.4009 3  128.2565 59  71510 303291118      281117        syn-C2H3C(O)NH2, v=0
  216180.4186  0.0200 -3.5444 3  174.4110 63 -71510 303311615      311516        syn-C2H3C(O)NH2, v=0
  216180.4186  0.0200 -3.5444 3  174.4110 63 -71510 303311616      311517        syn-C2H3C(O)NH2, v=0
  216197.0623  0.0022 -3.9585 3  588.4347131  71510 303651650      651551        syn-C2H3C(O)NH2, v=0
  216231.9111  0.0031 -6.3117 3  154.2813 63  71510 303311319      321022        syn-C2H3C(O)NH2, v=0
  216305.4874  0.0009 -5.3180 3  115.5666 61  71510 30330 525      29 524        syn-C2H3C(O)NH2, v=0
  216389.1239  0.0537 -6.4281 3  995.2677123  71510 303614813      624716        syn-C2H3C(O)NH2, v=0
  216389.1239  0.0537 -6.4281 3  995.2677123  71510 303614814      624715        syn-C2H3C(O)NH2, v=0
  216471.8850  0.0106 -6.2692 3  515.1948 81  71510 3034037 3      4136 6        syn-C2H3C(O)NH2, v=0
  216471.8850  0.0106 -6.2692 3  515.1948 81  71510 3034037 4      4136 5        syn-C2H3C(O)NH2, v=0
  216508.5223  0.0190 -4.4353 3  874.0360159  71510 303791960      791861        syn-C2H3C(O)NH2, v=0
  216557.9360  0.0338 -4.7890 3 1079.5834175  71510 303872463      872364        syn-C2H3C(O)NH2, v=0
  216607.3752  0.0200 -3.5523 3  166.7822 61 -71510 303301614      301515        syn-C2H3C(O)NH2, v=0
  216607.3752  0.0200 -3.5523 3  166.7822 61 -71510 303301615      301516        syn-C2H3C(O)NH2, v=0
  216647.3142  0.0200 -3.8271 3  185.1939 81 -71510 30340 337      40 238        syn-C2H3C(O)NH2, v=0
  216647.3142  0.0200 -3.8271 3  185.1939 81 -71510 30340 437      40 338        syn-C2H3C(O)NH2, v=0
  216647.3062  0.0033 -4.4137 3   31.0426 33  71510 30316 412      15 313        syn-C2H3C(O)NH2, v=0
  216808.3323  0.0240 -6.6971 3  921.0893171  71510 303851273      861176        syn-C2H3C(O)NH2, v=0
  216808.3327  0.0240 -6.6971 3  921.0893171  71510 303851373      861076        syn-C2H3C(O)NH2, v=0
  216812.7633  0.0063 -4.2386 3  766.4305147  71510 303732152      732053        syn-C2H3C(O)NH2, v=0
  216831.8715  0.0200 -3.7762 3  477.4261115 -71510 303571840      571741        syn-C2H3C(O)NH2, v=0
  216840.5918  0.0032 -4.0739 3  668.1655137  71510 303682048      681949        syn-C2H3C(O)NH2, v=0
  216868.3568  0.0686 -5.2068 3 1309.8762193  71510 303962670      962571        syn-C2H3C(O)NH2, v=0
  216937.0092  0.0039 -6.1731 3  408.5530117  71510 30358 652      59 555        syn-C2H3C(O)NH2, v=0
  216937.0095  0.0039 -6.1731 3  408.5530117  71510 30358 752      59 455        syn-C2H3C(O)NH2, v=0
  216992.4830  0.0200 -3.5625 3  159.4064 59 -71510 303291613      291514        syn-C2H3C(O)NH2, v=0
  216992.4830  0.0200 -3.5625 3  159.4064 59 -71510 303291614      291515        syn-C2H3C(O)NH2, v=0
  217057.2298  0.0071 -6.4897 3  247.7485 85  71510 303421131      43 836        syn-C2H3C(O)NH2, v=0
  217101.5534  0.0091 -6.3910 3  478.7772 77  71510 3033836 2      3935 5        syn-C2H3C(O)NH2, v=0
  217101.5534  0.0091 -6.3910 3  478.7772 77  71510 3033836 3      3935 4        syn-C2H3C(O)NH2, v=0
  217101.5717  0.0024 -5.2555 3   16.9543 27  71510 30313 311      12 012        syn-C2H3C(O)NH2, v=0
  217120.7203  0.0471 -6.3653 3  943.5507119  71510 303594712      604615        syn-C2H3C(O)NH2, v=0
  217120.7203  0.0471 -6.3653 3  943.5507119  71510 303594713      604614        syn-C2H3C(O)NH2, v=0
  217137.3394  0.0200 -3.3915 3  115.5666 61 -71510 30330 625      29 524        syn-C2H3C(O)NH2, v=0
  217230.9975  0.0012 -5.3402 3  109.0935 57  71510 30328 820      27 819        syn-C2H3C(O)NH2, v=0
  217316.1897  0.0010 -5.3741 3  123.5512 59  71510 303291020      281019        syn-C2H3C(O)NH2, v=0
  217328.7361  0.0431 -6.2496 3 1867.3297231  71510 303B53085      B52986        syn-C2H3C(O)NH2, v=0
  217339.1171  0.0200 -3.5752 3  152.2828 57 -71510 303281612      281513        syn-C2H3C(O)NH2, v=0
  217339.1171  0.0200 -3.5752 3  152.2828 57 -71510 303281613      281514        syn-C2H3C(O)NH2, v=0
  217422.9709  0.0200 -3.7871 3  459.1435117 -71510 303581346      581247        syn-C2H3C(O)NH2, v=0
  217527.1925  0.0200 -3.7559 3  463.0734113 -71510 303561838      561739        syn-C2H3C(O)NH2, v=0
  217536.1189  0.1042 -5.6734 3 1562.4038211  71510 303A52877      A52778        syn-C2H3C(O)NH2, v=0
  217606.6256  0.0026 -4.2307 3  313.7318 95  71510 303471334      461433        syn-C2H3C(O)NH2, v=0
  217641.5718  0.0200 -3.6024 3  338.3155 95 -71510 303471730      471631        syn-C2H3C(O)NH2, v=0
  217650.2543  0.0200 -3.5908 3  145.4108 55 -71510 303271611      271512        syn-C2H3C(O)NH2, v=0
  217650.2543  0.0200 -3.5908 3  145.4108 55 -71510 303271612      271513        syn-C2H3C(O)NH2, v=0
  217667.2445  0.0029 -4.2152 3  145.8247 75  71510 30337 136      37 037        syn-C2H3C(O)NH2, v=0
  217667.2445  0.0029 -4.2152 3  145.8247 75  71510 30337 236      37 137        syn-C2H3C(O)NH2, v=0
  217667.6162  0.0010 -5.3727 3  123.5638 59  71510 303291019      281018        syn-C2H3C(O)NH2, v=0
  217706.4970  0.1577 -6.1214 3 1799.7429227  71510 303B32984      B32885        syn-C2H3C(O)NH2, v=0
  217717.8821  0.0200 -3.6021 3  338.3127 95 -71510 303471731      471632        syn-C2H3C(O)NH2, v=0
  217719.8620  0.0078 -6.5939 3  443.7990 73  71510 3033635 1      3734 4        syn-C2H3C(O)NH2, v=0
  217719.8620  0.0078 -6.5939 3  443.7990 73  71510 3033635 2      3734 3        syn-C2H3C(O)NH2, v=0
  217746.3344  0.0081 -6.4586 3  397.0187107  71510 303531439      541144        syn-C2H3C(O)NH2, v=0
  217767.3929  0.0017 -3.9691 3  609.2973131  71510 303651947      651848        syn-C2H3C(O)NH2, v=0
  217831.7535  0.0098 -6.4269 3  728.0561153  71510 303761066      77 969        syn-C2H3C(O)NH2, v=0
  217831.7539  0.0098 -6.4269 3  728.0561153  71510 303761166      77 869        syn-C2H3C(O)NH2, v=0
  217843.2469  0.0413 -6.3099 3  893.2647115  71510 303574611      584514        syn-C2H3C(O)NH2, v=0
  217843.2469  0.0413 -6.3099 3  893.2647115  71510 303574612      584513        syn-C2H3C(O)NH2, v=0
  217861.1322  0.0031 -4.1395 3  713.8788143  71510 303711953      711854        syn-C2H3C(O)NH2, v=0
  217905.7957  0.0147 -6.6946 3  655.1645137  71510 303681850      691555        syn-C2H3C(O)NH2, v=0
  217908.7373  0.1418 -5.5471 3 1493.4932207  71510 303A32677      A32578        syn-C2H3C(O)NH2, v=0
  217924.3580  0.0046 -6.2437 3  557.1931135  71510 30367 859      68 762        syn-C2H3C(O)NH2, v=0
  217924.3584  0.0046 -6.2437 3  557.1931135  71510 30367 959      68 662        syn-C2H3C(O)NH2, v=0
  217928.6208  0.0200 -3.6097 3  138.7897 53 -71510 303261610      261511        syn-C2H3C(O)NH2, v=0
  217928.6208  0.0200 -3.6097 3  138.7897 53 -71510 303261611      261512        syn-C2H3C(O)NH2, v=0
  218011.0074  0.0031 -6.6980 3   83.1581 45  71510 303221112      23 815        syn-C2H3C(O)NH2, v=0
  218164.9037  0.0009 -5.3352 3  115.7134 59  71510 30329 822      28 821        syn-C2H3C(O)NH2, v=0
  218176.8786  0.0200 -3.6324 3  132.4190 51 -71510 3032516 9      251510        syn-C2H3C(O)NH2, v=0
  218176.8786  0.0200 -3.6324 3  132.4190 51 -71510 303251610      251511        syn-C2H3C(O)NH2, v=0
  218227.0027  0.0021 -6.0802 3   26.5301 27  71510 30313 7 6      13 4 9        syn-C2H3C(O)NH2, v=0
  218397.4454  0.0200 -3.6597 3  126.2979 49 -71510 3032416 8      2415 9        syn-C2H3C(O)NH2, v=0
  218397.4454  0.0200 -3.6597 3  126.2979 49 -71510 3032416 9      241510        syn-C2H3C(O)NH2, v=0
  218424.0788  0.0090 -5.2165 3  871.9373153  71510 303762651      752748        syn-C2H3C(O)NH2, v=0
  218424.9687  0.0090 -5.2165 3  871.9373153  71510 303762650      752749        syn-C2H3C(O)NH2, v=0
  218427.1129  0.0010 -5.3503 3  119.3954 59  71510 30329 921      28 920        syn-C2H3C(O)NH2, v=0
  218463.3207  0.0072 -5.1225 3  823.1330149  71510 303742550      732647        syn-C2H3C(O)NH2, v=0
  218465.8741  0.0072 -5.1225 3  823.1330149  71510 303742549      732648        syn-C2H3C(O)NH2, v=0
  218469.8609  0.0056 -5.4053 3   51.7637 41  71510 30320 515      20 218        syn-C2H3C(O)NH2, v=0
  218472.7910  0.0111 -5.3134 3  922.1796157  71510 303782752      772849        syn-C2H3C(O)NH2, v=0
  218473.0969  0.0111 -5.3134 3  922.1796157  71510 303782751      772850        syn-C2H3C(O)NH2, v=0
  218539.9449  0.1005 -6.3048 3 1897.7934233  71510 303B63086      B62987        syn-C2H3C(O)NH2, v=0
  218556.5449  0.0360 -6.2626 3  844.4105111  71510 303554510      564413        syn-C2H3C(O)NH2, v=0
  218556.5449  0.0360 -6.2626 3  844.4105111  71510 303554511      564412        syn-C2H3C(O)NH2, v=0
  218592.5580  0.0200 -3.6924 3  120.4260 47 -71510 3032316 7      2315 8        syn-C2H3C(O)NH2, v=0
  218592.5580  0.0200 -3.6924 3  120.4260 47 -71510 3032316 8      2315 9        syn-C2H3C(O)NH2, v=0
  218596.6227  0.0136 -5.4132 3  973.8586161  71510 303802853      792950        syn-C2H3C(O)NH2, v=0
  218596.7266  0.0136 -5.4132 3  973.8586161  71510 303802852      792951        syn-C2H3C(O)NH2, v=0
  218606.2856  0.0057 -5.0314 3  775.7682145  71510 303722449      712546        syn-C2H3C(O)NH2, v=0
  218613.5031  0.0057 -5.0314 3  775.7682145  71510 303722448      712547        syn-C2H3C(O)NH2, v=0
  218631.3547  0.0200 -3.7480 3  210.6106 85 -71510 30342 438      42 339        syn-C2H3C(O)NH2, v=0
  218631.3547  0.0200 -3.7480 3  210.6106 85 -71510 30342 538      42 439        syn-C2H3C(O)NH2, v=0
  218717.8099  0.0026 -6.1420 3  296.5528 89  71510 303441628      451333        syn-C2H3C(O)NH2, v=0
  218757.7248  0.0021 -4.4252 3  395.1532107  71510 303531440      521537        syn-C2H3C(O)NH2, v=0
  218764.5282  0.0200 -3.7320 3  114.8027 45 -71510 3032216 6      2215 7        syn-C2H3C(O)NH2, v=0
  218764.5282  0.0200 -3.7320 3  114.8027 45 -71510 3032216 7      2215 8        syn-C2H3C(O)NH2, v=0
  218785.1507  0.0164 -5.5159 3 1026.9730165  71510 303822954      813051        syn-C2H3C(O)NH2, v=0
  218785.1856  0.0164 -5.5159 3 1026.9730165  71510 303822953      813052        syn-C2H3C(O)NH2, v=0
  218799.5697  0.0017 -6.5369 3  290.9313 61  71510 3033028 2      2928 1        syn-C2H3C(O)NH2, v=0
  218799.5697  0.0017 -6.5369 3  290.9313 61  71510 3033028 3      2928 2        syn-C2H3C(O)NH2, v=0
  218871.9997  0.0045 -4.9432 3  729.8443141  71510 303702348      692445        syn-C2H3C(O)NH2, v=0
  218879.3168  0.0016 -6.3411 3  277.9607 61  71510 3033027 3      2927 2        syn-C2H3C(O)NH2, v=0
  218879.3168  0.0016 -6.3411 3  277.9607 61  71510 3033027 4      2927 3        syn-C2H3C(O)NH2, v=0
  218892.0627  0.0045 -4.9431 3  729.8442141  71510 303702347      692446        syn-C2H3C(O)NH2, v=0
  218915.1943  0.0200 -3.7805 3  109.4275 43 -71510 3032116 5      2115 6        syn-C2H3C(O)NH2, v=0
  218915.1943  0.0200 -3.7805 3  109.4275 43 -71510 3032116 6      2115 7        syn-C2H3C(O)NH2, v=0
  218929.6246  0.0034 -4.5599 3  422.7424111  71510 303551442      541539        syn-C2H3C(O)NH2, v=0
  218929.9808  0.0019 -3.8974 3  548.9421127  71510 303631549      631450        syn-C2H3C(O)NH2, v=0
  218966.1686  0.0015 -6.1974 3  265.4631 61  71510 3033026 4      2926 3        syn-C2H3C(O)NH2, v=0
  218966.1686  0.0015 -6.1974 3  265.4631 61  71510 3033026 5      2926 4        syn-C2H3C(O)NH2, v=0
  219029.8688  0.0196 -5.6215 3 1081.5215169  71510 303843055      833152        syn-C2H3C(O)NH2, v=0
  219029.8804  0.0196 -5.6215 3 1081.5215169  71510 303843054      833153        syn-C2H3C(O)NH2, v=0
  219044.0773  0.0042 -6.2014 3  348.5178109  71510 30354 549      55 452        syn-C2H3C(O)NH2, v=0
  219044.0775  0.0042 -6.2014 3  348.5178109  71510 30354 649      55 352        syn-C2H3C(O)NH2, v=0
  219046.6011  0.0200 -3.8412 3  104.3000 41 -71510 3032016 4      2015 5        syn-C2H3C(O)NH2, v=0
  219046.6011  0.0200 -3.8412 3  104.3000 41 -71510 3032016 5      2015 6        syn-C2H3C(O)NH2, v=0
  219054.7098  0.0200 -3.7467 3  423.7915113 -71510 303561145      561046        syn-C2H3C(O)NH2, v=0
  219061.3891  0.0014 -6.0829 3  253.4390 61  71510 3033025 5      2925 4        syn-C2H3C(O)NH2, v=0
  219061.3891  0.0014 -6.0829 3  253.4390 61  71510 3033025 6      2925 5        syn-C2H3C(O)NH2, v=0
  219131.9358  0.0200 -3.5868 3  326.5592 93 -71510 303461729      461630        syn-C2H3C(O)NH2, v=0
  219158.4293  0.0200 -3.7496 3  463.0108113 -71510 303561839      561740        syn-C2H3C(O)NH2, v=0
  219160.4331  0.0200 -3.9194 3   99.4195 39 -71510 3031916 3      1915 4        syn-C2H3C(O)NH2, v=0
  219160.4331  0.0200 -3.9194 3   99.4195 39 -71510 3031916 4      1915 5        syn-C2H3C(O)NH2, v=0
  219166.5171  0.0014 -5.9873 3  241.8889 61  71510 3033024 6      2924 5        syn-C2H3C(O)NH2, v=0
  219166.5171  0.0014 -5.9873 3  241.8889 61  71510 3033024 7      2924 6        syn-C2H3C(O)NH2, v=0
  219171.9709  0.0008 -3.5867 3  326.5577 93  71510 303461730      461631        syn-C2H3C(O)NH2, v=0
  219258.5250  0.0200 -4.0254 3   94.7858 37 -71510 3031816 2      1815 3        syn-C2H3C(O)NH2, v=0
  219258.5250  0.0200 -4.0254 3   94.7858 37 -71510 3031816 3      1815 4        syn-C2H3C(O)NH2, v=0
  219260.4438  0.0313 -6.2245 3  796.9890107  71510 3035344 9      544312        syn-C2H3C(O)NH2, v=0
  219260.4438  0.0313 -6.2245 3  796.9890107  71510 303534410      544311        syn-C2H3C(O)NH2, v=0
  219280.3226  0.0200 -3.8503 3  510.5967123 -71510 303611348      611249        syn-C2H3C(O)NH2, v=0
  219282.1922  0.0035 -4.8578 3  685.3629137  71510 303682247      672344        syn-C2H3C(O)NH2, v=0
  219283.4423  0.0013 -5.9049 3  230.8132 61  71510 3033023 7      2923 6        syn-C2H3C(O)NH2, v=0
  219283.4423  0.0013 -5.9049 3  230.8132 61  71510 3033023 8      2923 7        syn-C2H3C(O)NH2, v=0
  219299.9114  0.0207 -6.7569 3  831.3861151  71510 303752452      762155        syn-C2H3C(O)NH2, v=0
  219323.7832  0.0233 -5.7301 3 1137.5028173  71510 303863156      853253        syn-C2H3C(O)NH2, v=0
  219323.7870  0.0233 -5.7301 3 1137.5028173  71510 303863155      853254        syn-C2H3C(O)NH2, v=0
  219336.9266  0.0035 -4.8576 3  685.3628137  71510 303682246      672345        syn-C2H3C(O)NH2, v=0
  219342.3399  0.0012 -4.1821 3   90.3983 35  71510 3031716 1      1715 2        syn-C2H3C(O)NH2, v=0
  219342.3399  0.0012 -4.1821 3   90.3983 35  71510 3031716 2      1715 3        syn-C2H3C(O)NH2, v=0
  219406.3105  0.0030 -6.6935 3   83.1116 45  71510 303221111      23 816        syn-C2H3C(O)NH2, v=0
  219413.4788  0.0200 -4.4632 3   86.2568 33 -71510 3031616 0      1615 1        syn-C2H3C(O)NH2, v=0
  219413.4788  0.0200 -4.4632 3   86.2568 33 -71510 3031616 1      1615 2        syn-C2H3C(O)NH2, v=0
  219414.5069  0.0013 -5.8326 3  220.2126 61  71510 3033022 8      2922 7        syn-C2H3C(O)NH2, v=0
  219414.5069  0.0013 -5.8326 3  220.2126 61  71510 3033022 9      2922 8        syn-C2H3C(O)NH2, v=0
  219451.2630  0.0033 -4.0987 3  688.5314141  71510 303701853      701754        syn-C2H3C(O)NH2, v=0
  219562.6460  0.0012 -5.7682 3  210.0878 61  71510 3033021 9      2921 8        syn-C2H3C(O)NH2, v=0
  219562.6460  0.0012 -5.7682 3  210.0878 61  71510 303302110      2921 9        syn-C2H3C(O)NH2, v=0
  219605.2989  0.0200 -3.7446 3  423.7938113 -71510 303561245      561146        syn-C2H3C(O)NH2, v=0
  219661.0959  0.0275 -5.8417 3 1194.9158177  71510 303883257      873354        syn-C2H3C(O)NH2, v=0
  219661.0971  0.0275 -5.8417 3 1194.9158177  71510 303883256      873355        syn-C2H3C(O)NH2, v=0
  219665.6115  0.0138 -5.3411 3  699.0489143  71510 303711755      701852        syn-C2H3C(O)NH2, v=0
  219696.3144  0.0030 -6.2308 3  193.5227 71  71510 303351422      361125        syn-C2H3C(O)NH2, v=0
  219720.4111  0.0200 -3.8927 3  560.6838125 -71510 303621943      621844        syn-C2H3C(O)NH2, v=0
  219725.7681  0.0035 -5.8683 3   32.1003 33  71510 30316 512      16 215        syn-C2H3C(O)NH2, v=0
  219731.0650  0.0200 -3.6048 3   46.2542 37 -71510 30318 712      17 611        syn-C2H3C(O)NH2, v=0
  219731.5817  0.0012 -5.7103 3  200.4399 61  71510 303302010      2920 9        syn-C2H3C(O)NH2, v=0
  219731.5817  0.0012 -5.7103 3  200.4399 61  71510 303302011      292010        syn-C2H3C(O)NH2, v=0
  219830.4099  0.0009 -5.3122 3  111.7434 59  71510 30329 623      28 622        syn-C2H3C(O)NH2, v=0
  219855.7019  0.0200 -3.9372 3  592.7563129 -71510 303641946      641847        syn-C2H3C(O)NH2, v=0
  219858.1454  0.0028 -4.7753 3  642.3259133  71510 303662146      652243        syn-C2H3C(O)NH2, v=0
  219926.0989  0.0011 -5.6578 3  191.2698 61  71510 303301911      291910        syn-C2H3C(O)NH2, v=0
  219926.0989  0.0011 -5.6578 3  191.2698 61  71510 303301912      291911        syn-C2H3C(O)NH2, v=0
  219954.7611  0.0271 -6.1967 3  751.0011103  71510 3035143 8      524211        syn-C2H3C(O)NH2, v=0
  219954.7611  0.0271 -6.1967 3  751.0011103  71510 3035143 9      524210        syn-C2H3C(O)NH2, v=0
  220004.3268  0.0028 -4.7747 3  642.3256133  71510 303662145      652244        syn-C2H3C(O)NH2, v=0
  220036.9620  0.0322 -5.9562 3 1253.7591181  71510 303903358      893455        syn-C2H3C(O)NH2, v=0
  220036.9624  0.0322 -5.9562 3 1253.7591181  71510 303903357      893456        syn-C2H3C(O)NH2, v=0
  220152.4463  0.0011 -5.6100 3  182.5792 61  71510 303301812      291811        syn-C2H3C(O)NH2, v=0
  220152.4463  0.0011 -5.6100 3  182.5792 61  71510 303301813      291812        syn-C2H3C(O)NH2, v=0
  220230.8731  0.0200 -3.7009 3  237.3087 89 -71510 30344 539      44 440        syn-C2H3C(O)NH2, v=0
  220230.8731  0.0200 -3.7009 3  237.3087 89 -71510 30344 639      44 540        syn-C2H3C(O)NH2, v=0
  220240.6851  0.0081 -6.6615 3  170.2095 71  71510 30335 926      36 631        syn-C2H3C(O)NH2, v=0
  220344.0501  0.0009 -5.3127 3  106.7200 57  71510 30328 721      27 720        syn-C2H3C(O)NH2, v=0
  220364.5146  0.0026 -3.9540 3  169.2539 79  71510 30339 237      39 138        syn-C2H3C(O)NH2, v=0
  220364.5148  0.0026 -3.9540 3  169.2539 79  71510 30339 337      39 238        syn-C2H3C(O)NH2, v=0
  220404.7745  0.0022 -6.3174 3    9.9816 21  71510 30310 4 6       9 1 9        syn-C2H3C(O)NH2, v=0
  220414.3673  0.0027 -4.4793 3  408.7799109  71510 303541441      531538        syn-C2H3C(O)NH2, v=0
  220418.9361  0.0011 -5.5662 3  174.3699 61  71510 303301713      291712        syn-C2H3C(O)NH2, v=0
  220418.9361  0.0011 -5.5662 3  174.3699 61  71510 303301714      291713        syn-C2H3C(O)NH2, v=0
  220429.9916  0.0200 -3.7279 3  448.9085111 -71510 303551837      551738        syn-C2H3C(O)NH2, v=0
  220447.3025  0.0374 -6.0737 3 1314.0314185  71510 303923459      913556        syn-C2H3C(O)NH2, v=0
  220447.3026  0.0374 -6.0737 3 1314.0314185  71510 303923458      913557        syn-C2H3C(O)NH2, v=0
  220462.1633  0.0028 -4.0327 3  646.1020137  71510 303681752      681653        syn-C2H3C(O)NH2, v=0
  220467.1892  0.0028 -6.2975 3  154.1401 63  71510 303311318      321023        syn-C2H3C(O)NH2, v=0
  220478.2959  0.0123 -4.3087 3  807.0094153  71510 303761858      761759        syn-C2H3C(O)NH2, v=0
  220485.9934  0.1857 -5.9340 3 1704.1488221  71510 303B02882      B02783        syn-C2H3C(O)NH2, v=0
  220489.3880  0.0200 -3.5727 3  315.0707 91 -71510 303451728      451629        syn-C2H3C(O)NH2, v=0
  220509.9768  0.0200 -3.5726 3  315.0700 91 -71510 303451729      451630        syn-C2H3C(O)NH2, v=0
  220611.0399  0.0023 -4.6957 3  600.7353129  71510 303642045      632142        syn-C2H3C(O)NH2, v=0
  220619.9949  0.0162 -6.5628 3  831.0655163  71510 303811170      821073        syn-C2H3C(O)NH2, v=0
  220619.9952  0.0162 -6.5628 3  831.0655163  71510 303811270      82 973        syn-C2H3C(O)NH2, v=0
  220639.3010  0.0234 -6.1811 3  706.4477 99  71510 3034942 7      504110        syn-C2H3C(O)NH2, v=0
  220639.3010  0.0234 -6.1811 3  706.4477 99  71510 3034942 8      5041 9        syn-C2H3C(O)NH2, v=0
  220647.5688  0.0415 -4.7092 3 1037.6586173  71510 303862165      862066        syn-C2H3C(O)NH2, v=0
  220684.2539  0.0040 -6.1989 3  487.1358127  71510 30363 756      64 659        syn-C2H3C(O)NH2, v=0
  220684.2542  0.0040 -6.1989 3  487.1358127  71510 30363 856      64 559        syn-C2H3C(O)NH2, v=0
  220736.8706  0.0010 -5.5261 3  166.6445 61  71510 303301614      291613        syn-C2H3C(O)NH2, v=0
  220736.8706  0.0010 -5.5261 3  166.6445 61  71510 303301615      291614        syn-C2H3C(O)NH2, v=0
  220745.6707  0.0017 -4.3920 3  414.6256109  71510 303541540      531637        syn-C2H3C(O)NH2, v=0
  220758.7213  0.0029 -6.1541 3  350.1829 97  71510 303481731      491436        syn-C2H3C(O)NH2, v=0
  220760.4291  0.0048 -6.2860 3  292.9994101  71510 30350 446      51 349        syn-C2H3C(O)NH2, v=0
  220760.4292  0.0048 -6.2860 3  292.9994101  71510 30350 546      51 249        syn-C2H3C(O)NH2, v=0
  220823.8022  0.0011 -5.3408 3  119.5077 59  71510 30329 920      28 919        syn-C2H3C(O)NH2, v=0
  220827.9052  0.0026 -5.0631 3   64.5355 43  71510 30321 813      21 516        syn-C2H3C(O)NH2, v=0
  220830.8830  0.0022 -4.4087 3  435.0084111  71510 303551639      541738        syn-C2H3C(O)NH2, v=0
  220888.6593  0.0433 -6.1942 3 1375.7316189  71510 303943560      933657        syn-C2H3C(O)NH2, v=0
  220888.6594  0.0433 -6.1942 3 1375.7316189  71510 303943559      933658        syn-C2H3C(O)NH2, v=0
  220908.8451  0.0876 -6.7185 3 1199.4167137  71510 303685216      695119        syn-C2H3C(O)NH2, v=0
  220908.8451  0.0876 -6.7185 3 1199.4167137  71510 303685217      695118        syn-C2H3C(O)NH2, v=0
  220910.9404  0.0037 -4.1618 3  732.1262145  71510 303721954      721855        syn-C2H3C(O)NH2, v=0
  220982.2817  0.0200 -3.7111 3  389.6409109 -71510 303541044      54 945        syn-C2H3C(O)NH2, v=0
  220992.0368  0.0023 -4.6942 3  600.7346129  71510 303642044      632143        syn-C2H3C(O)NH2, v=0
  221085.3549  0.1064 -6.1819 3 1837.0520229  71510 303B43084      B42985        syn-C2H3C(O)NH2, v=0
  221122.0390  0.0010 -5.4891 3  159.4064 61  71510 303301516      291515        syn-C2H3C(O)NH2, v=0
  221122.0398  0.0010 -5.4891 3  159.4064 61  71510 303301515      291514        syn-C2H3C(O)NH2, v=0
  221151.4968  0.0066 -6.3321 3  648.0028145  71510 30372 963      73 866        syn-C2H3C(O)NH2, v=0
  221151.4971  0.0066 -6.3321 3  648.0028145  71510 303721063      73 766        syn-C2H3C(O)NH2, v=0
  221162.6401  0.0200 -3.7104 3  389.6415109 -71510 303541144      541045        syn-C2H3C(O)NH2, v=0
  221168.3932  0.0200 -3.0796 3  130.3472 71 -71510 30335 134      34 233        syn-C2H3C(O)NH2, v=0
  221168.3975  0.0008 -5.2443 3  130.3472 71  71510 30335 234      34 233        syn-C2H3C(O)NH2, v=0
  221168.3976  0.0008 -5.2443 3  130.3472 71  71510 30335 134      34 133        syn-C2H3C(O)NH2, v=0
  221168.3932  0.0200 -3.0796 3  130.3472 71 -71510 30335 234      34 133        syn-C2H3C(O)NH2, v=0
  221173.7331  0.0009 -5.2284 3  130.8676 73  71510 30336 036      35 035        syn-C2H3C(O)NH2, v=0
  221173.7308  0.0200 -3.0334 3  130.8676 73 -71510 30336 036      35 135        syn-C2H3C(O)NH2, v=0
  221173.7308  0.0200 -3.0334 3  130.8676 73 -71510 30336 136      35 035        syn-C2H3C(O)NH2, v=0
  221173.7331  0.0009 -5.2284 3  130.8676 73  71510 30336 136      35 135        syn-C2H3C(O)NH2, v=0
  221184.5238  0.0200 -3.1313 3  129.3083 69 -71510 30334 232      33 331        syn-C2H3C(O)NH2, v=0
  221184.5359  0.0008 -5.2594 3  129.3083 69  71510 30334 332      33 331        syn-C2H3C(O)NH2, v=0
  221184.5443  0.0008 -5.2594 3  129.3083 69  71510 30334 232      33 231        syn-C2H3C(O)NH2, v=0
  221184.5238  0.0200 -3.1313 3  129.3083 69 -71510 30334 332      33 231        syn-C2H3C(O)NH2, v=0
  221232.9886  0.0014 -6.2355 3    9.5218 19  71510 303 9 5 4       8 2 7        syn-C2H3C(O)NH2, v=0
  221254.1641  0.0200 -3.1908 3  127.7300 67 -71510 30333 330      32 429        syn-C2H3C(O)NH2, v=0
  221254.6687  0.0008 -5.2734 3  127.7300 67  71510 30333 430      32 429        syn-C2H3C(O)NH2, v=0
  221255.1560  0.0008 -5.2734 3  127.7300 67  71510 30333 330      32 329        syn-C2H3C(O)NH2, v=0
  221255.6792  0.0200 -3.1907 3  127.7300 67 -71510 30333 430      32 329        syn-C2H3C(O)NH2, v=0
  221299.9780  0.0200 -3.3589 3  122.8095 63 -71510 30331 526      30 625        syn-C2H3C(O)NH2, v=0
  221306.9648  0.0059 -4.8540 3  517.4781123  71510 303611547      601644        syn-C2H3C(O)NH2, v=0
  221313.8544  0.0201 -6.1800 3  663.3295 95  71510 3034741 6      4840 9        syn-C2H3C(O)NH2, v=0
  221313.8544  0.0201 -6.1800 3  663.3295 95  71510 3034741 7      4840 8        syn-C2H3C(O)NH2, v=0
  221358.0830  0.0499 -6.3176 3 1438.8583193  71510 303963660      953759        syn-C2H3C(O)NH2, v=0
  221358.0830  0.0499 -6.3176 3 1438.8583193  71510 303963661      953758        syn-C2H3C(O)NH2, v=0
  221396.9263  0.0200 -3.7242 3  448.8717111 -71510 303551838      551739        syn-C2H3C(O)NH2, v=0
  221415.2734  0.0200 -3.6754 3  265.2777 93 -71510 30346 640      46 541        syn-C2H3C(O)NH2, v=0
  221416.1731  0.0200 -3.6754 3  265.2777 93 -71510 30346 740      46 641        syn-C2H3C(O)NH2, v=0
  221422.0884  0.0200 -3.2625 3  125.5798 65 -71510 30332 428      31 527        syn-C2H3C(O)NH2, v=0
  221442.0150  0.0009 -5.2861 3  125.5798 65  71510 30332 528      31 527        syn-C2H3C(O)NH2, v=0
  221451.9456  0.0046 -4.7984 3   85.4481 51  71510 30325 718      25 421        syn-C2H3C(O)NH2, v=0
  221454.6809  0.0030 -4.5889 3  101.7066 55  71510 30327 819      27 522        syn-C2H3C(O)NH2, v=0
  221458.9470  0.0009 -5.2860 3  125.5785 65  71510 30332 428      31 427        syn-C2H3C(O)NH2, v=0
  221478.9071  0.0200 -3.2623 3  125.5785 65 -71510 30332 528      31 427        syn-C2H3C(O)NH2, v=0
  221517.8992  0.0020 -4.6195 3  560.5937125  71510 303621944      612041        syn-C2H3C(O)NH2, v=0
  221553.2292  0.0197 -4.5636 3  961.9915165  71510 303822359      822260        syn-C2H3C(O)NH2, v=0
  221561.0627  0.0009 -5.3087 3  119.4174 61  71510 30330 724      29 723        syn-C2H3C(O)NH2, v=0
  221597.2591  0.0010 -5.4549 3  152.6604 61  71510 303301417      291416        syn-C2H3C(O)NH2, v=0
  221597.2777  0.0010 -5.4549 3  152.6604 61  71510 303301416      291415        syn-C2H3C(O)NH2, v=0
  221650.9968  0.0126 -6.6249 3  747.5525143  71510 303712349      722052        syn-C2H3C(O)NH2, v=0
  221669.3676  0.0780 -6.6353 3 1142.4703133  71510 303665115      675018        syn-C2H3C(O)NH2, v=0
  221669.3676  0.0780 -6.6353 3 1142.4703133  71510 303665116      675017        syn-C2H3C(O)NH2, v=0
  221729.7099  0.0200 -3.5599 3  303.8484 89 -71510 303441727      441628        syn-C2H3C(O)NH2, v=0
  221740.0476  0.0200 -3.5599 3  303.8480 89 -71510 303441728      441629        syn-C2H3C(O)NH2, v=0
  221784.4753  0.0009 -5.2968 3  122.8095 63  71510 30331 626      30 625        syn-C2H3C(O)NH2, v=0
  221853.0432  0.0572 -6.4440 3 1503.4103197  71510 303983761      973860        syn-C2H3C(O)NH2, v=0
  221853.0432  0.0572 -6.4440 3 1503.4103197  71510 303983762      973859        syn-C2H3C(O)NH2, v=0
  221857.3848  0.0017 -3.8406 3  510.6102123  71510 303611448      611349        syn-C2H3C(O)NH2, v=0
  221864.4629  0.0200 -3.9188 3  564.6773129 -71510 303641450      641351        syn-C2H3C(O)NH2, v=0
  221978.1982  0.0172 -6.1971 3  621.6474 91  71510 3034540 5      4639 8        syn-C2H3C(O)NH2, v=0
  221978.1982  0.0172 -6.1971 3  621.6474 91  71510 3034540 6      4639 7        syn-C2H3C(O)NH2, v=0
  222022.8341  0.0200 -3.6855 3  356.7007105 -71510 30352 943      52 844        syn-C2H3C(O)NH2, v=0
  222053.6384  0.0055 -6.4601 3  242.0054 93  71510 30346 343      47 246        syn-C2H3C(O)NH2, v=0
  222053.6385  0.0055 -6.4601 3  242.0054 93  71510 30346 443      47 146        syn-C2H3C(O)NH2, v=0
  222077.1679  0.0200 -3.6853 3  356.7009105 -71510 303521043      52 944        syn-C2H3C(O)NH2, v=0
  222121.8276  0.0200 -3.3984 3   35.2114 25 -71510 3031210 2      11 9 3        syn-C2H3C(O)NH2, v=0
  222121.8276  0.0200 -3.3984 3   35.2114 25 -71510 3031210 3      11 9 2        syn-C2H3C(O)NH2, v=0
  222131.7938  0.0009 -5.2953 3  122.7818 63  71510 30331 526      30 525        syn-C2H3C(O)NH2, v=0
  222146.3898  0.0200 -3.6662 3  294.5069 97 -71510 30348 741      48 642        syn-C2H3C(O)NH2, v=0
  222150.1271  0.0200 -3.6662 3  294.5069 97 -71510 30348 841      48 742        syn-C2H3C(O)NH2, v=0
  222190.8973  0.0200 -3.9055 3  576.4857127 -71510 303631945      631846        syn-C2H3C(O)NH2, v=0
  222193.5157  0.0030 -3.9995 3  212.2827 79  71510 303391029      381128        syn-C2H3C(O)NH2, v=0
  222196.9081  0.0010 -5.4232 3  146.4136 61  71510 303301318      291317        syn-C2H3C(O)NH2, v=0
  222197.2726  0.0010 -5.4232 3  146.4136 61  71510 303301317      291316        syn-C2H3C(O)NH2, v=0
  222280.6435  0.0032 -6.1872 3  408.2748105  71510 303521834      531539        syn-C2H3C(O)NH2, v=0
  222371.3584  0.0653 -6.5734 3 1569.3861201  71510 303A03862      993961        syn-C2H3C(O)NH2, v=0
  222371.3584  0.0653 -6.5734 3 1569.3861201  71510 303A03863      993960        syn-C2H3C(O)NH2, v=0
  222373.0575  0.0200 -3.6702 3  324.9852101 -71510 30350 842      50 743        syn-C2H3C(O)NH2, v=0
  222379.8201  0.0028 -6.1843 3  237.2316 79  71510 303391525      401228        syn-C2H3C(O)NH2, v=0
  222388.0388  0.0200 -3.6702 3  324.9852101 -71510 30350 942      50 843        syn-C2H3C(O)NH2, v=0
  222394.6553  0.0172 -6.7449 3  850.3775153  71510 303762452      772157        syn-C2H3C(O)NH2, v=0
  222421.1922  0.0692 -6.5579 3 1086.9510129  71510 303645014      654917        syn-C2H3C(O)NH2, v=0
  222421.1922  0.0692 -6.5579 3 1086.9510129  71510 303645015      654916        syn-C2H3C(O)NH2, v=0
  222469.5560  0.0019 -4.5475 3  521.9047121  71510 303601843      591940        syn-C2H3C(O)NH2, v=0
  222474.0360  0.0200 -3.4481 3   37.3213 29 -71510 30314 9 6      13 8 5        syn-C2H3C(O)NH2, v=0
  222474.0360  0.0200 -3.4481 3   37.3213 29 -71510 30314 9 5      13 8 6        syn-C2H3C(O)NH2, v=0
  222478.5438  0.0200 -3.5075 3   40.9531 33 -71510 30316 8 9      15 7 8        syn-C2H3C(O)NH2, v=0
  222482.9732  0.0021 -4.6156 3  560.5917125  71510 303621943      612042        syn-C2H3C(O)NH2, v=0
  222521.0152  0.0200 -3.5074 3   40.9518 33 -71510 30316 8 8      15 7 9        syn-C2H3C(O)NH2, v=0
  222544.6774  0.0011 -4.9564 3   20.8362 27  71510 30313 5 9      12 210        syn-C2H3C(O)NH2, v=0
  222616.2612  0.0200 -3.3534 3  122.7818 63 -71510 30331 626      30 525        syn-C2H3C(O)NH2, v=0
  222632.0947  0.0147 -6.2375 3  581.4021 87  71510 3034339 4      4438 7        syn-C2H3C(O)NH2, v=0
  222632.0947  0.0147 -6.2375 3  581.4021 87  71510 3034339 5      4438 6        syn-C2H3C(O)NH2, v=0
  222687.2257  0.0200 -3.5971 3   46.1714 37 -71510 30318 711      17 612        syn-C2H3C(O)NH2, v=0
  222726.5226  0.0025 -3.7792 3  158.3887 69  71510 30334 826      33 925        syn-C2H3C(O)NH2, v=0
  222731.7600  0.0200 -3.8215 3  193.9851 83 -71510 30341 338      41 239        syn-C2H3C(O)NH2, v=0
  222731.7600  0.0200 -3.8215 3  193.9851 83 -71510 30341 438      41 339        syn-C2H3C(O)NH2, v=0
  222744.0800  0.0200 -3.6351 3  138.2585 65 -71510 30332 725      31 824        syn-C2H3C(O)NH2, v=0
  222865.2443  0.0200 -3.5485 3  292.8907 87 -71510 303431726      431627        syn-C2H3C(O)NH2, v=0
  222870.3516  0.0200 -3.5485 3  292.8905 87 -71510 303431727      431628        syn-C2H3C(O)NH2, v=0
  222911.1388  0.0742 -6.7058 3 1636.7846205  71510 303A23963      A14062        syn-C2H3C(O)NH2, v=0
  222911.1388  0.0742 -6.7058 3 1636.7846205  71510 303A23964      A14061        syn-C2H3C(O)NH2, v=0
  222922.4210  0.0026 -4.2753 3  356.1014101  71510 303501436      491535        syn-C2H3C(O)NH2, v=0
  222927.9313  0.0925 -5.3931 3 1420.0971201  71510 303A02773      A02674        syn-C2H3C(O)NH2, v=0
  222932.2876  0.0200 -4.1936 3  742.5468147 -71510 303731756      731657        syn-C2H3C(O)NH2, v=0
  222958.3089  0.0200 -3.7022 3  435.0296109 -71510 303541836      541737        syn-C2H3C(O)NH2, v=0
  222961.7486  0.0023 -3.9666 3  604.8250133  71510 303661651      661552        syn-C2H3C(O)NH2, v=0
  222974.3676  0.0010 -5.3937 3  140.6764 61  71510 303301219      291218        syn-C2H3C(O)NH2, v=0
  222980.0722  0.0010 -5.3936 3  140.6766 61  71510 303301218      291217        syn-C2H3C(O)NH2, v=0
  222992.0994  0.0017 -4.4270 3  448.9085113  71510 303561641      551738        syn-C2H3C(O)NH2, v=0
  223046.7787  0.0020 -6.2911 3   23.1770 25  71510 30312 7 5      12 4 8        syn-C2H3C(O)NH2, v=0
  223067.1381  0.0085 -5.0817 3  604.8214133  71510 303661651      651748        syn-C2H3C(O)NH2, v=0
  223076.0562  0.0488 -4.9508 3 1179.8972183  71510 303912566      912467        syn-C2H3C(O)NH2, v=0
  223109.1731  0.0040 -6.1856 3  421.5819119  71510 30359 653      60 556        syn-C2H3C(O)NH2, v=0
  223109.1732  0.0040 -6.1856 3  421.5819119  71510 30359 753      60 456        syn-C2H3C(O)NH2, v=0
  223164.1968  0.0612 -6.4868 3 1032.8597125  71510 303624913      634816        syn-C2H3C(O)NH2, v=0
  223164.1968  0.0612 -6.4868 3 1032.8597125  71510 303624914      634815        syn-C2H3C(O)NH2, v=0
  223172.6164  0.0018 -4.4819 3  484.6734117  71510 303581742      571839        syn-C2H3C(O)NH2, v=0
  223180.5840  0.0778 -5.0207 3 1215.0628187  71510 303932370      932271        syn-C2H3C(O)NH2, v=0
  223227.3427  0.0262 -6.7206 3  940.7680173  71510 303861274      871177        syn-C2H3C(O)NH2, v=0
  223227.3429  0.0262 -6.7206 3  940.7680173  71510 303861374      871077        syn-C2H3C(O)NH2, v=0
  223275.2915  0.0126 -6.3101 3  542.5943 83  71510 3034138 3      4237 6        syn-C2H3C(O)NH2, v=0
  223275.2915  0.0126 -6.3101 3  542.5943 83  71510 3034138 4      4237 5        syn-C2H3C(O)NH2, v=0
  223313.5390  0.0110 -6.6139 3  765.5723145  71510 303722349      732054        syn-C2H3C(O)NH2, v=0
  223322.4694  0.0036 -6.2393 3  470.8262113  71510 303561937      571642        syn-C2H3C(O)NH2, v=0
  223358.5209  0.0027 -5.5575 3   38.7210 35  71510 30317 612      17 315        syn-C2H3C(O)NH2, v=0
  223396.7537  0.1327 -5.8830 3 1682.5029219  71510 303A92980      A92881        syn-C2H3C(O)NH2, v=0
  223461.4937  0.0030 -3.9987 3  621.3691135  71510 303671552      671453        syn-C2H3C(O)NH2, v=0
  223497.4015  0.0200 -3.7936 3  473.4464119 -71510 303591247      591148        syn-C2H3C(O)NH2, v=0
  223519.6423  0.0200 -3.7001 3  435.0084109 -71510 303541837      541738        syn-C2H3C(O)NH2, v=0
  223540.8655  0.0506 -6.4831 3 1998.3137239  71510 303B93188      B93089        syn-C2H3C(O)NH2, v=0
  223559.8971  0.0026 -4.0234 3  650.6830135  71510 303672047      671948        syn-C2H3C(O)NH2, v=0
  223562.4711  0.0079 -6.5077 3  668.1655135  71510 303672246      681949        syn-C2H3C(O)NH2, v=0
  223567.2049  0.0200 -3.4742 3  126.8078 63 -71510 30331 625      30 724        syn-C2H3C(O)NH2, v=0
  223715.8674  0.0029 -4.2078 3  153.6063 77  71510 30338 137      38 038        syn-C2H3C(O)NH2, v=0
  223715.8674  0.0029 -4.2078 3  153.6063 77  71510 30338 237      38 138        syn-C2H3C(O)NH2, v=0
  223880.7254  0.0047 -4.0902 3  680.6626141  71510 303701654      701555        syn-C2H3C(O)NH2, v=0
  223888.4922  0.0071 -6.4972 3  685.2110137  71510 303682246      691951        syn-C2H3C(O)NH2, v=0
  223898.2500  0.0540 -6.4224 3  980.1977121  71510 303604812      614715        syn-C2H3C(O)NH2, v=0
  223898.2500  0.0540 -6.4224 3  980.1977121  71510 303604813      614714        syn-C2H3C(O)NH2, v=0
  223906.1191  0.0200 -3.5385 3  282.1963 85 -71510 303421725      421626        syn-C2H3C(O)NH2, v=0
  223907.5213  0.0108 -6.4305 3  505.2246 79  71510 3033937 2      4036 5        syn-C2H3C(O)NH2, v=0
  223907.5213  0.0108 -6.4305 3  505.2246 79  71510 3033937 3      4036 4        syn-C2H3C(O)NH2, v=0
  223908.5180  0.0200 -3.5385 3  282.1962 85 -71510 303421726      421627        syn-C2H3C(O)NH2, v=0
  223918.2483  0.0041 -6.3091 3  537.8347121  71510 303602040      611745        syn-C2H3C(O)NH2, v=0
  224002.2925  0.0010 -5.3658 3  135.4649 61  71510 303301120      291119        syn-C2H3C(O)NH2, v=0
  224065.5697  0.0200 -3.8551 3  544.8893123 -71510 303611942      611843        syn-C2H3C(O)NH2, v=0
  224071.8750  0.0010 -5.3656 3  135.4671 61  71510 303301119      291118        syn-C2H3C(O)NH2, v=0
  224074.8088  0.0029 -4.1607 3  739.4950145  71510 303722053      721954        syn-C2H3C(O)NH2, v=0
  224098.0230  0.0050 -6.3954 3  609.2973129  71510 303642143      651848        syn-C2H3C(O)NH2, v=0
  224136.2952  0.0031 -6.4917 3  112.4350 53  71510 303261215      27 918        syn-C2H3C(O)NH2, v=0
  224167.8979  0.0107 -6.4467 3  745.5200155  71510 303771067      78 970        syn-C2H3C(O)NH2, v=0
  224167.8981  0.0107 -6.4467 3  745.5200155  71510 303771167      78 870        syn-C2H3C(O)NH2, v=0
  224176.9713  0.0048 -6.2599 3  572.4402137  71510 30368 860      69 763        syn-C2H3C(O)NH2, v=0
  224176.9715  0.0048 -6.2599 3  572.4402137  71510 30368 960      69 663        syn-C2H3C(O)NH2, v=0
  224235.7387  0.1940 -6.6561 3 1329.1247197  71510 303982376      972473        syn-C2H3C(O)NH2, v=0
  224344.5901  0.0028 -6.1666 3  285.4072 87  71510 303431628      441331        syn-C2H3C(O)NH2, v=0
  224374.4894  0.0033 -4.1913 3  758.0880147  71510 303732054      731955        syn-C2H3C(O)NH2, v=0
  224461.3930  0.0200 -3.7900 3  473.4508119 -71510 303591347      591248        syn-C2H3C(O)NH2, v=0
  224528.5019  0.0093 -6.6321 3  469.2938 75  71510 3033736 1      3835 4        syn-C2H3C(O)NH2, v=0
  224528.5019  0.0093 -6.6321 3  469.2938 75  71510 3033736 2      3835 3        syn-C2H3C(O)NH2, v=0
  224588.9760  0.0026 -4.1286 3  721.1459143  71510 303712052      711953        syn-C2H3C(O)NH2, v=0
  224623.2109  0.0475 -6.3653 3  928.9657117  71510 303584711      594614        syn-C2H3C(O)NH2, v=0
  224623.2109  0.0475 -6.3653 3  928.9657117  71510 303584712      594613        syn-C2H3C(O)NH2, v=0
  224624.7631  0.0102 -4.3594 3  851.3160155  71510 303772255      772156        syn-C2H3C(O)NH2, v=0
  224656.8942  0.0200 -3.8742 3  560.4890125 -71510 303621944      621845        syn-C2H3C(O)NH2, v=0
  224704.4982  0.1285 -5.3669 3 1406.1969201  71510 303A02575      A02476        syn-C2H3C(O)NH2, v=0
  224750.6421  0.0200 -3.7438 3  220.0084 87 -71510 30343 439      43 340        syn-C2H3C(O)NH2, v=0
  224750.6421  0.0200 -3.7438 3  220.0084 87 -71510 30343 539      43 440        syn-C2H3C(O)NH2, v=0
  224808.8328  0.2059 -6.3474 3 1928.4041235  71510 303B73087      B72988        syn-C2H3C(O)NH2, v=0
  224831.9189  0.0020 -4.5379 3  521.8991121  71510 303601842      591941        syn-C2H3C(O)NH2, v=0
  224860.7705  0.0200 -3.5298 3  271.7638 83 -71510 303411724      411625        syn-C2H3C(O)NH2, v=0
  224861.9006  0.0200 -3.5298 3  271.7638 83 -71510 303411725      411626        syn-C2H3C(O)NH2, v=0
  224884.5285  0.0026 -6.2134 3  193.3497 71  71510 303351421      361126        syn-C2H3C(O)NH2, v=0
  224886.4697  0.0200 -4.1824 3  750.5866147 -71510 303731955      731856        syn-C2H3C(O)NH2, v=0
  224903.4655  0.0200 -3.6020 3   50.8090 39 -71510 30319 713      18 612        syn-C2H3C(O)NH2, v=0
  224924.7289  0.0200 -4.1139 3  706.3761143 -71510 303711854      711755        syn-C2H3C(O)NH2, v=0
  225011.6710  0.0056 -6.4061 3  593.2290127  71510 303632143      641846        syn-C2H3C(O)NH2, v=0
  225023.7221  0.0021 -4.8199 3   22.0797 29  71510 30314 411      13 112        syn-C2H3C(O)NH2, v=0
  225043.4598  0.0009 -5.2930 3  119.0762 61  71510 30330 624      29 623        syn-C2H3C(O)NH2, v=0
  225044.0917  0.0041 -6.4481 3   25.7497 31  71510 30315 412      15 115        syn-C2H3C(O)NH2, v=0
  225080.3662  0.0386 -5.7306 3  886.9018161  71510 303801962      792059        syn-C2H3C(O)NH2, v=0
  225159.4278  0.1335 -6.5397 3 2029.8132241  71510 303C03189      C03090        syn-C2H3C(O)NH2, v=0
  225175.6850  0.0043 -6.2125 3  360.5380111  71510 30355 550      56 453        syn-C2H3C(O)NH2, v=0
  225175.6851  0.0043 -6.2125 3  360.5380111  71510 30355 650      56 353        syn-C2H3C(O)NH2, v=0
  225193.0148  0.0200 -3.6784 3  421.4317107 -71510 303531835      531736        syn-C2H3C(O)NH2, v=0
  225273.3246  0.0010 -5.3397 3  130.8001 61  71510 303301021      291020        syn-C2H3C(O)NH2, v=0
  225290.0312  0.0049 -4.1790 3  747.5525145  71510 303722151      722052        syn-C2H3C(O)NH2, v=0
  225338.9284  0.0416 -6.3164 3  879.1649113  71510 303564610      574513        syn-C2H3C(O)NH2, v=0
  225338.9284  0.0416 -6.3164 3  879.1649113  71510 303564611      574512        syn-C2H3C(O)NH2, v=0
  225360.9321  0.0009 -5.3059 3  122.9906 61  71510 30330 823      29 822        syn-C2H3C(O)NH2, v=0
  225477.9275  0.0091 -6.5032 3  459.1435115  71510 303571542      581247        syn-C2H3C(O)NH2, v=0
  225512.3349  0.0200 -3.6772 3  421.4197107 -71510 303531836      531737        syn-C2H3C(O)NH2, v=0
  225581.6157  0.0200 -4.2201 3  776.9164149 -71510 303742055      741956        syn-C2H3C(O)NH2, v=0
  225643.6120  0.0031 -6.1739 3  338.0483 95  71510 303471731      481434        syn-C2H3C(O)NH2, v=0
  225736.5213  0.0007 -3.5224 3  261.5921 81  71510 303401723      401624        syn-C2H3C(O)NH2, v=0
  225737.0431  0.0007 -3.5224 3  261.5921 81  71510 303401724      401625        syn-C2H3C(O)NH2, v=0
  225793.7749  0.0200 -4.0953 3  703.0488141 -71510 303702051      701952        syn-C2H3C(O)NH2, v=0
  225902.2367  0.0010 -5.3373 3  130.8244 61  71510 303301020      291019        syn-C2H3C(O)NH2, v=0
  225938.9443  0.0952 -6.1716 3 1096.9668179  71510 303892169      882266        syn-C2H3C(O)NH2, v=0
  225973.6888  0.0047 -6.3208 3  522.7461119  71510 303592040      601743        syn-C2H3C(O)NH2, v=0
  226023.0110  0.0030 -6.4855 3  112.3721 53  71510 303261214      27 919        syn-C2H3C(O)NH2, v=0
  226026.8747  0.0200 -3.9035 3  564.7012129 -71510 303641550      641451        syn-C2H3C(O)NH2, v=0
  226027.3636  0.1878 -5.7446 3 1611.0078215  71510 303A72780      A72681        syn-C2H3C(O)NH2, v=0
  226045.2406  0.0363 -6.2766 3  830.7961109  71510 3035445 9      554412        syn-C2H3C(O)NH2, v=0
  226045.2406  0.0363 -6.2766 3  830.7961109  71510 303544510      554411        syn-C2H3C(O)NH2, v=0
  226067.5196  0.0017 -6.5515 3  311.6706 63  71510 3033129 2      3029 1        syn-C2H3C(O)NH2, v=0
  226067.5196  0.0017 -6.5515 3  311.6706 63  71510 3033129 3      3029 2        syn-C2H3C(O)NH2, v=0
  226147.7496  0.0016 -6.3544 3  298.2297 63  71510 3033128 3      3028 2        syn-C2H3C(O)NH2, v=0
  226147.7496  0.0016 -6.3544 3  298.2297 63  71510 3033128 4      3028 3        syn-C2H3C(O)NH2, v=0
  226159.2462  0.0200 -3.7482 3  437.4767115 -71510 303571146      571047        syn-C2H3C(O)NH2, v=0
  226233.7952  0.0009 -5.3176 3  126.6813 61  71510 30330 922      29 921        syn-C2H3C(O)NH2, v=0
  226234.7082  0.0016 -6.2096 3  285.2617 63  71510 3033127 4      3027 3        syn-C2H3C(O)NH2, v=0
  226234.7082  0.0016 -6.2096 3  285.2617 63  71510 3033127 5      3027 4        syn-C2H3C(O)NH2, v=0
  226254.4738  0.0292 -4.5636 3  964.6694167  71510 303832063      831964        syn-C2H3C(O)NH2, v=0
  226322.5015  0.0036 -6.2033 3  395.1532103  71510 303511834      521537        syn-C2H3C(O)NH2, v=0
  226329.5529  0.0015 -6.0938 3  272.7670 63  71510 3033126 5      3026 4        syn-C2H3C(O)NH2, v=0
  226329.5529  0.0015 -6.0938 3  272.7670 63  71510 3033126 6      3026 5        syn-C2H3C(O)NH2, v=0
  226398.6656  0.0200 -3.6979 3  247.3138 91 -71510 30345 540      45 441        syn-C2H3C(O)NH2, v=0
  226398.6656  0.0200 -3.6979 3  247.3138 91 -71510 30345 640      45 541        syn-C2H3C(O)NH2, v=0
  226420.9199  0.0041 -6.2528 3  456.7200111  71510 303551937      561640        syn-C2H3C(O)NH2, v=0
  226424.5898  0.0026 -3.9481 3  177.6412 81  71510 30340 238      40 139        syn-C2H3C(O)NH2, v=0
  226424.5899  0.0026 -3.9481 3  177.6412 81  71510 30340 338      40 239        syn-C2H3C(O)NH2, v=0
  226433.6823  0.0014 -5.9969 3  260.7461 63  71510 3033125 6      3025 5        syn-C2H3C(O)NH2, v=0
  226433.6823  0.0014 -5.9969 3  260.7461 63  71510 3033125 7      3025 6        syn-C2H3C(O)NH2, v=0
  226492.0134  0.0200 -3.7470 3  437.4780115 -71510 303571246      571147        syn-C2H3C(O)NH2, v=0
  226539.8435  0.0200 -3.5165 3  251.6801 79 -71510 303391722      391623        syn-C2H3C(O)NH2, v=0
  226539.8435  0.0200 -3.5164 3  251.6801 79 -71510 303391723      391624        syn-C2H3C(O)NH2, v=0
  226543.3569  0.0011 -5.3004 3  116.3395 59  71510 30329 821      28 820        syn-C2H3C(O)NH2, v=0
  226548.7997  0.0014 -5.9133 3  249.1995 63  71510 3033124 7      3024 6        syn-C2H3C(O)NH2, v=0
  226548.7997  0.0014 -5.9133 3  249.1995 63  71510 3033124 8      3024 7        syn-C2H3C(O)NH2, v=0
  226567.3156  0.0018 -3.7921 3   48.0994 39  71510 30319 613      18 514        syn-C2H3C(O)NH2, v=0
  226676.9979  0.0013 -5.8397 3  238.1277 63  71510 3033123 8      3023 7        syn-C2H3C(O)NH2, v=0
  226676.9979  0.0013 -5.8397 3  238.1277 63  71510 3033123 9      3023 8        syn-C2H3C(O)NH2, v=0
  226727.4936  0.0020 -6.5269 3   20.1128 23  71510 30311 7 4      11 4 7        syn-C2H3C(O)NH2, v=0
  226741.9741  0.0316 -6.2472 3  783.8602105  71510 3035244 8      534311        syn-C2H3C(O)NH2, v=0
  226741.9741  0.0316 -6.2472 3  783.8602105  71510 3035244 9      534310        syn-C2H3C(O)NH2, v=0
  226820.8738  0.0012 -5.7741 3  227.5315 63  71510 3033122 9      3022 8        syn-C2H3C(O)NH2, v=0
  226820.8738  0.0012 -5.7741 3  227.5315 63  71510 303312210      3022 9        syn-C2H3C(O)NH2, v=0
  226856.8500  0.0049 -6.2956 3  304.0108103  71510 30351 447      52 350        syn-C2H3C(O)NH2, v=0
  226856.8500  0.0049 -6.2956 3  304.0108103  71510 30351 547      52 250        syn-C2H3C(O)NH2, v=0
  226888.0745  0.0072 -6.4730 3  297.4524 93  71510 303461234      47 939        syn-C2H3C(O)NH2, v=0
  226890.7240  0.0041 -6.2137 3  501.3746129  71510 30364 757      65 660        syn-C2H3C(O)NH2, v=0
  226890.7241  0.0041 -6.2137 3  501.3746129  71510 30364 857      65 560        syn-C2H3C(O)NH2, v=0
  226909.6011  0.0033 -4.7683 3   25.2260 31  71510 30315 312      14 213        syn-C2H3C(O)NH2, v=0
  226956.0038  0.0030 -4.0437 3  663.3192139  71510 303691753      691654        syn-C2H3C(O)NH2, v=0
  226983.6845  0.0012 -5.7149 3  217.4117 63  71510 303312110      3021 9        syn-C2H3C(O)NH2, v=0
  226983.6845  0.0012 -5.7149 3  217.4117 63  71510 303312111      302110        syn-C2H3C(O)NH2, v=0
  226989.0626  0.0178 -6.5850 3  849.7373165  71510 303821171      831074        syn-C2H3C(O)NH2, v=0
  226989.0628  0.0178 -6.5850 3  849.7373165  71510 303821271      83 974        syn-C2H3C(O)NH2, v=0
  227005.6249  0.1273 -6.4140 3 1966.9953237  71510 303B83187      B83088        syn-C2H3C(O)NH2, v=0
  227037.0178  0.0030 -4.0930 3   41.2697 37  71510 30318 513      17 414        syn-C2H3C(O)NH2, v=0
  227159.9903  0.0013 -3.8436 3  544.7686123  71510 303611943      611844        syn-C2H3C(O)NH2, v=0
  227169.5664  0.0011 -5.6611 3  207.7693 63  71510 303312011      302010        syn-C2H3C(O)NH2, v=0
  227169.5664  0.0011 -5.6611 3  207.7693 63  71510 303312012      302011        syn-C2H3C(O)NH2, v=0
  227192.1292  0.0200 -3.6564 3  408.1109105 -71510 303521834      521735        syn-C2H3C(O)NH2, v=0
  227210.6644  0.0056 -5.8485 3   39.7834 37  71510 30318 414      18 117        syn-C2H3C(O)NH2, v=0
  227223.7941  0.0008 -5.2240 3  137.7246 73  71510 30336 135      35 134        syn-C2H3C(O)NH2, v=0
  227223.7657  0.0200 -3.0580 3  137.7246 73 -71510 30336 135      35 234        syn-C2H3C(O)NH2, v=0
  227223.7941  0.0008 -5.2240 3  137.7246 73  71510 30336 235      35 234        syn-C2H3C(O)NH2, v=0
  227223.7657  0.0200 -3.0580 3  137.7246 73 -71510 30336 235      35 134        syn-C2H3C(O)NH2, v=0
  227229.6013  0.0009 -5.2085 3  138.2452 75  71510 30337 037      36 036        syn-C2H3C(O)NH2, v=0
  227229.6030  0.0200 -3.0132 3  138.2452 75 -71510 30337 037      36 136        syn-C2H3C(O)NH2, v=0
  227229.6030  0.0200 -3.0132 3  138.2452 75 -71510 30337 137      36 036        syn-C2H3C(O)NH2, v=0
  227229.6013  0.0009 -5.2085 3  138.2452 75  71510 30337 137      36 136        syn-C2H3C(O)NH2, v=0
  227237.8064  0.0200 -3.1078 3  136.6862 71 -71510 30335 233      34 332        syn-C2H3C(O)NH2, v=0
  227237.8225  0.0008 -5.2386 3  136.6862 71  71510 30335 333      34 332        syn-C2H3C(O)NH2, v=0
  227237.8266  0.0008 -5.2386 3  136.6862 71  71510 30335 233      34 232        syn-C2H3C(O)NH2, v=0
  227237.8064  0.0200 -3.1078 3  136.6862 71 -71510 30335 333      34 232        syn-C2H3C(O)NH2, v=0
  227276.1109  0.0200 -3.5119 3  242.0268 77 -71510 303381721      381622        syn-C2H3C(O)NH2, v=0
  227276.1109  0.0200 -3.5119 3  242.0268 77 -71510 303381722      381623        syn-C2H3C(O)NH2, v=0
  227300.9242  0.0200 -3.1648 3  135.1103 69 -71510 30334 331      33 430        syn-C2H3C(O)NH2, v=0
  227301.2316  0.0008 -5.2522 3  135.1103 69  71510 30334 431      33 430        syn-C2H3C(O)NH2, v=0
  227301.4823  0.0008 -5.2522 3  135.1102 69  71510 30334 331      33 330        syn-C2H3C(O)NH2, v=0
  227301.7590  0.0200 -3.1648 3  135.1102 69 -71510 30334 431      33 330        syn-C2H3C(O)NH2, v=0
  227354.0542  0.0200 -3.8515 3  525.7320125 -71510 303621349      621250        syn-C2H3C(O)NH2, v=0
  227370.1755  0.0009 -3.6557 3  408.1043105  71510 303521835      521736        syn-C2H3C(O)NH2, v=0
  227383.8458  0.0011 -5.6121 3  198.6057 63  71510 303311912      301911        syn-C2H3C(O)NH2, v=0
  227383.8458  0.0011 -5.6121 3  198.6057 63  71510 303311913      301912        syn-C2H3C(O)NH2, v=0
  227428.9439  0.0274 -6.2300 3  738.3581101  71510 3035043 7      514210        syn-C2H3C(O)NH2, v=0
  227428.9439  0.0274 -6.2300 3  738.3581101  71510 3035043 8      5142 9        syn-C2H3C(O)NH2, v=0
  227438.7215  0.0072 -6.3507 3  664.4590147  71510 30373 964      74 867        syn-C2H3C(O)NH2, v=0
  227438.7217  0.0072 -6.3507 3  664.4590147  71510 303731064      74 767        syn-C2H3C(O)NH2, v=0
  227461.2975  0.0200 -3.2327 3  132.9663 67 -71510 30333 429      32 528        syn-C2H3C(O)NH2, v=0
  227471.9754  0.0008 -5.2644 3  132.9663 67  71510 30333 529      32 528        syn-C2H3C(O)NH2, v=0
  227481.2250  0.0008 -5.2644 3  132.9656 67  71510 30333 429      32 428        syn-C2H3C(O)NH2, v=0
  227491.9458  0.0200 -3.2326 3  132.9656 67 -71510 30333 529      32 428        syn-C2H3C(O)NH2, v=0
  227536.7777  0.0200 -3.3211 3  130.2074 65 -71510 30332 527      31 626        syn-C2H3C(O)NH2, v=0
  227548.9101  0.0200 -4.0611 3  685.2110139 -71510 303692050      691951        syn-C2H3C(O)NH2, v=0
  227633.4949  0.0011 -5.5670 3  189.9227 63  71510 303311813      301812        syn-C2H3C(O)NH2, v=0
  227633.4949  0.0011 -5.5670 3  189.9227 63  71510 303311814      301813        syn-C2H3C(O)NH2, v=0
  227643.9147  0.0009 -5.2841 3  114.0699 59  71510 30329 722      28 721        syn-C2H3C(O)NH2, v=0
  227648.0496  0.0014 -3.6736 3  275.8912 95  71510 30347 641      47 542        syn-C2H3C(O)NH2, v=0
  227648.4966  0.0014 -3.6736 3  275.8912 95  71510 30347 741      47 642        syn-C2H3C(O)NH2, v=0
  227733.0074  0.0200 -3.8210 3  529.3987121 -71510 303601941      601842        syn-C2H3C(O)NH2, v=0
  227750.4523  0.0046 -4.2469 3  795.9718151  71510 303752056      751957        syn-C2H3C(O)NH2, v=0
  227770.6708  0.0200 -3.7126 3  402.7059111 -71510 303551045      55 946        syn-C2H3C(O)NH2, v=0
  227814.9760  0.0009 -5.2747 3  130.2074 65  71510 30332 627      31 626        syn-C2H3C(O)NH2, v=0
  227876.7350  0.0200 -3.7123 3  402.7063111 -71510 303551145      551046        syn-C2H3C(O)NH2, v=0
  227881.2870  0.0009 -5.2848 3  126.8078 63  71510 30331 725      30 724        syn-C2H3C(O)NH2, v=0
  227881.5826  0.0124 -5.3077 3  941.5729159  71510 303792753      782850        syn-C2H3C(O)NH2, v=0
  227882.1743  0.0124 -5.3077 3  941.5729159  71510 303792752      782851        syn-C2H3C(O)NH2, v=0
  227915.3601  0.0029 -4.0541 3  247.3863 85  71510 303421131      411230        syn-C2H3C(O)NH2, v=0
  227919.9014  0.0150 -5.4089 3  993.7332163  71510 303812854      802951        syn-C2H3C(O)NH2, v=0
  227920.1046  0.0150 -5.4089 3  993.7332163  71510 303812853      802952        syn-C2H3C(O)NH2, v=0
  227927.8156  0.0010 -5.5256 3  181.7223 63  71510 303311714      301713        syn-C2H3C(O)NH2, v=0
  227927.8156  0.0010 -5.5256 3  181.7223 63  71510 303311715      301714        syn-C2H3C(O)NH2, v=0
  227929.4644  0.0101 -5.2094 3  890.8494155  71510 303772652      762749        syn-C2H3C(O)NH2, v=0
  227931.1652  0.0101 -5.2094 3  890.8494155  71510 303772651      762750        syn-C2H3C(O)NH2, v=0
  227950.6205  0.0200 -3.5088 3  232.6312 75 -71510 303371720      371621        syn-C2H3C(O)NH2, v=0
  227950.6205  0.0200 -3.5088 3  232.6312 75 -71510 303371721      371622        syn-C2H3C(O)NH2, v=0
  228021.2568  0.0009 -5.2739 3  130.1913 65  71510 30332 527      31 526        syn-C2H3C(O)NH2, v=0
  228032.1966  0.0181 -5.5130 3 1047.3290167  71510 303832955      823052        syn-C2H3C(O)NH2, v=0
  228032.2656  0.0181 -5.5130 3 1047.3290167  71510 303832954      823053        syn-C2H3C(O)NH2, v=0
  228078.5731  0.0082 -5.1139 3  841.5644151  71510 303752551      742648        syn-C2H3C(O)NH2, v=0
  228083.3919  0.0082 -5.1139 3  841.5644151  71510 303752550      742649        syn-C2H3C(O)NH2, v=0
  228098.2216  0.2417 -6.1511 3 1829.4435229  71510 303B42985      B42886        syn-C2H3C(O)NH2, v=0
  228105.9523  0.0236 -6.2274 3  694.2907 97  71510 3034842 6      4941 9        syn-C2H3C(O)NH2, v=0
  228105.9523  0.0236 -6.2274 3  694.2907 97  71510 3034842 7      4941 8        syn-C2H3C(O)NH2, v=0
  228121.5223  0.0056 -6.4683 3  252.0078 95  71510 30347 344      48 247        syn-C2H3C(O)NH2, v=0
  228121.5224  0.0056 -6.4683 3  252.0078 95  71510 30347 444      48 147        syn-C2H3C(O)NH2, v=0
  228208.5080  0.0215 -5.6200 3 1102.3591171  71510 303853056      843153        syn-C2H3C(O)NH2, v=0
  228208.5312  0.0215 -5.6200 3 1102.3591171  71510 303853055      843154        syn-C2H3C(O)NH2, v=0
  228279.5083  0.0010 -5.4874 3  174.0074 63  71510 303311616      301615        syn-C2H3C(O)NH2, v=0
  228279.5084  0.0010 -5.4874 3  174.0074 63  71510 303311615      301614        syn-C2H3C(O)NH2, v=0
  228299.4445  0.0200 -3.3181 3  130.1913 65 -71510 30332 627      31 526        syn-C2H3C(O)NH2, v=0
  228315.6080  0.0018 -4.3969 3  428.3469111  71510 303551541      541638        syn-C2H3C(O)NH2, v=0
  228347.2050  0.0065 -5.0214 3  793.7192147  71510 303732450      722547        syn-C2H3C(O)NH2, v=0
  228360.6422  0.0065 -5.0213 3  793.7191147  71510 303732449      722548        syn-C2H3C(O)NH2, v=0
  228433.9297  0.0880 -6.6995 3 1182.6543135  71510 303675215      685118        syn-C2H3C(O)NH2, v=0
  228433.9297  0.0880 -6.6995 3 1182.6543135  71510 303675216      685117        syn-C2H3C(O)NH2, v=0
  228440.6690  0.0255 -5.7300 3 1158.8220175  71510 303873157      863254        syn-C2H3C(O)NH2, v=0
  228440.6767  0.0255 -5.7300 3 1158.8220175  71510 303873156      863255        syn-C2H3C(O)NH2, v=0
  228464.3689  0.0012 -3.6655 3  305.7301 99  71510 30349 742      49 643        syn-C2H3C(O)NH2, v=0
  228466.3888  0.0200 -3.6655 3  305.7302 99 -71510 30349 842      49 743        syn-C2H3C(O)NH2, v=0
  228567.9829  0.0200 -3.5073 3  223.4925 73 -71510 303361719      361620        syn-C2H3C(O)NH2, v=0
  228567.9829  0.0200 -3.5073 3  223.4925 73 -71510 303361720      361621        syn-C2H3C(O)NH2, v=0
  228586.4455  0.0028 -5.2112 3   59.0510 41  71510 30320 812      20 515        syn-C2H3C(O)NH2, v=0
  228601.8581  0.0200 -3.6866 3  369.1492107 -71510 30353 944      53 845        syn-C2H3C(O)NH2, v=0
  228602.6784  0.0299 -4.7113 3 1056.8142173  71510 303862462      862363        syn-C2H3C(O)NH2, v=0
  228604.3072  0.0025 -6.1635 3  237.0241 79  71510 303391524      401229        syn-C2H3C(O)NH2, v=0
  228632.9949  0.0200 -3.6864 3  369.1493107 -71510 303531044      53 945        syn-C2H3C(O)NH2, v=0
  228706.4151  0.0010 -5.4521 3  166.7822 63  71510 303311517      301516        syn-C2H3C(O)NH2, v=0
  228706.4172  0.0010 -5.4521 3  166.7822 63  71510 303311516      301515        syn-C2H3C(O)NH2, v=0
  228714.0717  0.0022 -4.4589 3  484.6588117  71510 303581741      571840        syn-C2H3C(O)NH2, v=0
  228721.9307  0.0299 -5.8429 3 1216.7165179  71510 303893258      883355        syn-C2H3C(O)NH2, v=0
  228721.9332  0.0299 -5.8429 3 1216.7165179  71510 303893257      883356        syn-C2H3C(O)NH2, v=0
  228756.8826  0.0051 -4.9317 3  747.3154143  71510 303712349      702446        syn-C2H3C(O)NH2, v=0
  228772.7890  0.0203 -6.2430 3  651.6586 93  71510 3034641 5      4740 8        syn-C2H3C(O)NH2, v=0
  228772.7890  0.0203 -6.2430 3  651.6586 93  71510 3034641 6      4740 7        syn-C2H3C(O)NH2, v=0
  228792.7185  0.0026 -4.3231 3  401.1482107  71510 303531538      521637        syn-C2H3C(O)NH2, v=0
  228793.6906  0.0051 -4.9315 3  747.3154143  71510 303712348      702447        syn-C2H3C(O)NH2, v=0
  228802.7603  0.0200 -3.6705 3  336.8199103 -71510 30351 843      51 744        syn-C2H3C(O)NH2, v=0
  228811.0537  0.0200 -3.6704 3  336.8200103 -71510 30351 943      51 844        syn-C2H3C(O)NH2, v=0
  228813.1481  0.0023 -3.8169 3  202.9783 85  71510 30342 339      42 240        syn-C2H3C(O)NH2, v=0
  228813.1490  0.0023 -3.8169 3  202.9783 85  71510 30342 439      42 340        syn-C2H3C(O)NH2, v=0
  228913.9188  0.1221 -5.5902 3 1534.7343209  71510 303A42876      A42777        syn-C2H3C(O)NH2, v=0
  228989.3702  0.0017 -3.8456 3  525.7401125  71510 303621449      621350        syn-C2H3C(O)NH2, v=0
  228990.1204  0.0200 -3.3291 3   37.0151 23 -71510 3031111 0      1010 1        syn-C2H3C(O)NH2, v=0
  228990.1204  0.0200 -3.3291 3   37.0151 23 -71510 3031111 1      1010 0        syn-C2H3C(O)NH2, v=0
  228997.2551  0.0200 -3.6359 3  395.0644103 -71510 303511833      511734        syn-C2H3C(O)NH2, v=0
  229046.6703  0.0349 -5.9588 3 1276.0412183  71510 303913359      903456        syn-C2H3C(O)NH2, v=0
  229046.6711  0.0349 -5.9588 3 1276.0412183  71510 303913358      903457        syn-C2H3C(O)NH2, v=0
  229069.1499  0.0200 -3.6053 3   55.6569 41 -71510 30320 714      19 613        syn-C2H3C(O)NH2, v=0
  229094.6368  0.0200 -3.6355 3  395.0608103 -71510 303511834      511735        syn-C2H3C(O)NH2, v=0
  229132.3212  0.0200 -3.5073 3  214.6096 71 -71510 303351718      351619        syn-C2H3C(O)NH2, v=0
  229132.3212  0.0200 -3.5073 3  214.6096 71 -71510 303351719      351620        syn-C2H3C(O)NH2, v=0
  229154.4201  0.0200 -3.9782 3  633.5320133 -71510 303662046      661947        syn-C2H3C(O)NH2, v=0
  229188.4231  0.0784 -6.6204 3 1126.1919131  71510 303655114      665017        syn-C2H3C(O)NH2, v=0
  229188.4231  0.0784 -6.6204 3 1126.1919131  71510 303655115      665016        syn-C2H3C(O)NH2, v=0
  229213.3061  0.1663 -6.1032 3 1807.0048227  71510 303B33083      B32984        syn-C2H3C(O)NH2, v=0
  229234.5206  0.0010 -5.4193 3  160.0521 63  71510 303311418      301417        syn-C2H3C(O)NH2, v=0
  229234.5677  0.0010 -5.4193 3  160.0521 63  71510 303311417      301416        syn-C2H3C(O)NH2, v=0
  229272.9237  0.0041 -6.1990 3  434.8123121  71510 30360 654      61 557        syn-C2H3C(O)NH2, v=0
  229272.9238  0.0041 -6.1990 3  434.8123121  71510 30360 754      61 457        syn-C2H3C(O)NH2, v=0
  229321.1491  0.0030 -6.3481 3  146.1760 61  71510 303301318      311021        syn-C2H3C(O)NH2, v=0
  229330.6225  0.0040 -4.8448 3  702.3550139  71510 303692248      682345        syn-C2H3C(O)NH2, v=0
  229406.5142  0.0200 -3.3768 3   38.1406 27 -71510 3031310 4      12 9 3        syn-C2H3C(O)NH2, v=0
  229406.5142  0.0200 -3.3768 3   38.1406 27 -71510 3031310 3      12 9 4        syn-C2H3C(O)NH2, v=0
  229410.1670  0.0404 -6.0776 3 1336.7949187  71510 303933460      923557        syn-C2H3C(O)NH2, v=0
  229410.1672  0.0404 -6.0776 3 1336.7949187  71510 303933459      923558        syn-C2H3C(O)NH2, v=0
  229429.2302  0.0175 -6.2819 3  610.4627 89  71510 3034440 4      4539 7        syn-C2H3C(O)NH2, v=0
  229429.2302  0.0175 -6.2819 3  610.4627 89  71510 3034440 5      4539 6        syn-C2H3C(O)NH2, v=0
  229429.4481  0.0041 -4.8444 3  702.3548139  71510 303692247      682346        syn-C2H3C(O)NH2, v=0
  229469.8671  0.0020 -3.5477 3  104.5880 57  71510 30328 722      27 621        syn-C2H3C(O)NH2, v=0
  229488.7327  0.0684 -5.1239 3 1284.6394191  71510 303952669      952570        syn-C2H3C(O)NH2, v=0
  229510.1081  0.0200 -3.4896 3   44.9084 35 -71510 30317 810      16 7 9        syn-C2H3C(O)NH2, v=0
  229516.2530  0.0057 -5.0988 3   70.3695 47  71510 30323 617      23 320        syn-C2H3C(O)NH2, v=0
  229616.4951  0.0200 -3.4892 3   44.9052 35 -71510 30317 8 9      16 710        syn-C2H3C(O)NH2, v=0
  229629.5825  0.0200 -3.8141 3  529.3255121 -71510 303601942      601843        syn-C2H3C(O)NH2, v=0
  229647.5758  0.0200 -3.5090 3  205.9819 69 -71510 303341717      341618        syn-C2H3C(O)NH2, v=0
  229647.5758  0.0200 -3.5090 3  205.9819 69 -71510 303341718      341619        syn-C2H3C(O)NH2, v=0
  229707.4799  0.0010 -3.4267 3   40.7542 31  71510 30315 9 7      14 8 6        syn-C2H3C(O)NH2, v=0
  229708.0009  0.0010 -3.4267 3   40.7541 31  71510 30315 9 6      14 8 7        syn-C2H3C(O)NH2, v=0
  229710.0524  0.0020 -4.0267 3  667.6390137  71510 303682049      681950        syn-C2H3C(O)NH2, v=0
  229716.1644  0.0200 -4.2015 3  769.2539149 -71510 303741956      741857        syn-C2H3C(O)NH2, v=0
  229727.3902  0.0018 -6.0882 3   26.1464 27  71510 30313 7 7      13 410        syn-C2H3C(O)NH2, v=0
  229741.4214  0.0602 -6.7270 3 2133.6838247  71510 303C33291      C33192        syn-C2H3C(O)NH2, v=0
  229763.8095  0.0030 -4.2014 3  161.5898 79  71510 30339 138      39 039        syn-C2H3C(O)NH2, v=0
  229763.8095  0.0030 -4.2014 3  161.5898 79  71510 30339 238      39 139        syn-C2H3C(O)NH2, v=0
  229808.4284  0.0467 -6.1994 3 1398.9763191  71510 303953561      943658        syn-C2H3C(O)NH2, v=0
  229808.4285  0.0467 -6.1994 3 1398.9763191  71510 303953560      943659        syn-C2H3C(O)NH2, v=0
  229875.6998  0.0022 -3.5824 3   97.6203 55  71510 30327 721      26 620        syn-C2H3C(O)NH2, v=0
  229881.9175  0.0018 -5.9127 3   29.5856 29  71510 30314 7 8      14 411        syn-C2H3C(O)NH2, v=0
  229903.2948  0.0010 -5.3887 3  153.8253 63  71510 303311319      301318        syn-C2H3C(O)NH2, v=0
  229904.1375  0.0010 -5.3887 3  153.8253 63  71510 303311318      301317        syn-C2H3C(O)NH2, v=0
  229920.3623  0.0011 -5.3034 3  126.8735 61  71510 30330 921      29 920        syn-C2H3C(O)NH2, v=0
  229934.0629  0.0696 -6.5476 3 1071.1568127  71510 303635013      644916        syn-C2H3C(O)NH2, v=0
  229934.0629  0.0696 -6.5476 3 1071.1568127  71510 303635014      644915        syn-C2H3C(O)NH2, v=0
  229990.3335  0.0023 -3.9751 3  621.4104135  71510 303671652      671553        syn-C2H3C(O)NH2, v=0
  230033.3514  0.0019 -6.2901 3   22.9439 25  71510 30312 7 6      12 4 9        syn-C2H3C(O)NH2, v=0
  230044.6269  0.0597 -4.8582 3 1136.1429181  71510 303902268      902169        syn-C2H3C(O)NH2, v=0
  230058.1912  0.0200 -3.5085 3  111.7434 59 -71510 30329 723      28 622        syn-C2H3C(O)NH2, v=0
  230075.0390  0.0150 -6.3530 3  570.7038 85  71510 3034239 3      4338 6        syn-C2H3C(O)NH2, v=0
  230075.0390  0.0150 -6.3530 3  570.7038 85  71510 3034239 4      4338 5        syn-C2H3C(O)NH2, v=0
  230086.7210  0.0032 -4.7609 3  658.8398135  71510 303672147      662244        syn-C2H3C(O)NH2, v=0
  230117.2247  0.0200 -3.5125 3  197.6086 67 -71510 303331716      331617        syn-C2H3C(O)NH2, v=0
  230117.2247  0.0200 -3.5125 3  197.6086 67 -71510 303331717      331618        syn-C2H3C(O)NH2, v=0
  230238.0567  0.0536 -6.3241 3 1462.5841195  71510 303973661      963760        syn-C2H3C(O)NH2, v=0
  230238.0567  0.0536 -6.3241 3 1462.5841195  71510 303973662      963759        syn-C2H3C(O)NH2, v=0
  230312.6521  0.0009 -5.2744 3  126.5828 63  71510 30331 625      30 624        syn-C2H3C(O)NH2, v=0
  230346.0663  0.0032 -4.7598 3  658.8393135  71510 303672146      662245        syn-C2H3C(O)NH2, v=0
  230415.7336  0.0200 -3.5895 3   50.6575 39 -71510 30319 712      18 613        syn-C2H3C(O)NH2, v=0
  230417.4741  0.0051 -6.2770 3  587.8886139  71510 30369 861      70 764        syn-C2H3C(O)NH2, v=0
  230417.4742  0.0051 -6.2770 3  587.8886139  71510 30369 961      70 664        syn-C2H3C(O)NH2, v=0
  230488.4163  0.0118 -6.4676 3  763.1847157  71510 303781068      79 971        syn-C2H3C(O)NH2, v=0
  230488.4164  0.0118 -6.4676 3  763.1847157  71510 303781168      79 871        syn-C2H3C(O)NH2, v=0
  230508.5026  0.0195 -4.4281 3  894.2231161  71510 303801961      801862        syn-C2H3C(O)NH2, v=0
  230523.6770  0.0200 -3.9201 3  580.6408131 -71510 303651451      651352        syn-C2H3C(O)NH2, v=0
  230544.5765  0.0200 -3.5180 3  189.4888 65 -71510 303321715      321616        syn-C2H3C(O)NH2, v=0
  230544.5765  0.0200 -3.5180 3  189.4888 65 -71510 303321716      321617        syn-C2H3C(O)NH2, v=0
  230612.0878  0.0019 -6.5239 3   19.9832 23  71510 30311 7 5      11 4 8        syn-C2H3C(O)NH2, v=0
  230638.7279  0.0200 -3.6168 3  382.2895101 -71510 303501832      501733        syn-C2H3C(O)NH2, v=0
  230670.7235  0.0616 -6.4815 3 1017.5501123  71510 303614912      624815        syn-C2H3C(O)NH2, v=0
  230670.7235  0.0616 -6.4815 3 1017.5501123  71510 303614913      624814        syn-C2H3C(O)NH2, v=0
  230690.9014  0.0200 -3.6166 3  382.2876101 -71510 303501833      501734        syn-C2H3C(O)NH2, v=0
  230696.1421  0.0613 -6.4519 3 1527.6169199  71510 303993762      983861        syn-C2H3C(O)NH2, v=0
  230696.1421  0.0613 -6.4519 3 1527.6169199  71510 303993763      983860        syn-C2H3C(O)NH2, v=0
  230704.6769  0.0018 -5.7603 3   33.2563 31  71510 30315 7 9      15 412        syn-C2H3C(O)NH2, v=0
  230709.9645  0.0128 -6.4720 3  532.3824 81  71510 3034038 2      4137 5        syn-C2H3C(O)NH2, v=0
  230709.9645  0.0128 -6.4720 3  532.3824 81  71510 3034038 3      4137 4        syn-C2H3C(O)NH2, v=0
  230773.4169  0.0009 -5.3601 3  148.1140 63  71510 303311220      301219        syn-C2H3C(O)NH2, v=0
  230785.4816  0.0009 -5.3600 3  148.1144 63  71510 303311219      301218        syn-C2H3C(O)NH2, v=0
  230864.3466  0.0200 -3.7406 3  229.6079 89 -71510 30344 440      44 341        syn-C2H3C(O)NH2, v=0
  230864.3466  0.0200 -3.7406 3  229.6079 89 -71510 30344 540      44 441        syn-C2H3C(O)NH2, v=0
  230878.2868  0.0200 -3.7898 3  514.2034119 -71510 303591940      591841        syn-C2H3C(O)NH2, v=0
  230881.6228  0.0016 -3.7965 3  487.9525121  71510 303601248      601149        syn-C2H3C(O)NH2, v=0
  230890.3437  0.0055 -4.2719 3  815.2464153  71510 303762057      761958        syn-C2H3C(O)NH2, v=0
  230932.6832  0.0200 -3.5255 3  181.6220 63 -71510 303311714      311615        syn-C2H3C(O)NH2, v=0
  230932.6832  0.0200 -3.5255 3  181.6220 63 -71510 303311715      311616        syn-C2H3C(O)NH2, v=0
  230959.3277  0.0023 -3.6096 3   90.8570 53  71510 30326 720      25 619        syn-C2H3C(O)NH2, v=0
  231022.1200  0.0026 -4.6800 3  616.7724131  71510 303652046      642143        syn-C2H3C(O)NH2, v=0
  231025.8177  0.0042 -4.1282 3  724.4200145  71510 303721855      721756        syn-C2H3C(O)NH2, v=0
  231039.2513  0.0049 -4.7147 3  501.7733121  71510 303601546      591643        syn-C2H3C(O)NH2, v=0
  231050.0293  0.0013 -4.7885 3   24.0259 29  71510 30314 510      13 211        syn-C2H3C(O)NH2, v=0
  231180.1800  0.0697 -6.5826 3 1594.0733203  71510 303A13863      A03962        syn-C2H3C(O)NH2, v=0
  231180.1800  0.0697 -6.5826 3 1594.0733203  71510 303A13864      A03961        syn-C2H3C(O)NH2, v=0
  231284.3783  0.0200 -3.5353 3  174.0074 61 -71510 303301713      301614        syn-C2H3C(O)NH2, v=0
  231284.3783  0.0200 -3.5353 3  174.0074 61 -71510 303301714      301615        syn-C2H3C(O)NH2, v=0
  231300.9353  0.0045 -6.2245 3  372.7598113  71510 30356 551      57 454        syn-C2H3C(O)NH2, v=0
  231300.9353  0.0045 -6.2245 3  372.7598113  71510 30356 651      57 354        syn-C2H3C(O)NH2, v=0
  231333.7429  0.0110 -6.6722 3  495.4994 77  71510 3033837 1      3936 4        syn-C2H3C(O)NH2, v=0
  231333.7429  0.0110 -6.6722 3  495.4994 77  71510 3033837 2      3936 3        syn-C2H3C(O)NH2, v=0
  231398.2704  0.0544 -6.4228 3  965.3728119  71510 303594811      604714        syn-C2H3C(O)NH2, v=0
  231398.2704  0.0544 -6.4228 3  965.3728119  71510 303594812      604713        syn-C2H3C(O)NH2, v=0
  231402.5263  0.0200 -3.4172 3  134.4091 65 -71510 30332 626      31 725        syn-C2H3C(O)NH2, v=0
  231474.5122  0.0200 -3.7944 3  487.9550121 -71510 303601348      601249        syn-C2H3C(O)NH2, v=0
  231502.4164  0.0029 -5.2288 3   19.6844 29  71510 30314 212      13 113        syn-C2H3C(O)NH2, v=0
  231602.3153  0.0200 -3.5476 3  166.6445 59 -71510 303291712      291613        syn-C2H3C(O)NH2, v=0
  231602.3153  0.0200 -3.5476 3  166.6445 59 -71510 303291713      291614        syn-C2H3C(O)NH2, v=0
  231684.9763  0.0026 -4.6775 3  616.7710131  71510 303652045      642144        syn-C2H3C(O)NH2, v=0
  231688.0038  0.0791 -6.7162 3 1661.9522207  71510 303A33964      A24063        syn-C2H3C(O)NH2, v=0
  231688.0038  0.0791 -6.7162 3 1661.9522207  71510 303A33965      A24062        syn-C2H3C(O)NH2, v=0
  231688.6262  0.0025 -6.1421 3  285.1624 87  71510 303431627      441332        syn-C2H3C(O)NH2, v=0
  231763.8896  0.0029 -6.3402 3  146.0945 61  71510 303301317      311022        syn-C2H3C(O)NH2, v=0
  231788.8749  0.0200 -3.4677 3  119.0762 61 -71510 30330 724      29 623        syn-C2H3C(O)NH2, v=0
  231888.9648  0.0200 -3.5629 3  159.5324 57 -71510 303281711      281612        syn-C2H3C(O)NH2, v=0
  231888.9648  0.0200 -3.5629 3  159.5324 57 -71510 303281712      281613        syn-C2H3C(O)NH2, v=0
  231907.5194  0.2656 -6.5838 3 2061.4550243  71510 303C13190      C13091        syn-C2H3C(O)NH2, v=0
  231915.8752  0.0009 -5.3330 3  142.9368 63  71510 303311121      301120        syn-C2H3C(O)NH2, v=0
  232007.3915  0.0014 -3.6137 3   60.8046 43  71510 30321 715      20 614        syn-C2H3C(O)NH2, v=0
  232016.5420  0.0200 -3.7856 3  514.1599119 -71510 303591941      591842        syn-C2H3C(O)NH2, v=0
  232049.7998  0.0009 -5.3325 3  142.9413 63  71510 303311120      301119        syn-C2H3C(O)NH2, v=0
  232074.3443  0.0022 -4.6030 3  576.1560127  71510 303631945      622042        syn-C2H3C(O)NH2, v=0
  232097.7291  0.0052 -6.4621 3   29.0855 33  71510 30316 313      16 016        syn-C2H3C(O)NH2, v=0
  232116.5596  0.0478 -6.3723 3  914.6259115  71510 303574710      584613        syn-C2H3C(O)NH2, v=0
  232116.5596  0.0478 -6.3723 3  914.6259115  71510 303574711      584612        syn-C2H3C(O)NH2, v=0
  232138.7819  0.0200 -3.5991 3  369.7841 99 -71510 303491831      491732        syn-C2H3C(O)NH2, v=0
  232140.7203  0.0200 -3.9922 3  650.3377135 -71510 303672048      671949        syn-C2H3C(O)NH2, v=0
  232146.6865  0.0200 -3.5814 3  152.6708 55 -71510 303271710      271611        syn-C2H3C(O)NH2, v=0
  232146.6865  0.0200 -3.5814 3  152.6708 55 -71510 303271711      271612        syn-C2H3C(O)NH2, v=0
  232166.1944  0.0200 -3.5990 3  369.7831 99 -71510 303491832      491733        syn-C2H3C(O)NH2, v=0
  232172.5631  0.0077 -6.5860 3  211.9498 79  71510 303391029      40 734        syn-C2H3C(O)NH2, v=0
  232193.8467  0.1072 -5.1899 3 1321.3795195  71510 303972473      972374        syn-C2H3C(O)NH2, v=0
  232284.1628  0.0015 -6.0340 3   11.6160 21  71510 30310 5 5       9 2 8        syn-C2H3C(O)NH2, v=0
  232287.7330  0.0162 -4.4924 3  940.6445163  71510 303812358      812259        syn-C2H3C(O)NH2, v=0
  232304.8689  0.0023 -3.6271 3   84.3183 51  71510 30325 719      24 618        syn-C2H3C(O)NH2, v=0
  232359.4649  0.0009 -5.2796 3  130.5079 63  71510 30331 824      30 823        syn-C2H3C(O)NH2, v=0
  232377.6520  0.0200 -3.6037 3  146.0591 53 -71510 3032617 9      261610        syn-C2H3C(O)NH2, v=0
  232377.6520  0.0200 -3.6037 3  146.0591 53 -71510 303261710      261611        syn-C2H3C(O)NH2, v=0
  232410.6180  0.0018 -5.6295 3   37.1529 33  71510 30316 710      16 413        syn-C2H3C(O)NH2, v=0
  232424.8065  0.0018 -4.4184 3  463.0734115  71510 303571642      561739        syn-C2H3C(O)NH2, v=0
  232448.5159  0.0039 -4.1253 3  729.0230143  71510 303712150      712051        syn-C2H3C(O)NH2, v=0
  232483.1488  0.0026 -3.9432 3  186.2303 83  71510 30341 239      41 140        syn-C2H3C(O)NH2, v=0
  232483.1488  0.0026 -3.9432 3  186.2303 83  71510 30341 339      41 240        syn-C2H3C(O)NH2, v=0
  232557.4815  0.0200 -3.6960 3  257.5205 93 -71510 30346 541      46 442        syn-C2H3C(O)NH2, v=0
  232557.4815  0.0200 -3.6960 3  257.5205 93 -71510 30346 641      46 542        syn-C2H3C(O)NH2, v=0
  232583.9175  0.0200 -3.6305 3  139.6966 51 -71510 3032517 8      2516 9        syn-C2H3C(O)NH2, v=0
  232583.9175  0.0200 -3.6305 3  139.6966 51 -71510 3032517 9      251610        syn-C2H3C(O)NH2, v=0
  232657.7997  0.0029 -4.1096 3  285.1624 91  71510 303451233      441332        syn-C2H3C(O)NH2, v=0
  232765.0447  0.0015 -4.5568 3  111.7434 57  71510 30328 919      28 622        syn-C2H3C(O)NH2, v=0
  232767.4892  0.0200 -3.6629 3  133.5829 49 -71510 3032417 7      2416 8        syn-C2H3C(O)NH2, v=0
  232767.4892  0.0200 -3.6629 3  133.5829 49 -71510 3032417 8      2416 9        syn-C2H3C(O)NH2, v=0
  232825.4372  0.0419 -6.3308 3  865.3103111  71510 3035546 9      564512        syn-C2H3C(O)NH2, v=0
  232825.4372  0.0419 -6.3308 3  865.3103111  71510 303554610      564511        syn-C2H3C(O)NH2, v=0
  232872.5130  0.0029 -3.9994 3  638.1648137  71510 303681553      681454        syn-C2H3C(O)NH2, v=0
  232903.6315  0.1501 -6.6565 3 2101.3264245  71510 303C23290      C23191        syn-C2H3C(O)NH2, v=0
  232930.1257  0.0200 -3.7022 3  127.7175 47 -71510 3032317 6      2316 7        syn-C2H3C(O)NH2, v=0
  232930.1257  0.0200 -3.7022 3  127.7175 47 -71510 3032317 7      2316 8        syn-C2H3C(O)NH2, v=0
  232948.7967  0.0051 -6.3061 3  315.2239105  71510 30352 448      53 351        syn-C2H3C(O)NH2, v=0
  232948.7967  0.0051 -6.3061 3  315.2239105  71510 30352 548      53 251        syn-C2H3C(O)NH2, v=0
  233001.3453  0.0102 -6.5641 3  525.7401123  71510 303611645      621350        syn-C2H3C(O)NH2, v=0
  233045.3410  0.0020 -4.5310 3  536.9950123  71510 303611844      601941        syn-C2H3C(O)NH2, v=0
  233073.6333  0.0200 -3.7504 3  122.0999 45 -71510 3032217 5      2216 6        syn-C2H3C(O)NH2, v=0
  233073.6333  0.0200 -3.7504 3  122.0999 45 -71510 3032217 6      2216 7        syn-C2H3C(O)NH2, v=0
  233087.2207  0.0043 -6.2294 3  515.8149131  71510 30365 758      66 661        syn-C2H3C(O)NH2, v=0
  233087.2208  0.0043 -6.2294 3  515.8149131  71510 30365 858      66 561        syn-C2H3C(O)NH2, v=0
  233133.9384  0.0200 -3.7515 3  451.3596117 -71510 303581147      581048        syn-C2H3C(O)NH2, v=0
  233199.6187  0.0200 -3.8109 3  116.7298 43 -71510 3032117 4      2116 5        syn-C2H3C(O)NH2, v=0
  233199.6187  0.0200 -3.8109 3  116.7298 43 -71510 3032117 5      2116 6        syn-C2H3C(O)NH2, v=0
  233217.1675  0.0200 -3.9105 3  580.6554131 -71510 303651551      651452        syn-C2H3C(O)NH2, v=0
  233221.2762  0.0125 -4.3038 3  826.3361155  71510 303771859      771760        syn-C2H3C(O)NH2, v=0
  233242.6240  0.0009 -5.3078 3  138.3144 63  71510 303311022      301021        syn-C2H3C(O)NH2, v=0
  233278.9291  0.0008 -5.2051 3  145.3040 75  71510 30337 136      36 135        syn-C2H3C(O)NH2, v=0
  233278.9369  0.0200 -3.0378 3  145.3040 75 -71510 30337 136      36 235        syn-C2H3C(O)NH2, v=0
  233278.9369  0.0200 -3.0378 3  145.3040 75 -71510 30337 236      36 135        syn-C2H3C(O)NH2, v=0
  233278.9291  0.0008 -5.2051 3  145.3040 75  71510 30337 236      36 235        syn-C2H3C(O)NH2, v=0
  233285.1663  0.0009 -5.1901 3  145.8247 77  71510 30338 038      37 037        syn-C2H3C(O)NH2, v=0
  233285.1705  0.0200 -2.9943 3  145.8247 77 -71510 30338 038      37 137        syn-C2H3C(O)NH2, v=0
  233285.1705  0.0200 -2.9943 3  145.8247 77 -71510 30338 138      37 037        syn-C2H3C(O)NH2, v=0
  233285.1663  0.0009 -5.1901 3  145.8247 77  71510 30338 138      37 137        syn-C2H3C(O)NH2, v=0
  233289.3186  0.1713 -5.5558 3 1520.3263209  71510 303A42678      A42579        syn-C2H3C(O)NH2, v=0
  233291.0717  0.0200 -3.0859 3  144.2660 73 -71510 30336 234      35 333        syn-C2H3C(O)NH2, v=0
  233291.0550  0.0008 -5.2192 3  144.2660 73  71510 30336 334      35 333        syn-C2H3C(O)NH2, v=0
  233291.0570  0.0008 -5.2192 3  144.2660 73  71510 30336 234      35 233        syn-C2H3C(O)NH2, v=0
  233291.0717  0.0200 -3.0859 3  144.2660 73 -71510 30336 334      35 233        syn-C2H3C(O)NH2, v=0
  233309.6210  0.0200 -3.8889 3  111.6066 41 -71510 3032017 3      2016 4        syn-C2H3C(O)NH2, v=0
  233309.6210  0.0200 -3.8889 3  111.6066 41 -71510 3032017 4      2016 5        syn-C2H3C(O)NH2, v=0
  233332.9820  0.0200 -3.7508 3  451.3603117 -71510 303581247      581148        syn-C2H3C(O)NH2, v=0
  233333.3655  0.0018 -6.5685 3  333.1225 65  71510 3033230 2      3130 1        syn-C2H3C(O)NH2, v=0
  233333.3655  0.0018 -6.5685 3  333.1225 65  71510 3033230 3      3130 2        syn-C2H3C(O)NH2, v=0
  233341.3033  0.0196 -6.6082 3  868.6098167  71510 303831172      841075        syn-C2H3C(O)NH2, v=0
  233341.3034  0.0196 -6.6082 3  868.6098167  71510 303831272      84 975        syn-C2H3C(O)NH2, v=0
  233348.3407  0.0008 -3.1406 3  142.6922 71  71510 30335 332      34 431        syn-C2H3C(O)NH2, v=0
  233348.4720  0.0008 -5.2324 3  142.6922 71  71510 30335 432      34 431        syn-C2H3C(O)NH2, v=0
  233348.6002  0.0008 -5.2324 3  142.6922 71  71510 30335 332      34 331        syn-C2H3C(O)NH2, v=0
  233348.7316  0.0008 -3.1406 3  142.6922 71  71510 30335 432      34 331        syn-C2H3C(O)NH2, v=0
  233405.1063  0.0200 -3.9947 3  106.7299 39 -71510 3031917 2      1916 3        syn-C2H3C(O)NH2, v=0
  233405.1063  0.0200 -3.9947 3  106.7299 39 -71510 3031917 3      1916 4        syn-C2H3C(O)NH2, v=0
  233414.1589  0.0017 -6.3702 3  319.2114 65  71510 3033229 3      3129 2        syn-C2H3C(O)NH2, v=0
  233414.1589  0.0017 -6.3702 3  319.2114 65  71510 3033229 4      3129 3        syn-C2H3C(O)NH2, v=0
  233469.6410  0.0021 -3.6344 3   78.0253 49  71510 30324 718      23 617        syn-C2H3C(O)NH2, v=0
  233469.8154  0.0019 -4.4673 3  499.2967119  71510 303591743      581840        syn-C2H3C(O)NH2, v=0
  233487.4958  0.0200 -4.1514 3  102.0995 37 -71510 3031817 1      1816 2        syn-C2H3C(O)NH2, v=0
  233487.4958  0.0200 -4.1514 3  102.0995 37 -71510 3031817 2      1816 3        syn-C2H3C(O)NH2, v=0
  233498.1251  0.0200 -3.2051 3  140.5539 69 -71510 30334 430      33 529        syn-C2H3C(O)NH2, v=0
  233501.3358  0.0016 -6.2241 3  305.7732 65  71510 3033228 4      3128 3        syn-C2H3C(O)NH2, v=0
  233501.3358  0.0016 -6.2241 3  305.7732 65  71510 3033228 5      3128 4        syn-C2H3C(O)NH2, v=0
  233503.8176  0.0008 -5.2442 3  140.5539 69  71510 30334 530      33 529        syn-C2H3C(O)NH2, v=0
  233508.8223  0.0008 -5.2442 3  140.5536 69  71510 30334 430      33 429        syn-C2H3C(O)NH2, v=0
  233514.4964  0.0200 -3.5827 3  357.5466 97 -71510 303481830      481731        syn-C2H3C(O)NH2, v=0
  233514.4964  0.0200 -3.2051 3  140.5536 69 -71510 30334 530      33 429        syn-C2H3C(O)NH2, v=0
  233524.7387  0.0366 -6.2999 3  817.4269107  71510 3035345 8      544411        syn-C2H3C(O)NH2, v=0
  233524.7387  0.0366 -6.2999 3  817.4269107  71510 3035345 9      544410        syn-C2H3C(O)NH2, v=0
  233528.5204  0.0200 -3.5827 3  357.5461 97 -71510 303481831      481732        syn-C2H3C(O)NH2, v=0
  233556.3099  0.0031 -5.5216 3   42.8669 37  71510 30318 613      18 316        syn-C2H3C(O)NH2, v=0
  233558.1045  0.0200 -4.4326 3   97.7148 35 -71510 3031717 0      1716 1        syn-C2H3C(O)NH2, v=0
  233558.1045  0.0200 -4.4326 3   97.7148 35 -71510 3031717 1      1716 2        syn-C2H3C(O)NH2, v=0
  233581.4788  0.0080 -4.2967 3  831.3861153  71510 303762254      762155        syn-C2H3C(O)NH2, v=0
  233595.9599  0.0016 -6.1072 3  292.8081 65  71510 3033227 5      3127 4        syn-C2H3C(O)NH2, v=0
  233595.9599  0.0016 -6.1072 3  292.8081 65  71510 3033227 6      3127 5        syn-C2H3C(O)NH2, v=0
  233605.3389  0.0027 -3.8298 3  188.9318 75  71510 30337 928      361027        syn-C2H3C(O)NH2, v=0
  233620.3038  0.0200 -3.7608 3  499.2967117 -71510 303581939      581840        syn-C2H3C(O)NH2, v=0
  233630.5006  0.0017 -3.6242 3   66.2536 45  71510 30322 716      21 615        syn-C2H3C(O)NH2, v=0
  233651.2157  0.0213 -5.4362 3  780.3294151  71510 303751858      741955        syn-C2H3C(O)NH2, v=0
  233652.4991  0.0029 -6.2513 3  184.3820 69  71510 303341421      351124        syn-C2H3C(O)NH2, v=0
  233676.1421  0.0200 -3.2871 3  137.8065 67 -71510 30333 528      32 627        syn-C2H3C(O)NH2, v=0
  233699.3074  0.0015 -6.0090 3  280.3166 65  71510 3033226 6      3126 5        syn-C2H3C(O)NH2, v=0
  233699.3074  0.0015 -6.0090 3  280.3166 65  71510 3033226 7      3126 6        syn-C2H3C(O)NH2, v=0
  233707.0077  0.0040 -4.2732 3  822.9481153  71510 303762156      762057        syn-C2H3C(O)NH2, v=0
  233712.4349  0.0079 -6.3702 3  681.1163149  71510 30374 965      75 868        syn-C2H3C(O)NH2, v=0
  233712.4350  0.0079 -6.3702 3  681.1163149  71510 303741065      75 768        syn-C2H3C(O)NH2, v=0
  233716.5134  0.0023 -4.5965 3  576.1522127  71510 303631944      622043        syn-C2H3C(O)NH2, v=0
  233740.4693  0.0040 -4.6163 3  108.5428 57  71510 30328 820      28 523        syn-C2H3C(O)NH2, v=0
  233758.4370  0.0016 -4.5011 3  119.0762 59  71510 30329 920      29 623        syn-C2H3C(O)NH2, v=0
  233812.9213  0.0014 -5.9242 3  268.2992 65  71510 3033225 7      3125 6        syn-C2H3C(O)NH2, v=0
  233812.9213  0.0014 -5.9242 3  268.2992 65  71510 3033225 8      3125 7        syn-C2H3C(O)NH2, v=0
  233824.6662  0.0033 -4.0549 3  680.7318141  71510 303701754      701655        syn-C2H3C(O)NH2, v=0
  233828.0806  0.0200 -3.9373 3  616.6996131 -71510 303652045      651946        syn-C2H3C(O)NH2, v=0
  233833.8616  0.0009 -5.2542 3  137.8065 67  71510 30333 628      32 627        syn-C2H3C(O)NH2, v=0
  233867.0811  0.0014 -3.6729 3  286.7060 97  71510 30348 642      48 543        syn-C2H3C(O)NH2, v=0
  233867.3177  0.0014 -3.6729 3  286.7060 97  71510 30348 742      48 643        syn-C2H3C(O)NH2, v=0
  233936.7402  0.0009 -5.2878 3  134.2277 63  71510 30331 923      30 922        syn-C2H3C(O)NH2, v=0
  233938.6819  0.0013 -5.8494 3  256.7564 65  71510 3033224 8      3124 7        syn-C2H3C(O)NH2, v=0
  233938.6819  0.0013 -5.8494 3  256.7564 65  71510 3033224 9      3124 8        syn-C2H3C(O)NH2, v=0
  233954.3181  0.0009 -5.2537 3  137.7972 67  71510 30333 528      32 527        syn-C2H3C(O)NH2, v=0
  233967.4687  0.0039 -5.8612 3   35.8411 35  71510 30317 513      17 216        syn-C2H3C(O)NH2, v=0
  234032.5062  0.0019 -3.6324 3   71.9980 47  71510 30323 717      22 616        syn-C2H3C(O)NH2, v=0
  234044.7663  0.0046 -4.3063 3  842.5706155  71510 303772157      772058        syn-C2H3C(O)NH2, v=0
  234078.9012  0.0013 -5.7825 3  245.6888 65  71510 3033223 9      3123 8        syn-C2H3C(O)NH2, v=0
  234078.9012  0.0013 -5.7825 3  245.6888 65  71510 303322310      3123 9        syn-C2H3C(O)NH2, v=0
  234091.8877  0.0009 -5.2631 3  134.4091 65  71510 30332 726      31 725        syn-C2H3C(O)NH2, v=0
  234112.0677  0.0200 -3.2854 3  137.7972 67 -71510 30333 628      32 527        syn-C2H3C(O)NH2, v=0
  234139.4667  0.2449 -5.9530 3 1732.9287223  71510 303B12883      B12784        syn-C2H3C(O)NH2, v=0
  234186.5728  0.0058 -6.4772 3  262.2120 97  71510 30348 345      49 248        syn-C2H3C(O)NH2, v=0
  234186.5729  0.0058 -6.4772 3  262.2120 97  71510 30348 445      49 148        syn-C2H3C(O)NH2, v=0
  234190.5545  0.0027 -6.1453 3  337.7635 95  71510 303471730      481435        syn-C2H3C(O)NH2, v=0
  234208.4041  0.0036 -4.2386 3  803.5688151  71510 303752155      752056        syn-C2H3C(O)NH2, v=0
  234214.2886  0.0319 -6.2811 3  770.9766103  71510 3035144 7      524310        syn-C2H3C(O)NH2, v=0
  234214.2886  0.0319 -6.2811 3  770.9766103  71510 3035144 8      5243 9        syn-C2H3C(O)NH2, v=0
  234233.7132  0.0047 -4.0896 3  698.2953143  71510 303711655      711556        syn-C2H3C(O)NH2, v=0
  234236.4507  0.0012 -5.7221 3  235.0974 65  71510 303322210      3122 9        syn-C2H3C(O)NH2, v=0
  234236.4507  0.0012 -5.7221 3  235.0974 65  71510 303322211      312210        syn-C2H3C(O)NH2, v=0
  234266.7718  0.0009 -5.2609 3  121.6633 61  71510 30330 723      29 722        syn-C2H3C(O)NH2, v=0
  234289.9757  0.0200 -3.7583 3  499.2713117 -71510 303581940      581841        syn-C2H3C(O)NH2, v=0
  234293.2863  0.0020 -4.4165 3  442.3745113  71510 303561542      551639        syn-C2H3C(O)NH2, v=0
  234325.8706  0.0010 -5.3038 3  138.3597 63  71510 303311021      301020        syn-C2H3C(O)NH2, v=0
  234414.5479  0.0077 -4.1910 3  761.0227149  71510 303741757      741658        syn-C2H3C(O)NH2, v=0
  234414.9364  0.0012 -5.6671 3  224.9830 65  71510 303322111      312110        syn-C2H3C(O)NH2, v=0
  234414.9364  0.0012 -5.6671 3  224.9830 65  71510 303322112      312111        syn-C2H3C(O)NH2, v=0
  234484.0158  0.0200 -3.7156 3  415.9699113 -71510 303561046      56 947        syn-C2H3C(O)NH2, v=0
  234501.0259  0.0200 -3.5434 3  146.2361 67 -71510 30333 726      32 825        syn-C2H3C(O)NH2, v=0
  234545.8398  0.0200 -3.7154 3  415.9702113 -71510 303561146      561047        syn-C2H3C(O)NH2, v=0
  234618.9442  0.0011 -5.6167 3  215.3469 65  71510 303322012      312011        syn-C2H3C(O)NH2, v=0
  234618.9442  0.0011 -5.6167 3  215.3469 65  71510 303322013      312012        syn-C2H3C(O)NH2, v=0
  234626.6981  0.0200 -3.4275 3  126.5828 63 -71510 30331 725      30 624        syn-C2H3C(O)NH2, v=0
  234721.0221  0.0200 -3.9581 3  633.3110133 -71510 303662047      661948        syn-C2H3C(O)NH2, v=0
  234733.6094  0.0026 -5.2230 3   19.6840 29  71510 30314 312      13 013        syn-C2H3C(O)NH2, v=0
  234761.8235  0.0200 -3.6660 3  317.1544101 -71510 30350 743      50 644        syn-C2H3C(O)NH2, v=0
  234762.9497  0.0012 -3.6660 3  317.1544101  71510 30350 843      50 744        syn-C2H3C(O)NH2, v=0
  234779.1175  0.0200 -3.5676 3  345.5752 95 -71510 303471829      471730        syn-C2H3C(O)NH2, v=0
  234786.2180  0.0200 -3.5676 3  345.5750 95 -71510 303471830      471731        syn-C2H3C(O)NH2, v=0
  234831.7290  0.1582 -5.7981 3 1653.7818217  71510 303A82979      A82880        syn-C2H3C(O)NH2, v=0
  234854.3912  0.0011 -5.5705 3  206.1905 65  71510 303321913      311912        syn-C2H3C(O)NH2, v=0
  234854.3912  0.0011 -5.5705 3  206.1905 65  71510 303321914      311913        syn-C2H3C(O)NH2, v=0
  234891.5321  0.0200 -3.8134 3  212.1733 87 -71510 30343 340      43 241        syn-C2H3C(O)NH2, v=0
  234891.5321  0.0200 -3.8134 3  212.1733 87 -71510 30343 440      43 341        syn-C2H3C(O)NH2, v=0
  234893.9003  0.0277 -6.2769 3  725.9603 99  71510 3034943 6      5042 9        syn-C2H3C(O)NH2, v=0
  234893.9003  0.0277 -6.2769 3  725.9603 99  71510 3034943 7      5042 8        syn-C2H3C(O)NH2, v=0
  234965.6130  0.0066 -4.2952 3  834.7330155  71510 303772058      771959        syn-C2H3C(O)NH2, v=0
  234989.5312  0.2055 -6.3339 3 1935.9030235  71510 303B73186      B73087        syn-C2H3C(O)NH2, v=0
  235095.5842  0.0200 -3.8554 3  541.0612127 -71510 303631350      631251        syn-C2H3C(O)NH2, v=0
  235129.0420  0.0011 -5.5278 3  197.5157 65  71510 303321814      311813        syn-C2H3C(O)NH2, v=0
  235129.0420  0.0011 -5.5278 3  197.5157 65  71510 303321815      311814        syn-C2H3C(O)NH2, v=0
  235134.2533  0.0200 -3.6889 3  381.7976109 -71510 30354 945      54 846        syn-C2H3C(O)NH2, v=0
  235151.9560  0.0200 -3.6888 3  381.7977109 -71510 303541045      54 946        syn-C2H3C(O)NH2, v=0
  235201.8528  0.0200 -3.6719 3  348.8552105 -71510 30352 844      52 745        syn-C2H3C(O)NH2, v=0
  235206.4881  0.0200 -3.6719 3  348.8553105 -71510 30352 944      52 845        syn-C2H3C(O)NH2, v=0
  235207.9033  0.0019 -5.5191 3   41.2697 35  71510 30317 711      17 414        syn-C2H3C(O)NH2, v=0
  235246.9075  0.0020 -4.6410 3  104.5880 55  71510 30327 918      27 621        syn-C2H3C(O)NH2, v=0
  235283.9254  0.0025 -4.3750 3  448.8717113  71510 303561640      551739        syn-C2H3C(O)NH2, v=0
  235296.7412  0.0200 -4.2195 3  788.1232151 -71510 303751957      751858        syn-C2H3C(O)NH2, v=0
  235312.1793  0.0055 -4.3376 3  862.4277157  71510 303782158      782059        syn-C2H3C(O)NH2, v=0
  235427.4669  0.0033 -4.2028 3  784.4410149  71510 303742154      742055        syn-C2H3C(O)NH2, v=0
  235428.7556  0.0042 -6.2133 3  448.2443123  71510 30361 655      62 558        syn-C2H3C(O)NH2, v=0
  235428.7557  0.0042 -6.2133 3  448.2443123  71510 30361 755      62 458        syn-C2H3C(O)NH2, v=0
  235453.2911  0.0010 -5.4884 3  189.3251 65  71510 303321715      311714        syn-C2H3C(O)NH2, v=0
  235453.2911  0.0010 -5.4884 3  189.3251 65  71510 303321716      311715        syn-C2H3C(O)NH2, v=0
  235497.5099  0.0031 -6.5595 3  105.6464 51  71510 303251214      26 917        syn-C2H3C(O)NH2, v=0
  235524.9877  0.0438 -4.8706 3 1156.0708181  71510 303902565      902466        syn-C2H3C(O)NH2, v=0
  235563.3750  0.0239 -6.2909 3  682.3787 95  71510 3034742 5      4841 8        syn-C2H3C(O)NH2, v=0
  235563.3750  0.0239 -6.2909 3  682.3787 95  71510 3034742 6      4841 7        syn-C2H3C(O)NH2, v=0
  235576.8323  0.0010 -5.2646 3  123.8962 61  71510 30330 822      29 821        syn-C2H3C(O)NH2, v=0
  235705.5443  0.3104 -6.3788 3 1959.1330237  71510 303B83088      B82989        syn-C2H3C(O)NH2, v=0
  235716.5944  0.0009 -5.2564 3  134.2652 65  71510 30332 626      31 625        syn-C2H3C(O)NH2, v=0
  235802.3958  0.0935 -5.3081 3 1393.8044199  71510 303992772      992673        syn-C2H3C(O)NH2, v=0
  235811.0915  0.0031 -4.1961 3  169.7753 81  71510 30340 139      40 040        syn-C2H3C(O)NH2, v=0
  235811.0915  0.0031 -4.1961 3  169.7753 81  71510 30340 239      40 140        syn-C2H3C(O)NH2, v=0
  235841.3949  0.0010 -5.4518 3  181.6220 65  71510 303321617      311616        syn-C2H3C(O)NH2, v=0
  235841.3951  0.0010 -5.4518 3  181.6220 65  71510 303321616      311615        syn-C2H3C(O)NH2, v=0
  235943.5229  0.0200 -3.5538 3  333.8686 93 -71510 303461828      461729        syn-C2H3C(O)NH2, v=0
  235947.0320  0.0200 -3.5538 3  333.8685 93 -71510 303461829      461730        syn-C2H3C(O)NH2, v=0
  235950.2919  0.0884 -6.6851 3 1166.1369133  71510 303665214      675117        syn-C2H3C(O)NH2, v=0
  235950.2919  0.0884 -6.6851 3 1166.1369133  71510 303665215      675116        syn-C2H3C(O)NH2, v=0
  235965.1717  0.0432 -4.7040 3 1059.7430175  71510 303872166      872067        syn-C2H3C(O)NH2, v=0
  236046.5191  0.0200 -3.7337 3  484.6734115 -71510 303571938      571839        syn-C2H3C(O)NH2, v=0
  236119.2569  0.0200 -3.8518 3  541.0660127 -71510 303631450      631351        syn-C2H3C(O)NH2, v=0
  236155.8342  0.0031 -6.1704 3  394.8256103  71510 303511833      521538        syn-C2H3C(O)NH2, v=0
  236222.5022  0.0206 -6.3284 3  640.2327 91  71510 3034541 4      4640 7        syn-C2H3C(O)NH2, v=0
  236222.5022  0.0206 -6.3284 3  640.2327 91  71510 3034541 5      4640 6        syn-C2H3C(O)NH2, v=0
  236283.9248  0.0200 -3.3099 3   39.6949 25 -71510 3031211 1      1110 2        syn-C2H3C(O)NH2, v=0
  236283.9248  0.0200 -3.3099 3   39.6949 25 -71510 3031211 2      1110 1        syn-C2H3C(O)NH2, v=0
  236313.5082  0.0010 -5.4179 3  174.4110 65  71510 303321518      311517        syn-C2H3C(O)NH2, v=0
  236313.5138  0.0010 -5.4179 3  174.4110 65  71510 303321517      311516        syn-C2H3C(O)NH2, v=0
  236404.3316  0.0078 -6.4783 3  351.6400101  71510 303501337      511042        syn-C2H3C(O)NH2, v=0
  236424.9616  0.0200 -3.4743 3   49.1227 37 -71510 30318 811      17 710        syn-C2H3C(O)NH2, v=0
  236432.9932  0.0200 -3.7324 3  484.6588115 -71510 303571939      571840        syn-C2H3C(O)NH2, v=0
  236513.7029  0.0030 -6.5563 3  105.6125 51  71510 303251213      26 918        syn-C2H3C(O)NH2, v=0
  236646.5441  0.0055 -6.2951 3  603.5381141  71510 30370 862      71 765        syn-C2H3C(O)NH2, v=0
  236646.5441  0.0055 -6.2951 3  603.5381141  71510 30370 962      71 665        syn-C2H3C(O)NH2, v=0
  236673.8019  0.0200 -3.4736 3   49.1154 37 -71510 30318 810      17 711        syn-C2H3C(O)NH2, v=0
  236682.2541  0.0200 -3.3561 3   41.3173 29 -71510 3031410 5      13 9 4        syn-C2H3C(O)NH2, v=0
  236682.2541  0.0200 -3.3561 3   41.3173 29 -71510 3031410 4      13 9 5        syn-C2H3C(O)NH2, v=0
  236698.7106  0.0788 -6.6106 3 1110.1585129  71510 303645113      655016        syn-C2H3C(O)NH2, v=0
  236698.7106  0.0788 -6.6106 3 1110.1585129  71510 303645114      655015        syn-C2H3C(O)NH2, v=0
  236715.4737  0.0027 -6.2414 3  184.2799 69  71510 303341420      351125        syn-C2H3C(O)NH2, v=0
  236794.1401  0.0131 -6.4895 3  781.0503159  71510 303791069      80 972        syn-C2H3C(O)NH2, v=0
  236794.1402  0.0131 -6.4895 3  781.0503159  71510 303791169      80 872        syn-C2H3C(O)NH2, v=0
  236801.8654  0.0028 -5.3605 3   53.8142 39  71510 30319 811      19 514        syn-C2H3C(O)NH2, v=0
  236871.0588  0.0177 -6.3980 3  599.5231 87  71510 3034340 3      4439 6        syn-C2H3C(O)NH2, v=0
  236871.0588  0.0177 -6.3980 3  599.5231 87  71510 3034340 4      4439 5        syn-C2H3C(O)NH2, v=0
  236899.2300  0.0010 -5.3863 3  167.6986 65  71510 303321419      311418        syn-C2H3C(O)NH2, v=0
  236899.3445  0.0010 -5.3863 3  167.6986 65  71510 303321418      311417        syn-C2H3C(O)NH2, v=0
  236913.4859  0.0200 -3.4069 3   44.4381 33 -71510 30316 9 8      15 8 7        syn-C2H3C(O)NH2, v=0
  236915.2039  0.0200 -3.4069 3   44.4380 33 -71510 30316 9 7      15 8 8        syn-C2H3C(O)NH2, v=0
  236952.4947  0.0029 -4.1654 3  325.6123 97  71510 303481335      471434        syn-C2H3C(O)NH2, v=0
  236961.8965  0.0023 -4.5156 3  536.9851123  71510 303611843      601942        syn-C2H3C(O)NH2, v=0
  236963.8944  0.0039 -4.6013 3  486.4113119  71510 303591545      581642        syn-C2H3C(O)NH2, v=0
  236972.9580  0.0200 -3.7385 3  239.4092 91 -71510 30345 441      45 342        syn-C2H3C(O)NH2, v=0
  236972.9580  0.0200 -3.7385 3  239.4092 91 -71510 30345 541      45 442        syn-C2H3C(O)NH2, v=0
  237016.6438  0.0200 -3.5412 3  322.4254 91 -71510 303451827      451728        syn-C2H3C(O)NH2, v=0
  237018.3407  0.0200 -3.5412 3  322.4254 91 -71510 303451828      451729        syn-C2H3C(O)NH2, v=0
  237186.2198  0.0024 -3.9843 3  638.1903137  71510 303681653      681554        syn-C2H3C(O)NH2, v=0
  237203.8975  0.0027 -6.1914 3  227.0533 77  71510 303381524      391227        syn-C2H3C(O)NH2, v=0
  237223.9999  0.0030 -4.1661 3  765.5723147  71510 303732153      732054        syn-C2H3C(O)NH2, v=0
  237338.3929  0.0167 -5.4065 3 1013.8704165  71510 303822855      812952        syn-C2H3C(O)NH2, v=0
  237338.7856  0.0167 -5.4065 3 1013.8704165  71510 303822854      812953        syn-C2H3C(O)NH2, v=0
  237352.7501  0.0016 -3.9248 3  616.5613131  71510 303652046      651947        syn-C2H3C(O)NH2, v=0
  237366.9973  0.0199 -5.5120 3 1067.9470169  71510 303842956      833053        syn-C2H3C(O)NH2, v=0
  237367.1320  0.0199 -5.5120 3 1067.9470169  71510 303842955      833054        syn-C2H3C(O)NH2, v=0
  237394.2611  0.0138 -5.3039 3  961.2295161  71510 303802754      792851        syn-C2H3C(O)NH2, v=0
  237395.3916  0.0138 -5.3039 3  961.2295161  71510 303802753      792852        syn-C2H3C(O)NH2, v=0
  237420.2033  0.0046 -6.2373 3  385.1833115  71510 30357 552      58 455        syn-C2H3C(O)NH2, v=0
  237420.2033  0.0046 -6.2373 3  385.1833115  71510 30357 652      58 355        syn-C2H3C(O)NH2, v=0
  237431.6739  0.0073 -4.9188 3  587.7264131  71510 303651650      641747        syn-C2H3C(O)NH2, v=0
  237438.1236  0.0700 -6.5428 3 1055.6078125  71510 303625012      634915        syn-C2H3C(O)NH2, v=0
  237438.1236  0.0700 -6.5428 3 1055.6078125  71510 303625013      634914        syn-C2H3C(O)NH2, v=0
  237468.4400  0.0236 -5.6204 3 1123.4579173  71510 303863057      853154        syn-C2H3C(O)NH2, v=0
  237468.4856  0.0236 -5.6204 3 1123.4579173  71510 303863056      853155        syn-C2H3C(O)NH2, v=0
  237469.2044  0.0036 -4.4263 3   34.7790 35  71510 30317 413      16 314        syn-C2H3C(O)NH2, v=0
  237508.8095  0.0152 -6.5155 3  560.2504 83  71510 3034139 2      4238 5        syn-C2H3C(O)NH2, v=0
  237508.8095  0.0152 -6.5155 3  560.2504 83  71510 3034139 3      4238 4        syn-C2H3C(O)NH2, v=0
  237548.8823  0.0113 -5.2042 3  910.0258157  71510 303782653      772750        syn-C2H3C(O)NH2, v=0
  237552.0925  0.0113 -5.2042 3  910.0258157  71510 303782652      772751        syn-C2H3C(O)NH2, v=0
  237559.3607  0.0067 -4.3670 3  882.5109159  71510 303792159      792060        syn-C2H3C(O)NH2, v=0
  237624.2261  0.0035 -6.2152 3  456.3467111  71510 303551936      561641        syn-C2H3C(O)NH2, v=0
  237625.3575  0.0047 -4.1423 3  742.6602147  71510 303731856      731757        syn-C2H3C(O)NH2, v=0
  237633.2033  0.0278 -5.7318 3 1180.4018177  71510 303883158      873255        syn-C2H3C(O)NH2, v=0
  237633.2186  0.0278 -5.7318 3 1180.4018177  71510 303883157      873256        syn-C2H3C(O)NH2, v=0
  237643.8188  0.0009 -5.3568 3  161.4941 65  71510 303321320      311319        syn-C2H3C(O)NH2, v=0
  237645.7005  0.0009 -5.3567 3  161.4941 65  71510 303321319      311318        syn-C2H3C(O)NH2, v=0
  237777.6504  0.0200 -3.9000 3  600.1747129 -71510 303642044      641945        syn-C2H3C(O)NH2, v=0
  237819.7229  0.0092 -5.1074 3  860.2608153  71510 303762552      752649        syn-C2H3C(O)NH2, v=0
  237828.7007  0.0092 -5.1073 3  860.2608153  71510 303762551      752650        syn-C2H3C(O)NH2, v=0
  237853.4460  0.0325 -5.8460 3 1238.7773181  71510 303903259      893356        syn-C2H3C(O)NH2, v=0
  237853.4511  0.0325 -5.8460 3 1238.7773181  71510 303903258      893357        syn-C2H3C(O)NH2, v=0
  238006.1364  0.0200 -3.5299 3  311.2445 89 -71510 303441826      441727        syn-C2H3C(O)NH2, v=0
  238006.9953  0.0200 -3.5299 3  311.2445 89 -71510 303441827      441728        syn-C2H3C(O)NH2, v=0
  238085.6440  0.0200 -3.8013 3  502.6550123 -71510 303611249      611150        syn-C2H3C(O)NH2, v=0
  238093.1498  0.0590 -5.8517 3  978.1307169  71510 303842065      832162        syn-C2H3C(O)NH2, v=0
  238111.7857  0.0118 -5.1626 3  680.5888141  71510 303701754      691851        syn-C2H3C(O)NH2, v=0
  238118.6559  0.0024 -4.4546 3  456.7200115  71510 303571543      561640        syn-C2H3C(O)NH2, v=0
  238122.6554  0.0378 -5.9632 3 1298.5829185  71510 303923360      913457        syn-C2H3C(O)NH2, v=0
  238122.6571  0.0378 -5.9632 3 1298.5829185  71510 303923359      913458        syn-C2H3C(O)NH2, v=0
  238168.4023  0.0620 -6.4825 3 1002.4856121  71510 303604911      614814        syn-C2H3C(O)NH2, v=0
  238168.4023  0.0620 -6.4825 3 1002.4856121  71510 303604912      614813        syn-C2H3C(O)NH2, v=0
  238168.6967  0.1351 -6.3166 3 1198.1160187  71510 303932272      922369        syn-C2H3C(O)NH2, v=0
  238220.0732  0.0200 -3.7084 3  470.3293113 -71510 303561937      561838        syn-C2H3C(O)NH2, v=0
  238227.7059  0.0074 -5.0134 3  811.9362149  71510 303742451      732548        syn-C2H3C(O)NH2, v=0
  238251.5864  0.0200 -3.6664 3  166.9310 71 -71510 30335 827      34 926        syn-C2H3C(O)NH2, v=0
  238252.3917  0.0074 -5.0133 3  811.9361149  71510 303742450      732549        syn-C2H3C(O)NH2, v=0
  238405.9727  0.0200 -3.3889 3  134.2652 65 -71510 30332 726      31 625        syn-C2H3C(O)NH2, v=0
  238428.3821  0.0031 -4.0768 3  710.8293141  71510 303702149      702050        syn-C2H3C(O)NH2, v=0
  238435.3796  0.0437 -6.0834 3 1359.8175189  71510 303943461      933558        syn-C2H3C(O)NH2, v=0
  238435.3801  0.0437 -6.0834 3 1359.8175189  71510 303943460      933559        syn-C2H3C(O)NH2, v=0
  238438.8918  0.0200 -3.7077 3  470.3211113 -71510 303561938      561839        syn-C2H3C(O)NH2, v=0
  238446.2788  0.0200 -3.8000 3  502.6565123 -71510 303611349      611250        syn-C2H3C(O)NH2, v=0
  238540.2771  0.0027 -3.9393 3  195.0214 85  71510 30342 240      42 141        syn-C2H3C(O)NH2, v=0
  238540.2771  0.0027 -3.9393 3  195.0214 85  71510 30342 340      42 241        syn-C2H3C(O)NH2, v=0
  238579.6042  0.0200 -3.3694 3  142.2176 67 -71510 30333 627      32 726        syn-C2H3C(O)NH2, v=0
  238602.7594  0.0155 -6.6897 3  830.7437151  71510 303752451      762156        syn-C2H3C(O)NH2, v=0
  238615.0634  0.0009 -5.3289 3  155.8118 65  71510 303321221      311220        syn-C2H3C(O)NH2, v=0
  238630.5725  0.0039 -6.2782 3  522.3245119  71510 303592039      601744        syn-C2H3C(O)NH2, v=0
  238635.3395  0.0022 -4.4771 3  126.5828 61  71510 30330 921      30 624        syn-C2H3C(O)NH2, v=0
  238639.7474  0.0009 -5.3288 3  155.8126 65  71510 303321220      311219        syn-C2H3C(O)NH2, v=0
  238708.1528  0.0200 -3.6952 3  267.9287 95 -71510 30347 542      47 443        syn-C2H3C(O)NH2, v=0
  238708.1528  0.0200 -3.6952 3  267.9287 95 -71510 30347 642      47 543        syn-C2H3C(O)NH2, v=0
  238725.9572  0.0200 -3.9246 3  596.7959133 -71510 303661452      661353        syn-C2H3C(O)NH2, v=0
  238751.8822  0.0200 -3.5876 3   55.3967 41 -71510 30320 713      19 614        syn-C2H3C(O)NH2, v=0
  238787.0204  0.0502 -6.2065 3 1422.4796193  71510 303963562      953659        syn-C2H3C(O)NH2, v=0
  238787.0206  0.0502 -6.2065 3 1422.4796193  71510 303963561      953660        syn-C2H3C(O)NH2, v=0
  238796.4216  0.0059 -4.9222 3  765.0537145  71510 303722350      712447        syn-C2H3C(O)NH2, v=0
  238863.0234  0.0059 -4.9220 3  765.0536145  71510 303722349      712448        syn-C2H3C(O)NH2, v=0
  238889.4095  0.0547 -6.4302 3  950.7931117  71510 303584810      594713        syn-C2H3C(O)NH2, v=0
  238889.4095  0.0547 -6.4302 3  950.7931117  71510 303584811      594712        syn-C2H3C(O)NH2, v=0
  238918.7444  0.0007 -3.5198 3  300.3247 87  71510 303431825      431726        syn-C2H3C(O)NH2, v=0
  238919.1137  0.0007 -3.5198 3  300.3247 87  71510 303431826      431727        syn-C2H3C(O)NH2, v=0
  239036.5310  0.0052 -6.3174 3  326.6388107  71510 30353 449      54 352        syn-C2H3C(O)NH2, v=0
  239036.5311  0.0052 -6.3174 3  326.6388107  71510 30353 549      54 252        syn-C2H3C(O)NH2, v=0
  239159.8714  0.0008 -5.2559 3  138.2585 65  71510 30332 825      31 824        syn-C2H3C(O)NH2, v=0
  239168.4689  0.0098 -6.5645 3  746.9693143  71510 303712348      722053        syn-C2H3C(O)NH2, v=0
  239173.6732  0.0575 -6.3325 3 1486.5680197  71510 303983662      973761        syn-C2H3C(O)NH2, v=0
  239173.6732  0.0575 -6.3325 3 1486.5680197  71510 303983663      973760        syn-C2H3C(O)NH2, v=0
  239193.4070  0.0031 -4.5151 3  471.3954117  71510 303581544      571641        syn-C2H3C(O)NH2, v=0
  239205.6374  0.0046 -6.3580 3  592.7563127  71510 303632142      641847        syn-C2H3C(O)NH2, v=0
  239274.3077  0.0045 -6.2461 3  530.4565133  71510 30366 759      67 662        syn-C2H3C(O)NH2, v=0
  239274.3077  0.0045 -6.2461 3  530.4565133  71510 30366 859      67 562        syn-C2H3C(O)NH2, v=0
  239283.8969  0.0020 -5.4285 3   45.6020 37  71510 30318 712      18 415        syn-C2H3C(O)NH2, v=0
  239287.7862  0.0011 -5.2676 3  134.5429 63  71510 30331 922      30 921        syn-C2H3C(O)NH2, v=0
  239333.7891  0.0008 -5.1875 3  153.0853 77  71510 30338 137      37 136        syn-C2H3C(O)NH2, v=0
  239333.7958  0.0200 -3.0190 3  153.0853 77 -71510 30338 137      37 236        syn-C2H3C(O)NH2, v=0
  239333.7958  0.0200 -3.0190 3  153.0853 77 -71510 30338 237      37 136        syn-C2H3C(O)NH2, v=0
  239333.7891  0.0008 -5.1875 3  153.0853 77  71510 30338 237      37 236        syn-C2H3C(O)NH2, v=0
  239340.4193  0.0009 -5.1729 3  153.6063 79  71510 30339 039      38 038        syn-C2H3C(O)NH2, v=0
  239340.4204  0.0200 -2.9768 3  153.6063 79 -71510 30339 039      38 138        syn-C2H3C(O)NH2, v=0
  239340.4204  0.0200 -2.9768 3  153.6063 79 -71510 30339 139      38 038        syn-C2H3C(O)NH2, v=0
  239340.4193  0.0009 -5.1729 3  153.6063 79  71510 30339 139      38 138        syn-C2H3C(O)NH2, v=0
  239344.1919  0.0200 -3.0655 3  152.0478 75 -71510 30337 235      36 334        syn-C2H3C(O)NH2, v=0
  239344.1933  0.0008 -5.2012 3  152.0478 75  71510 30337 335      36 334        syn-C2H3C(O)NH2, v=0
  239344.1943  0.0008 -5.2012 3  152.0478 75  71510 30337 235      36 234        syn-C2H3C(O)NH2, v=0
  239344.1919  0.0200 -3.0655 3  152.0478 75 -71510 30337 335      36 234        syn-C2H3C(O)NH2, v=0
  239376.7756  0.0064 -6.4537 3  667.6390135  71510 303672245      681950        syn-C2H3C(O)NH2, v=0
  239396.3113  0.0200 -3.1180 3  150.4759 73 -71510 30336 333      35 432        syn-C2H3C(O)NH2, v=0
  239396.2571  0.0008 -5.2140 3  150.4759 73  71510 30336 433      35 432        syn-C2H3C(O)NH2, v=0
  239396.3223  0.0008 -5.2140 3  150.4759 73  71510 30336 333      35 332        syn-C2H3C(O)NH2, v=0
  239396.3113  0.0200 -3.1180 3  150.4759 73 -71510 30336 433      35 332        syn-C2H3C(O)NH2, v=0
  239415.1088  0.0835 -5.0189 3 1239.0583189  71510 303942371      942272        syn-C2H3C(O)NH2, v=0
  239452.2484  0.0028 -4.1290 3  746.9693145  71510 303722152      722053        syn-C2H3C(O)NH2, v=0
  239534.6188  0.0200 -3.1795 3  148.3428 71 -71510 30335 431      34 530        syn-C2H3C(O)NH2, v=0
  239537.6027  0.0008 -5.2255 3  148.3428 71  71510 30335 531      34 530        syn-C2H3C(O)NH2, v=0
  239540.2871  0.0008 -5.2254 3  148.3426 71  71510 30335 431      34 430        syn-C2H3C(O)NH2, v=0
  239543.3142  0.0200 -3.1795 3  148.3426 71 -71510 30335 531      34 430        syn-C2H3C(O)NH2, v=0
  239548.3184  0.0047 -4.8339 3  719.6155141  71510 303702249      692346        syn-C2H3C(O)NH2, v=0
  239592.0014  0.0656 -6.4616 3 1552.0812201  71510 303A03763      993862        syn-C2H3C(O)NH2, v=0
  239592.0014  0.0656 -6.4616 3 1552.0812201  71510 303A03764      993861        syn-C2H3C(O)NH2, v=0
  239600.9987  0.0482 -6.3872 3  900.5311113  71510 3035647 9      574612        syn-C2H3C(O)NH2, v=0
  239600.9987  0.0482 -6.3872 3  900.5311113  71510 303564710      574611        syn-C2H3C(O)NH2, v=0
  239632.6438  0.0054 -4.8567 3   91.6421 53  71510 30326 719      26 422        syn-C2H3C(O)NH2, v=0
  239677.5787  0.0215 -6.6325 3  887.6828169  71510 303841173      851076        syn-C2H3C(O)NH2, v=0
  239677.5788  0.0215 -6.6325 3  887.6828169  71510 303841273      85 976        syn-C2H3C(O)NH2, v=0
  239724.1937  0.0047 -4.8333 3  719.6151141  71510 303702248      692347        syn-C2H3C(O)NH2, v=0
  239759.2971  0.0200 -3.2560 3  145.6064 69 -71510 30334 529      33 628        syn-C2H3C(O)NH2, v=0
  239760.2683  0.0007 -3.5110 3  289.6650 85  71510 303421824      421725        syn-C2H3C(O)NH2, v=0
  239760.4346  0.0007 -3.5110 3  289.6650 85  71510 303421825      421726        syn-C2H3C(O)NH2, v=0
  239808.3609  0.0249 -4.6373 3 1034.4118171  71510 303852461      852362        syn-C2H3C(O)NH2, v=0
  239847.7502  0.0008 -5.2351 3  145.6064 69  71510 30334 629      33 628        syn-C2H3C(O)NH2, v=0
  239871.8515  0.0009 -5.3025 3  150.6727 65  71510 303321122      311121        syn-C2H3C(O)NH2, v=0
  239900.4311  0.0078 -4.3170 3  854.4255157  71510 303782059      781960        syn-C2H3C(O)NH2, v=0
  239917.0608  0.0008 -5.2349 3  145.6011 69  71510 30334 529      33 528        syn-C2H3C(O)NH2, v=0
  239960.9467  0.0015 -3.8923 3  600.0899129  71510 303642045      641946        syn-C2H3C(O)NH2, v=0
  239973.3637  0.0086 -6.3906 3  697.9745151  71510 30375 966      76 869        syn-C2H3C(O)NH2, v=0
  239973.3638  0.0086 -6.3906 3  697.9745151  71510 303751066      76 769        syn-C2H3C(O)NH2, v=0
  240005.5082  0.0200 -3.2551 3  145.6011 69 -71510 30334 629      33 528        syn-C2H3C(O)NH2, v=0
  240006.9136  0.0015 -3.7562 3  465.4406119  71510 303591148      591049        syn-C2H3C(O)NH2, v=0
  240037.8141  0.0027 -6.1620 3  274.1894 85  71510 303421627      431330        syn-C2H3C(O)NH2, v=0
  240039.1381  0.0745 -6.5936 3 1619.0179205  71510 303A23864      A13963        syn-C2H3C(O)NH2, v=0
  240039.1381  0.0745 -6.5936 3 1619.0179205  71510 303A23865      A13962        syn-C2H3C(O)NH2, v=0
  240073.6800  0.0014 -3.6733 3  297.7221 99  71510 30349 643      49 544        syn-C2H3C(O)NH2, v=0
  240073.8046  0.0014 -3.6733 3  297.7222 99  71510 30349 743      49 644        syn-C2H3C(O)NH2, v=0
  240113.4320  0.0027 -6.3123 3   12.1035 23  71510 30311 4 7      10 110        syn-C2H3C(O)NH2, v=0
  240121.1455  0.0009 -5.3016 3  150.6817 65  71510 303321121      311120        syn-C2H3C(O)NH2, v=0
  240124.8312  0.0015 -3.7558 3  465.4410119  71510 303591248      591149        syn-C2H3C(O)NH2, v=0
  240186.2959  0.0200 -3.6846 3  456.2613111 -71510 303551936      551837        syn-C2H3C(O)NH2, v=0
  240220.6807  0.0009 -5.2432 3  142.2176 67  71510 30333 727      32 726        syn-C2H3C(O)NH2, v=0
  240248.9497  0.0059 -6.4870 3  272.6181 99  71510 30349 346      50 249        syn-C2H3C(O)NH2, v=0
  240248.9497  0.0059 -6.4870 3  272.6181 99  71510 30349 446      50 149        syn-C2H3C(O)NH2, v=0
  240254.3260  0.0009 -5.2422 3  129.4776 63  71510 30331 724      30 723        syn-C2H3C(O)NH2, v=0
  240303.0138  0.0422 -6.3546 3  851.7007109  71510 3035446 8      554511        syn-C2H3C(O)NH2, v=0
  240303.0138  0.0422 -6.3546 3  851.7007109  71510 3035446 9      554510        syn-C2H3C(O)NH2, v=0
  240307.9036  0.0200 -3.6842 3  456.2567111 -71510 303551937      551838        syn-C2H3C(O)NH2, v=0
  240332.4577  0.0061 -5.4536 3   56.5188 43  71510 30321 516      21 219        syn-C2H3C(O)NH2, v=0
  240337.3902  0.0122 -6.6401 3  596.8047131  71510 303651748      661453        syn-C2H3C(O)NH2, v=0
  240382.9415  0.0037 -6.6749 3  122.7818 59  71510 303291020      30 525        syn-C2H3C(O)NH2, v=0
  240394.4889  0.0024 -3.8200 3   52.7859 41  71510 30320 614      19 515        syn-C2H3C(O)NH2, v=0
  240442.7797  0.0019 -3.9186 3  596.8047133  71510 303661552      661453        syn-C2H3C(O)NH2, v=0
  240492.9008  0.0297 -4.5598 3  985.8812169  71510 303842064      841965        syn-C2H3C(O)NH2, v=0
  240493.5120  0.0037 -4.7487 3  675.6237137  71510 303682148      672245        syn-C2H3C(O)NH2, v=0
  240536.0624  0.0200 -3.5035 3  279.2643 83 -71510 303411823      411724        syn-C2H3C(O)NH2, v=0
  240536.0624  0.0200 -3.5035 3  279.2643 83 -71510 303411824      411725        syn-C2H3C(O)NH2, v=0
  240597.0318  0.0019 -6.5879 3  355.2866 67  71510 3033331 2      3231 1        syn-C2H3C(O)NH2, v=0
  240597.0318  0.0019 -6.5879 3  355.2866 67  71510 3033331 3      3231 2        syn-C2H3C(O)NH2, v=0
  240615.4332  0.0025 -4.7473 3   97.6203 53  71510 30326 917      26 620        syn-C2H3C(O)NH2, v=0
  240678.4647  0.0018 -6.3884 3  340.9056 67  71510 3033330 3      3230 2        syn-C2H3C(O)NH2, v=0
  240678.4647  0.0018 -6.3884 3  340.9056 67  71510 3033330 4      3230 3        syn-C2H3C(O)NH2, v=0
  240686.4254  0.2018 -6.0167 3 1777.2336225  71510 303B23082      B22983        syn-C2H3C(O)NH2, v=0
  240728.8188  0.2508 -6.5750 3 2069.1906243  71510 303C13289      C13190        syn-C2H3C(O)NH2, v=0
  240765.9630  0.0017 -6.2411 3  326.9973 67  71510 3033329 4      3229 3        syn-C2H3C(O)NH2, v=0
  240765.9630  0.0017 -6.2411 3  326.9973 67  71510 3033329 5      3229 4        syn-C2H3C(O)NH2, v=0
  240791.0846  0.0082 -4.3945 3  902.8123161  71510 303802160      802061        syn-C2H3C(O)NH2, v=0
  240860.5073  0.0016 -6.1229 3  313.5619 67  71510 3033328 5      3228 4        syn-C2H3C(O)NH2, v=0
  240860.5073  0.0016 -6.1229 3  313.5619 67  71510 3033328 6      3228 5        syn-C2H3C(O)NH2, v=0
  240946.6680  0.0037 -4.7470 3  675.6228137  71510 303682147      672246        syn-C2H3C(O)NH2, v=0
  240951.3317  0.0025 -6.1794 3  226.9284 77  71510 303381523      391228        syn-C2H3C(O)NH2, v=0
  240954.1990  0.0036 -4.0664 3  698.3388143  71510 303711755      711656        syn-C2H3C(O)NH2, v=0
  240962.3543  0.0024 -4.7751 3   25.2187 31  71510 30315 412      14 113        syn-C2H3C(O)NH2, v=0
  240963.2671  0.0015 -6.0236 3  300.6000 67  71510 3033327 6      3227 5        syn-C2H3C(O)NH2, v=0
  240963.2671  0.0015 -6.0236 3  300.6000 67  71510 3033327 7      3227 6        syn-C2H3C(O)NH2, v=0
  240967.2138  0.0023 -3.8110 3  221.5701 89  71510 30344 341      44 242        syn-C2H3C(O)NH2, v=0
  240967.2141  0.0023 -3.8110 3  221.5701 89  71510 30344 441      44 342        syn-C2H3C(O)NH2, v=0
  240995.2883  0.0369 -6.3342 3  804.3027105  71510 3035245 7      534410        syn-C2H3C(O)NH2, v=0
  240995.2883  0.0369 -6.3342 3  804.3027105  71510 3035245 8      5344 9        syn-C2H3C(O)NH2, v=0
  241040.9581  0.0012 -3.6675 3  328.7797103  71510 30351 744      51 645        syn-C2H3C(O)NH2, v=0
  241041.5545  0.0012 -3.6675 3  328.7797103  71510 30351 844      51 745        syn-C2H3C(O)NH2, v=0
  241048.9139  0.0019 -4.4187 3  477.5304117  71510 303581643      571740        syn-C2H3C(O)NH2, v=0
  241075.6460  0.0015 -5.9375 3  288.1120 67  71510 3033326 7      3226 6        syn-C2H3C(O)NH2, v=0
  241075.6460  0.0015 -5.9375 3  288.1120 67  71510 3033326 8      3226 7        syn-C2H3C(O)NH2, v=0
  241135.8115  0.0014 -3.7199 3  429.4332115  71510 303571047      57 948        syn-C2H3C(O)NH2, v=0
  241167.3900  0.0015 -3.8656 3  583.9482127  71510 303632043      631944        syn-C2H3C(O)NH2, v=0
  241171.5403  0.0014 -3.7197 3  429.4334115  71510 303571147      571048        syn-C2H3C(O)NH2, v=0
  241180.7016  0.0062 -4.2398 3  811.8092151  71510 303752253      752154        syn-C2H3C(O)NH2, v=0
  241187.8393  0.1443 -5.3703 3 1432.1176203  71510 303A12576      A12477        syn-C2H3C(O)NH2, v=0
  241199.3418  0.0014 -5.8615 3  276.0983 67  71510 3033325 8      3225 7        syn-C2H3C(O)NH2, v=0
  241199.3418  0.0014 -5.8615 3  276.0983 67  71510 3033325 9      3225 8        syn-C2H3C(O)NH2, v=0
  241200.8379  0.0009 -5.2783 3  146.0945 65  71510 303321023      311022        syn-C2H3C(O)NH2, v=0
  241250.7360  0.0200 -3.4973 3  269.1219 81 -71510 303401822      401723        syn-C2H3C(O)NH2, v=0
  241250.7360  0.0200 -3.4973 3  269.1219 81 -71510 303401823      401724        syn-C2H3C(O)NH2, v=0
  241268.9887  0.0009 -5.2390 3  142.1279 67  71510 30333 627      32 626        syn-C2H3C(O)NH2, v=0
  241281.9502  0.0030 -4.2217 3  368.7368103  71510 303511437      501536        syn-C2H3C(O)NH2, v=0
  241336.4249  0.0013 -5.7934 3  264.5597 67  71510 3033324 9      3224 8        syn-C2H3C(O)NH2, v=0
  241336.4249  0.0013 -5.7934 3  264.5597 67  71510 303332410      3224 9        syn-C2H3C(O)NH2, v=0
  241357.1991  0.0015 -4.6620 3   27.4065 31  71510 30315 511      14 212        syn-C2H3C(O)NH2, v=0
  241450.1117  0.0030 -6.3947 3  138.3597 59  71510 303291317      301020        syn-C2H3C(O)NH2, v=0
  241489.4435  0.0013 -5.7317 3  253.4969 67  71510 303332310      3223 9        syn-C2H3C(O)NH2, v=0
  241489.4435  0.0013 -5.7317 3  253.4969 67  71510 303332311      322310        syn-C2H3C(O)NH2, v=0
  241499.9035  0.0009 -5.2607 3  142.0310 65  71510 30332 924      31 923        syn-C2H3C(O)NH2, v=0
  241504.7235  0.0067 -4.2367 3  807.1906153  71510 303761958      761859        syn-C2H3C(O)NH2, v=0
  241574.1308  0.0012 -3.6745 3  361.0912107  71510 30353 845      53 746        syn-C2H3C(O)NH2, v=0
  241576.6918  0.0012 -3.6745 3  361.0912107  71510 30353 945      53 846        syn-C2H3C(O)NH2, v=0
  241577.1195  0.0044 -6.2284 3  461.8777125  71510 30362 656      63 559        syn-C2H3C(O)NH2, v=0
  241577.1195  0.0044 -6.2284 3  461.8777125  71510 30362 756      63 459        syn-C2H3C(O)NH2, v=0
  241602.6158  0.0029 -4.6668 3  633.0815133  71510 303662047      652144        syn-C2H3C(O)NH2, v=0
  241626.8593  0.0013 -3.6924 3  394.6461111  71510 30355 946      55 847        syn-C2H3C(O)NH2, v=0
  241636.7943  0.0200 -3.6924 3  394.6461111 -71510 303551046      55 947        syn-C2H3C(O)NH2, v=0
  241661.5653  0.0012 -5.6755 3  242.9107 67  71510 303332211      322210        syn-C2H3C(O)NH2, v=0
  241661.5653  0.0012 -5.6755 3  242.9107 67  71510 303332212      322211        syn-C2H3C(O)NH2, v=0
  241670.3580  0.0029 -4.0039 3  655.1489139  71510 303691554      691455        syn-C2H3C(O)NH2, v=0
  241677.6456  0.0322 -6.3284 3  758.3380101  71510 3035044 6      5143 9        syn-C2H3C(O)NH2, v=0
  241677.6456  0.0322 -6.3284 3  758.3380101  71510 3035044 7      5143 8        syn-C2H3C(O)NH2, v=0
  241721.5253  0.0128 -4.4266 3  919.6627161  71510 303802357      802258        syn-C2H3C(O)NH2, v=0
  241851.4776  0.0044 -6.4538 3   29.0856 33  71510 30316 413      16 116        syn-C2H3C(O)NH2, v=0
  241856.7735  0.0012 -5.6239 3  232.8023 67  71510 303332112      322111        syn-C2H3C(O)NH2, v=0
  241856.7735  0.0012 -5.6239 3  232.8023 67  71510 303332113      322112        syn-C2H3C(O)NH2, v=0
  241857.7311  0.0032 -4.1917 3  178.1628 83  71510 30341 140      41 041        syn-C2H3C(O)NH2, v=0
  241857.7311  0.0032 -4.1917 3  178.1628 83  71510 30341 240      41 141        syn-C2H3C(O)NH2, v=0
  241860.6813  0.2245 -5.7557 3 1638.8666217  71510 303A82781      A82682        syn-C2H3C(O)NH2, v=0
  241908.7081  0.0200 -3.4926 3  259.2367 79 -71510 303391821      391722        syn-C2H3C(O)NH2, v=0
  241908.7081  0.0200 -3.4926 3  259.2367 79 -71510 303391822      391723        syn-C2H3C(O)NH2, v=0
  241972.8796  0.0026 -4.0920 3  728.6373143  71510 303712151      712052        syn-C2H3C(O)NH2, v=0
  241978.2768  0.0010 -3.6623 3  442.4667109  71510 303541935      541836        syn-C2H3C(O)NH2, v=0
  242023.1675  0.1252 -5.5032 3 1507.3869207  71510 303A32875      A32776        syn-C2H3C(O)NH2, v=0
  242033.7744  0.0169 -6.6813 3  811.8092149  71510 303742451      752154        syn-C2H3C(O)NH2, v=0
  242044.6299  0.0010 -3.6620 3  442.4642109  71510 303541936      541837        syn-C2H3C(O)NH2, v=0
  242080.1425  0.0011 -5.5764 3  223.1729 67  71510 303332013      322012        syn-C2H3C(O)NH2, v=0
  242080.1425  0.0011 -5.5764 3  223.1729 67  71510 303332014      322013        syn-C2H3C(O)NH2, v=0
  242181.4316  0.0028 -3.8906 3  222.1388 81  71510 303401030      391129        syn-C2H3C(O)NH2, v=0
  242207.6676  0.0028 -6.1587 3  325.7893 93  71510 303461730      471433        syn-C2H3C(O)NH2, v=0
  242242.1062  0.3148 -6.1722 3 1859.2494231  71510 303B52986      B52887        syn-C2H3C(O)NH2, v=0
  242326.7033  0.0623 -5.0412 3 1259.7564189  71510 303942668      942569        syn-C2H3C(O)NH2, v=0
  242338.2335  0.0011 -5.5325 3  214.0244 67  71510 303331914      321913        syn-C2H3C(O)NH2, v=0
  242338.2335  0.0011 -5.5325 3  214.0244 67  71510 303331915      321914        syn-C2H3C(O)NH2, v=0
  242349.8980  0.0280 -6.3409 3  713.8074 97  71510 3034843 5      4942 8        syn-C2H3C(O)NH2, v=0
  242349.8980  0.0280 -6.3409 3  713.8074 97  71510 3034843 6      4942 7        syn-C2H3C(O)NH2, v=0
  242367.9091  0.0025 -4.4317 3  499.2713119  71510 303591742      581841        syn-C2H3C(O)NH2, v=0
  242492.5682  0.0014 -3.8609 3  583.8972127  71510 303632044      631945        syn-C2H3C(O)NH2, v=0
  242513.9641  0.0200 -3.4892 3  249.6079 77 -71510 303381820      381721        syn-C2H3C(O)NH2, v=0
  242513.9641  0.0200 -3.4892 3  249.6079 77 -71510 303381821      381722        syn-C2H3C(O)NH2, v=0
  242586.9754  0.0017 -3.8614 3  556.5854129  71510 303641351      641252        syn-C2H3C(O)NH2, v=0
  242639.6805  0.0010 -5.4919 3  205.3588 67  71510 303331815      321814        syn-C2H3C(O)NH2, v=0
  242639.6805  0.0010 -5.4919 3  205.3588 67  71510 303331816      321815        syn-C2H3C(O)NH2, v=0
  242737.2069  0.0030 -4.6626 3  633.0789133  71510 303662046      652145        syn-C2H3C(O)NH2, v=0
  242749.2100  0.0024 -4.5893 3  591.9926129  71510 303641946      632043        syn-C2H3C(O)NH2, v=0
  242809.2410  0.0029 -6.3905 3  138.3144 59  71510 303291316      301021        syn-C2H3C(O)NH2, v=0
  242864.8025  0.0059 -6.3141 3  619.3888143  71510 30371 863      72 766        syn-C2H3C(O)NH2, v=0
  242864.8026  0.0059 -6.3141 3  619.3888143  71510 30371 963      72 666        syn-C2H3C(O)NH2, v=0
  242910.0328  0.0200 -3.3526 3  142.1279 67 -71510 30333 727      32 626        syn-C2H3C(O)NH2, v=0
  242992.5328  0.0010 -5.2720 3  146.1760 65  71510 303321022      311021        syn-C2H3C(O)NH2, v=0
  242996.0848  0.0010 -5.4542 3  197.1790 67  71510 303331716      321715        syn-C2H3C(O)NH2, v=0
  242996.0848  0.0010 -5.4542 3  197.1790 67  71510 303331717      321716        syn-C2H3C(O)NH2, v=0
  243011.8468  0.0242 -6.3768 3  670.7118 93  71510 3034642 4      4741 7        syn-C2H3C(O)NH2, v=0
  243011.8468  0.0242 -6.3768 3  670.7118 93  71510 3034642 5      4741 6        syn-C2H3C(O)NH2, v=0
  243070.1167  0.0200 -3.4873 3  240.2348 75 -71510 303371819      371720        syn-C2H3C(O)NH2, v=0
  243070.1167  0.0200 -3.4873 3  240.2348 75 -71510 303371820      371721        syn-C2H3C(O)NH2, v=0
  243076.8804  0.0200 -3.7373 3  249.4123 93 -71510 30346 442      46 343        syn-C2H3C(O)NH2, v=0
  243076.8804  0.0200 -3.7373 3  249.4123 93 -71510 30346 542      46 443        syn-C2H3C(O)NH2, v=0
  243085.8352  0.0144 -6.5123 3  799.1166161  71510 303801070      81 973        syn-C2H3C(O)NH2, v=0
  243085.8352  0.0144 -6.5123 3  799.1166161  71510 303801170      81 873        syn-C2H3C(O)NH2, v=0
  243164.4971  0.0200 -3.4622 3   53.5994 39 -71510 30319 812      18 711        syn-C2H3C(O)NH2, v=0
  243220.0967  0.0200 -3.8592 3  556.5883129 -71510 303641451      641352        syn-C2H3C(O)NH2, v=0
  243253.2813  0.0055 -4.3981 3  910.8442161  71510 303802259      802160        syn-C2H3C(O)NH2, v=0
  243305.3139  0.3940 -6.6171 3 2093.2106245  71510 303C23191      C23092        syn-C2H3C(O)NH2, v=0
  243423.4396  0.0010 -5.4191 3  189.4888 67  71510 303331618      321617        syn-C2H3C(O)NH2, v=0
  243423.4403  0.0010 -5.4191 3  189.4888 67  71510 303331617      321616        syn-C2H3C(O)NH2, v=0
  243433.9794  0.0025 -4.0328 3  692.9584139  71510 303692148      692049        syn-C2H3C(O)NH2, v=0
  243454.1841  0.0196 -4.4265 3  914.5737163  71510 303811962      811863        syn-C2H3C(O)NH2, v=0
  243458.1247  0.0888 -6.6757 3 1149.8644131  71510 303655213      665116        syn-C2H3C(O)NH2, v=0
  243458.1247  0.0888 -6.6757 3 1149.8644131  71510 303655214      665115        syn-C2H3C(O)NH2, v=0
  243465.3505  0.0019 -4.4583 3  514.2034121  71510 303601744      591841        syn-C2H3C(O)NH2, v=0
  243494.5243  0.0103 -6.5573 3  729.0230141  71510 303702348      712051        syn-C2H3C(O)NH2, v=0
  243524.4723  0.0040 -6.6506 3  130.1913 61  71510 303301021      31 526        syn-C2H3C(O)NH2, v=0
  243533.8296  0.0048 -6.2509 3  397.8084117  71510 30358 553      59 456        syn-C2H3C(O)NH2, v=0
  243533.8297  0.0048 -6.2509 3  397.8084117  71510 30358 653      59 356        syn-C2H3C(O)NH2, v=0
  243574.7800  0.0200 -3.2909 3   42.6206 27 -71510 3031311 2      1210 3        syn-C2H3C(O)NH2, v=0
  243574.7800  0.0200 -3.2909 3   42.6206 27 -71510 3031311 3      1210 2        syn-C2H3C(O)NH2, v=0
  243580.4949  0.0200 -3.4870 3  231.1167 73 -71510 303361818      361719        syn-C2H3C(O)NH2, v=0
  243580.4949  0.0200 -3.4870 3  231.1167 73 -71510 303361819      361720        syn-C2H3C(O)NH2, v=0
  243603.5778  0.0021 -4.5182 3  552.3633125  71510 303621845      611942        syn-C2H3C(O)NH2, v=0
  243620.2360  0.0200 -3.6412 3  428.9433107 -71510 303531934      531835        syn-C2H3C(O)NH2, v=0
  243632.9291  0.0065 -4.4336 3  931.4958163  71510 303812260      812161        syn-C2H3C(O)NH2, v=0
  243655.7735  0.0200 -3.6411 3  428.9420107 -71510 303531935      531836        syn-C2H3C(O)NH2, v=0
  243663.2822  0.0209 -6.4449 3  629.0518 89  71510 3034441 3      4540 6        syn-C2H3C(O)NH2, v=0
  243663.2822  0.0209 -6.4449 3  629.0518 89  71510 3034441 4      4540 5        syn-C2H3C(O)NH2, v=0
  243663.4583  0.0074 -6.5408 3  258.1826 87  71510 303431132      44 837        syn-C2H3C(O)NH2, v=0
  243711.4933  0.0200 -3.4607 3   53.5837 39 -71510 30319 811      18 712        syn-C2H3C(O)NH2, v=0
  243737.4266  0.0049 -4.3610 3  890.4350159  71510 303792258      792159        syn-C2H3C(O)NH2, v=0
  243759.5073  0.0032 -6.1784 3  381.8516101  71510 303501833      511536        syn-C2H3C(O)NH2, v=0
  243794.3585  0.0047 -4.0936 3  716.1123145  71510 303721656      721557        syn-C2H3C(O)NH2, v=0
  243944.5127  0.0010 -5.3864 3  182.2936 67  71510 303331519      321518        syn-C2H3C(O)NH2, v=0
  243944.5271  0.0010 -5.3864 3  182.2936 67  71510 303331518      321517        syn-C2H3C(O)NH2, v=0
  243945.7001  0.0200 -3.3365 3   44.7423 31 -71510 3031510 6      14 9 5        syn-C2H3C(O)NH2, v=0
  243945.7001  0.0200 -3.3365 3   44.7423 31 -71510 3031510 5      14 9 6        syn-C2H3C(O)NH2, v=0
  244048.2400  0.0200 -3.4884 3  222.2527 71 -71510 303351817      351718        syn-C2H3C(O)NH2, v=0
  244048.2400  0.0200 -3.4884 3  222.2527 71 -71510 303351818      351719        syn-C2H3C(O)NH2, v=0
  244084.3630  0.0200 -3.3888 3   48.3743 35 -71510 30317 9 9      16 8 8        syn-C2H3C(O)NH2, v=0
  244089.4235  0.0200 -3.3888 3   48.3742 35 -71510 30317 9 8      16 8 9        syn-C2H3C(O)NH2, v=0
  244124.3033  0.0013 -3.8334 3  568.0129125  71510 303622042      621943        syn-C2H3C(O)NH2, v=0
  244124.3275  0.0009 -5.2337 3  131.7542 63  71510 30331 823      30 822        syn-C2H3C(O)NH2, v=0
  244200.4295  0.0792 -6.6062 3 1094.3701127  71510 303635112      645015        syn-C2H3C(O)NH2, v=0
  244200.4295  0.0792 -6.6062 3 1094.3701127  71510 303635113      645014        syn-C2H3C(O)NH2, v=0
  244303.9831  0.0180 -6.5610 3  588.8283 85  71510 3034240 2      4339 5        syn-C2H3C(O)NH2, v=0
  244303.9831  0.0180 -6.5610 3  588.8283 85  71510 3034240 3      4339 4        syn-C2H3C(O)NH2, v=0
  244472.0861  0.0026 -3.9944 3  655.1645139  71510 303691654      691555        syn-C2H3C(O)NH2, v=0
  244476.1903  0.0200 -3.4915 3  213.6421 69 -71510 303341816      341717        syn-C2H3C(O)NH2, v=0
  244476.1903  0.0200 -3.4915 3  213.6421 69 -71510 303341817      341718        syn-C2H3C(O)NH2, v=0
  244518.6433  0.0066 -6.4483 3  650.6830133  71510 303662245      671948        syn-C2H3C(O)NH2, v=0
  244534.1990  0.0025 -6.1476 3  274.0395 85  71510 303421626      431331        syn-C2H3C(O)NH2, v=0
  244593.0348  0.0009 -5.3558 3  175.6007 67  71510 303331420      321419        syn-C2H3C(O)NH2, v=0
  244593.3035  0.0009 -5.3558 3  175.6007 67  71510 303331419      321418        syn-C2H3C(O)NH2, v=0
  244596.0502  0.0028 -3.9364 3  204.0144 87  71510 30343 241      43 142        syn-C2H3C(O)NH2, v=0
  244596.0502  0.0028 -3.9364 3  204.0144 87  71510 30343 341      43 242        syn-C2H3C(O)NH2, v=0
  244597.0114  0.0053 -4.1564 3  761.0950149  71510 303741857      741758        syn-C2H3C(O)NH2, v=0
  244641.6472  0.0017 -5.8798 3   13.9233 23  71510 30311 5 6      10 2 9        syn-C2H3C(O)NH2, v=0
  244662.1942  0.0023 -4.0552 3  710.5804141  71510 303702150      702051        syn-C2H3C(O)NH2, v=0
  244733.3706  0.0037 -6.2188 3  442.3745109  71510 303541936      551639        syn-C2H3C(O)NH2, v=0
  244740.8648  0.0200 -3.4682 3  154.4342 69 -71510 30334 727      33 826        syn-C2H3C(O)NH2, v=0
  244792.3867  0.0023 -5.3568 3   50.1456 39  71510 30319 713      19 416        syn-C2H3C(O)NH2, v=0
  244844.6813  0.0027 -5.5081 3   48.8429 37  71510 30318 810      18 513        syn-C2H3C(O)NH2, v=0
  244851.3257  0.0200 -3.6954 3  278.5386 97 -71510 30348 543      48 444        syn-C2H3C(O)NH2, v=0
  244851.3257  0.0200 -3.6954 3  278.5386 97 -71510 30348 643      48 544        syn-C2H3C(O)NH2, v=0
  244867.1251  0.0200 -3.4966 3  205.2845 67 -71510 303331815      331716        syn-C2H3C(O)NH2, v=0
  244867.1251  0.0200 -3.4966 3  205.2845 67 -71510 303331816      331717        syn-C2H3C(O)NH2, v=0
  244882.3110  0.0125 -4.3045 3  845.8350157  71510 303781860      781761        syn-C2H3C(O)NH2, v=0
  244913.3258  0.0013 -3.8307 3  567.9828125  71510 303622043      621944        syn-C2H3C(O)NH2, v=0
  244929.8625  0.0078 -4.1937 3  779.6776151  71510 303751758      751659        syn-C2H3C(O)NH2, v=0
  244933.5804  0.0704 -6.5442 3 1040.3037123  71510 303615011      624914        syn-C2H3C(O)NH2, v=0
  244933.5804  0.0704 -6.5442 3 1040.3037123  71510 303615012      624913        syn-C2H3C(O)NH2, v=0
  244963.6565  0.0078 -4.4673 3  952.3812165  71510 303822261      822162        syn-C2H3C(O)NH2, v=0
  244965.7554  0.0046 -4.3227 3  870.2768157  71510 303782257      782158        syn-C2H3C(O)NH2, v=0
  244967.0608  0.0099 -4.4204 3  923.3246163  71510 303812161      812062        syn-C2H3C(O)NH2, v=0
  245083.5605  0.0049 -6.3550 3  576.7929125  71510 303622142      631845        syn-C2H3C(O)NH2, v=0
  245120.2898  0.0054 -6.3294 3  338.2554109  71510 30354 450      55 353        syn-C2H3C(O)NH2, v=0
  245120.2898  0.0054 -6.3294 3  338.2554109  71510 30354 550      55 253        syn-C2H3C(O)NH2, v=0
  245130.5743  0.0200 -3.6214 3  415.6892105 -71510 303521933      521834        syn-C2H3C(O)NH2, v=0
  245149.2685  0.0009 -3.6214 3  415.6886105  71510 303521934      521835        syn-C2H3C(O)NH2, v=0
  245151.0617  0.0015 -3.8076 3  517.5547125  71510 303621250      621151        syn-C2H3C(O)NH2, v=0
  245164.3694  0.0042 -6.2781 3  507.3558117  71510 303582039      591742        syn-C2H3C(O)NH2, v=0
  245223.5208  0.0200 -3.5037 3  197.1790 65 -71510 303321814      321715        syn-C2H3C(O)NH2, v=0
  245223.5208  0.0200 -3.5037 3  197.1790 65 -71510 303321815      321716        syn-C2H3C(O)NH2, v=0
  245254.5115  0.0035 -5.5005 3   47.2159 39  71510 30319 614      19 317        syn-C2H3C(O)NH2, v=0
  245308.9366  0.0200 -3.3286 3  150.2305 69 -71510 30334 628      33 727        syn-C2H3C(O)NH2, v=0
  245368.1822  0.0015 -3.8069 3  517.5555125  71510 303621350      621251        syn-C2H3C(O)NH2, v=0
  245388.3614  0.0008 -5.1712 3  161.0687 79  71510 30339 138      38 137        syn-C2H3C(O)NH2, v=0
  245388.3801  0.0200 -3.0016 3  161.0687 79 -71510 30339 138      38 237        syn-C2H3C(O)NH2, v=0
  245388.3801  0.0200 -3.0016 3  161.0687 79 -71510 30339 238      38 137        syn-C2H3C(O)NH2, v=0
  245388.3614  0.0008 -5.1712 3  161.0687 79  71510 30339 238      38 237        syn-C2H3C(O)NH2, v=0
  245395.3519  0.0009 -5.1570 3  161.5898 81  71510 30340 040      39 039        syn-C2H3C(O)NH2, v=0
  245395.3682  0.0200 -2.9606 3  161.5898 81 -71510 30340 040      39 139        syn-C2H3C(O)NH2, v=0
  245395.3682  0.0200 -2.9606 3  161.5898 81 -71510 30340 140      39 039        syn-C2H3C(O)NH2, v=0
  245395.3519  0.0009 -5.1570 3  161.5898 81  71510 30340 140      39 139        syn-C2H3C(O)NH2, v=0
  245397.1963  0.0200 -3.0466 3  160.0315 77 -71510 30338 236      37 335        syn-C2H3C(O)NH2, v=0
  245397.2021  0.0008 -5.1845 3  160.0315 77  71510 30338 336      37 335        syn-C2H3C(O)NH2, v=0
  245397.2025  0.0008 -5.1845 3  160.0315 77  71510 30338 236      37 235        syn-C2H3C(O)NH2, v=0
  245397.1963  0.0200 -3.0466 3  160.0315 77 -71510 30338 336      37 235        syn-C2H3C(O)NH2, v=0
  245420.7447  0.0009 -5.3271 3  169.4210 67  71510 303331321      321320        syn-C2H3C(O)NH2, v=0
  245424.8099  0.0009 -5.3271 3  169.4211 67  71510 303331320      321319        syn-C2H3C(O)NH2, v=0
  245444.4884  0.0200 -3.0971 3  158.4613 75 -71510 30337 334      36 433        syn-C2H3C(O)NH2, v=0
  245444.4683  0.0008 -5.1969 3  158.4613 75  71510 30337 434      36 433        syn-C2H3C(O)NH2, v=0
  245444.5013  0.0008 -5.1969 3  158.4613 75  71510 30337 334      36 333        syn-C2H3C(O)NH2, v=0
  245444.4884  0.0200 -3.0971 3  158.4613 75 -71510 30337 434      36 333        syn-C2H3C(O)NH2, v=0
  245452.5004  0.0047 -6.2636 3  545.2994135  71510 30367 760      68 663        syn-C2H3C(O)NH2, v=0
  245452.5004  0.0047 -6.2636 3  545.2994135  71510 30367 860      68 563        syn-C2H3C(O)NH2, v=0
  245494.1000  0.0026 -4.5789 3  591.9859129  71510 303641945      632044        syn-C2H3C(O)NH2, v=0
  245547.7839  0.0200 -3.5131 3  189.3251 63 -71510 303311813      311714        syn-C2H3C(O)NH2, v=0
  245547.7839  0.0200 -3.5131 3  189.3251 63 -71510 303311814      311715        syn-C2H3C(O)NH2, v=0
  245571.6245  0.0200 -3.1558 3  156.3329 73 -71510 30336 432      35 531        syn-C2H3C(O)NH2, v=0
  245573.2164  0.0008 -5.2080 3  156.3329 73  71510 30336 532      35 531        syn-C2H3C(O)NH2, v=0
  245574.6448  0.0008 -5.2080 3  156.3328 73  71510 30336 432      35 431        syn-C2H3C(O)NH2, v=0
  245576.2182  0.0200 -3.1558 3  156.3328 73 -71510 30336 532      35 431        syn-C2H3C(O)NH2, v=0
  245588.0122  0.0091 -4.3378 3  874.3190159  71510 303792060      791961        syn-C2H3C(O)NH2, v=0
  245639.2012  0.0616 -4.8562 3 1159.2520183  71510 303912269      912170        syn-C2H3C(O)NH2, v=0
  245645.1480  0.0087 -6.5031 3  410.3074109  71510 303541440      551145        syn-C2H3C(O)NH2, v=0
  245657.4464  0.0624 -6.4903 3  987.6661119  71510 303594910      604813        syn-C2H3C(O)NH2, v=0
  245657.4464  0.0624 -6.4903 3  987.6661119  71510 303594911      604812        syn-C2H3C(O)NH2, v=0
  245736.2658  0.0009 -5.2267 3  137.4916 65  71510 30332 725      31 724        syn-C2H3C(O)NH2, v=0
  245772.9333  0.0008 -5.2348 3  146.2361 67  71510 30333 826      32 825        syn-C2H3C(O)NH2, v=0
  245811.6094  0.0200 -3.2277 3  153.6068 71 -71510 30335 530      34 629        syn-C2H3C(O)NH2, v=0
  245842.0614  0.0200 -3.5250 3  181.7223 61 -71510 303301812      301713        syn-C2H3C(O)NH2, v=0
  245842.0614  0.0200 -3.5250 3  181.7223 61 -71510 303301813      301714        syn-C2H3C(O)NH2, v=0
  245860.6620  0.0008 -5.2174 3  153.6068 71  71510 30335 630      34 629        syn-C2H3C(O)NH2, v=0
  245900.0273  0.0008 -5.2173 3  153.6039 71  71510 30335 530      34 529        syn-C2H3C(O)NH2, v=0
  245949.1130  0.0008 -3.2272 3  153.6039 71  71510 30335 630      34 529        syn-C2H3C(O)NH2, v=0
  245998.6850  0.0235 -6.6576 3  906.9564171  71510 303851174      861077        syn-C2H3C(O)NH2, v=0
  245998.6850  0.0235 -6.6576 3  906.9564171  71510 303851274      86 977        syn-C2H3C(O)NH2, v=0
  246013.4986  0.0030 -4.2796 3  414.5363109  71510 303541539      531638        syn-C2H3C(O)NH2, v=0
  246108.5909  0.0200 -3.5398 3  174.3699 59 -71510 303291811      291712        syn-C2H3C(O)NH2, v=0
  246108.5909  0.0200 -3.5398 3  174.3699 59 -71510 303291812      291713        syn-C2H3C(O)NH2, v=0
  246190.0315  0.0031 -6.6386 3   99.1343 49  71510 303241213      25 916        syn-C2H3C(O)NH2, v=0
  246193.5016  0.0035 -4.1275 3   45.6020 39  71510 30319 514      18 415        syn-C2H3C(O)NH2, v=0
  246222.1764  0.0095 -6.4119 3  715.0338153  71510 30376 967      77 870        syn-C2H3C(O)NH2, v=0
  246222.1764  0.0095 -6.4119 3  715.0338153  71510 303761067      77 770        syn-C2H3C(O)NH2, v=0
  246268.9572  0.0200 -3.6748 3  308.9397101 -71510 30350 644      50 545        syn-C2H3C(O)NH2, v=0
  246268.9572  0.0200 -3.6748 3  308.9397101 -71510 30350 744      50 645        syn-C2H3C(O)NH2, v=0
  246292.2940  0.0008 -5.2249 3  150.2305 69  71510 30334 728      33 727        syn-C2H3C(O)NH2, v=0
  246308.7965  0.0061 -6.4974 3  283.2260101  71510 30350 347      51 250        syn-C2H3C(O)NH2, v=0
  246308.7965  0.0061 -6.4974 3  283.2260101  71510 30350 447      51 150        syn-C2H3C(O)NH2, v=0
  246349.2232  0.0200 -3.5579 3  167.2674 57 -71510 303281810      281711        syn-C2H3C(O)NH2, v=0
  246349.2232  0.0200 -3.5579 3  167.2674 57 -71510 303281811      281712        syn-C2H3C(O)NH2, v=0
  246371.8880  0.0551 -6.4456 3  936.4583115  71510 3035748 9      584712        syn-C2H3C(O)NH2, v=0
  246371.8880  0.0551 -6.4456 3  936.4583115  71510 303574810      584711        syn-C2H3C(O)NH2, v=0
  246482.7359  0.2537 -6.2457 3 1905.0831233  71510 303B63185      B63086        syn-C2H3C(O)NH2, v=0
  246501.1602  0.0009 -5.2999 3  163.7711 67  71510 303331222      321221        syn-C2H3C(O)NH2, v=0
  246523.7399  0.0200 -3.6029 3  402.7029103 -71510 303511932      511833        syn-C2H3C(O)NH2, v=0
  246533.3303  0.0200 -3.6029 3  402.7025103 -71510 303511933      511834        syn-C2H3C(O)NH2, v=0
  246550.0813  0.0009 -5.2997 3  163.7727 67  71510 303331221      321220        syn-C2H3C(O)NH2, v=0
  246550.7116  0.0028 -6.2813 3  175.5354 67  71510 303331420      341123        syn-C2H3C(O)NH2, v=0
  246565.8796  0.0200 -3.5799 3  160.4144 55 -71510 3032718 9      271710        syn-C2H3C(O)NH2, v=0
  246565.8796  0.0200 -3.5799 3  160.4144 55 -71510 303271810      271711        syn-C2H3C(O)NH2, v=0
  246582.7130  0.0200 -3.9315 3  613.1440135 -71510 303671453      671354        syn-C2H3C(O)NH2, v=0
  246716.0105  0.0030 -6.6370 3   99.1167 49  71510 303241212      25 917        syn-C2H3C(O)NH2, v=0
  246742.5720  0.0012 -3.8033 3  552.3633123  71510 303612041      611942        syn-C2H3C(O)NH2, v=0
  246760.3190  0.0200 -3.6063 3  153.8103 53 -71510 3032618 8      2617 9        syn-C2H3C(O)NH2, v=0
  246760.3190  0.0200 -3.6063 3  153.8103 53 -71510 3032618 9      261710        syn-C2H3C(O)NH2, v=0
  246794.2496  0.0219 -5.5129 3 1088.8275171  71510 303852957      843054        syn-C2H3C(O)NH2, v=0
  246794.5096  0.0219 -5.5129 3 1088.8275171  71510 303852956      843055        syn-C2H3C(O)NH2, v=0
  246798.2177  0.0200 -3.7623 3  479.7201121 -71510 303601149      601050        syn-C2H3C(O)NH2, v=0
  246798.3899  0.0043 -4.2836 3  850.3775155  71510 303772256      772157        syn-C2H3C(O)NH2, v=0
  246813.7633  0.0259 -5.6227 3 1144.8187175  71510 303873058      863155        syn-C2H3C(O)NH2, v=0
  246813.8523  0.0259 -5.6227 3 1144.8187175  71510 303873057      863156        syn-C2H3C(O)NH2, v=0
  246857.5203  0.0184 -5.4061 3 1034.2709167  71510 303832856      822953        syn-C2H3C(O)NH2, v=0
  246858.2702  0.0184 -5.4061 3 1034.2708167  71510 303832855      822954        syn-C2H3C(O)NH2, v=0
  246867.4535  0.0200 -3.7621 3  479.7204121 -71510 303601249      601150        syn-C2H3C(O)NH2, v=0
  246904.9901  0.0303 -5.7354 3 1202.2429179  71510 303893159      883256        syn-C2H3C(O)NH2, v=0
  246905.0203  0.0303 -5.7354 3 1202.2429179  71510 303893158      883257        syn-C2H3C(O)NH2, v=0
  246934.2274  0.0200 -3.6384 3  147.4547 51 -71510 3032518 7      2517 8        syn-C2H3C(O)NH2, v=0
  246934.2274  0.0200 -3.6384 3  147.4547 51 -71510 3032518 8      2517 9        syn-C2H3C(O)NH2, v=0
  246949.9814  0.0009 -5.2223 3  150.1758 69  71510 30334 628      33 627        syn-C2H3C(O)NH2, v=0
  247017.1271  0.0154 -5.3021 3  981.1502163  71510 303812755      802852        syn-C2H3C(O)NH2, v=0
  247019.2611  0.0154 -5.3021 3  981.1502163  71510 303812754      802853        syn-C2H3C(O)NH2, v=0
  247040.2897  0.0200 -3.8095 3  231.1688 91 -71510 30345 342      45 243        syn-C2H3C(O)NH2, v=0
  247040.2897  0.0200 -3.8095 3  231.1688 91 -71510 30345 442      45 343        syn-C2H3C(O)NH2, v=0
  247058.8336  0.0353 -5.8510 3 1261.0987183  71510 303913260      903357        syn-C2H3C(O)NH2, v=0
  247058.8437  0.0353 -5.8510 3 1261.0987183  71510 303913259      903358        syn-C2H3C(O)NH2, v=0
  247076.7566  0.0485 -6.4113 3  886.6814111  71510 3035547 8      564611        syn-C2H3C(O)NH2, v=0
  247076.7566  0.0485 -6.4113 3  886.6814111  71510 3035547 9      564610        syn-C2H3C(O)NH2, v=0
  247089.1616  0.0200 -3.6773 3  141.3472 49 -71510 3032418 6      2417 7        syn-C2H3C(O)NH2, v=0
  247089.1616  0.0200 -3.6773 3  141.3472 49 -71510 3032418 7      2417 8        syn-C2H3C(O)NH2, v=0
  247193.0006  0.0369 -4.7938 3 1132.6132179  71510 303892564      892465        syn-C2H3C(O)NH2, v=0
  247203.7599  0.0200 -3.8017 3  552.3458123 -71510 303612042      611943        syn-C2H3C(O)NH2, v=0
  247226.6643  0.0200 -3.7253 3  135.4872 47 -71510 3032318 5      2317 6        syn-C2H3C(O)NH2, v=0
  247226.6643  0.0200 -3.7253 3  135.4872 47 -71510 3032318 6      2317 7        syn-C2H3C(O)NH2, v=0
  247267.7626  0.0409 -5.9695 3 1321.3848187  71510 303933361      923458        syn-C2H3C(O)NH2, v=0
  247267.7660  0.0409 -5.9695 3 1321.3848187  71510 303933360      923459        syn-C2H3C(O)NH2, v=0
  247289.6676  0.0127 -5.2010 3  929.4670159  71510 303792654      782751        syn-C2H3C(O)NH2, v=0
  247291.4270  0.0097 -4.4992 3  973.4918167  71510 303832262      832163        syn-C2H3C(O)NH2, v=0
  247295.6522  0.0127 -5.2010 3  929.4670159  71510 303792653      782752        syn-C2H3C(O)NH2, v=0
  247303.5065  0.0012 -3.6701 3  340.6061105  71510 30352 745      52 646        syn-C2H3C(O)NH2, v=0
  247303.8261  0.0012 -3.6701 3  340.6061105  71510 30352 845      52 746        syn-C2H3C(O)NH2, v=0
  247348.1422  0.0200 -3.7854 3  129.8744 45 -71510 3032218 4      2217 5        syn-C2H3C(O)NH2, v=0
  247348.1422  0.0200 -3.7854 3  129.8744 45 -71510 3032218 5      2217 6        syn-C2H3C(O)NH2, v=0
  247417.7271  0.0021 -4.0191 3  692.8012139  71510 303692149      692050        syn-C2H3C(O)NH2, v=0
  247454.9806  0.0200 -3.8633 3  124.5085 43 -71510 3032118 3      2117 4        syn-C2H3C(O)NH2, v=0
  247454.9806  0.0200 -3.8633 3  124.5085 43 -71510 3032118 4      2117 5        syn-C2H3C(O)NH2, v=0
  247517.8968  0.0026 -6.1418 3  325.6123 93  71510 303461729      471434        syn-C2H3C(O)NH2, v=0
  247525.4918  0.0471 -6.0909 3 1383.0997191  71510 303953462      943559        syn-C2H3C(O)NH2, v=0
  247525.4929  0.0471 -6.0909 3 1383.0997191  71510 303953461      943560        syn-C2H3C(O)NH2, v=0
  247548.3661  0.0200 -3.9690 3  119.3889 41 -71510 3032018 2      2017 3        syn-C2H3C(O)NH2, v=0
  247548.3661  0.0200 -3.9690 3  119.3889 41 -71510 3032018 3      2017 4        syn-C2H3C(O)NH2, v=0
  247549.0419  0.0048 -4.1881 3  792.5725149  71510 303742252      742153        syn-C2H3C(O)NH2, v=0
  247610.4736  0.0032 -4.4838 3  134.2652 63  71510 30331 922      31 625        syn-C2H3C(O)NH2, v=0
  247614.2169  0.0335 -5.5450 3  866.0594159  71510 303791961      782058        syn-C2H3C(O)NH2, v=0
  247629.6166  0.0200 -4.1256 3  114.5155 39 -71510 3031918 1      1917 2        syn-C2H3C(O)NH2, v=0
  247629.6166  0.0200 -4.1256 3  114.5155 39 -71510 3031918 2      1917 3        syn-C2H3C(O)NH2, v=0
  247662.6308  0.0200 -3.9279 3  613.1492135 -71510 303671553      671454        syn-C2H3C(O)NH2, v=0
  247668.5473  0.0021 -3.9923 3  675.3986137  71510 303682147      682048        syn-C2H3C(O)NH2, v=0
  247695.2380  0.0104 -5.1028 3  879.2231155  71510 303772553      762650        syn-C2H3C(O)NH2, v=0
  247699.7813  0.0013 -4.4068 3  109.8878 37  71510 3031818 0      1817 1        syn-C2H3C(O)NH2, v=0
  247699.7813  0.0013 -4.4068 3  109.8878 37  71510 3031818 1      1817 2        syn-C2H3C(O)NH2, v=0
  247711.7518  0.0104 -5.1027 3  879.2231155  71510 303772552      762651        syn-C2H3C(O)NH2, v=0
  247718.4264  0.0045 -6.2444 3  475.7126127  71510 30363 657      64 560        syn-C2H3C(O)NH2, v=0
  247718.4264  0.0045 -6.2444 3  475.7126127  71510 30363 757      64 460        syn-C2H3C(O)NH2, v=0
  247735.8987  0.0200 -3.7254 3  443.0960117 -71510 303581048      58 949        syn-C2H3C(O)NH2, v=0
  247756.3307  0.0200 -3.7253 3  443.0961117 -71510 303581148      581049        syn-C2H3C(O)NH2, v=0
  247771.8947  0.0426 -6.3893 3  838.3361107  71510 3035346 7      544510        syn-C2H3C(O)NH2, v=0
  247771.8947  0.0426 -6.3893 3  838.3361107  71510 3035346 8      5445 9        syn-C2H3C(O)NH2, v=0
  247795.2059  0.0034 -4.7451 3   28.5619 33  71510 30316 313      15 214        syn-C2H3C(O)NH2, v=0
  247811.0977  0.0200 -3.5856 3  389.9827101 -71510 303501931      501832        syn-C2H3C(O)NH2, v=0
  247815.9602  0.0200 -3.5855 3  389.9826101 -71510 303501932      501833        syn-C2H3C(O)NH2, v=0
  247826.7354  0.0540 -6.2154 3 1446.2420195  71510 303973563      963660        syn-C2H3C(O)NH2, v=0
  247826.7358  0.0540 -6.2154 3 1446.2420195  71510 303973562      963661        syn-C2H3C(O)NH2, v=0
  247858.4432  0.0021 -6.6096 3  378.1628 69  71510 3033432 2      3332 1        syn-C2H3C(O)NH2, v=0
  247858.4432  0.0021 -6.6096 3  378.1628 69  71510 3033432 3      3332 2        syn-C2H3C(O)NH2, v=0
  247863.7849  0.0009 -5.2741 3  158.6739 67  71510 303331123      321122        syn-C2H3C(O)NH2, v=0
  247903.7432  0.0032 -4.1883 3  186.7522 85  71510 30342 141      42 042        syn-C2H3C(O)NH2, v=0
  247903.7432  0.0032 -4.1883 3  186.7522 85  71510 30342 241      42 142        syn-C2H3C(O)NH2, v=0
  247922.5117  0.0200 -3.6782 3  373.5278109 -71510 30354 846      54 747        syn-C2H3C(O)NH2, v=0
  247923.9035  0.0200 -3.6782 3  373.5278109 -71510 30354 946      54 847        syn-C2H3C(O)NH2, v=0
  247933.3478  0.0200 -3.3187 3  150.1758 69 -71510 30334 728      33 627        syn-C2H3C(O)NH2, v=0
  247940.5877  0.0019 -6.4089 3  363.3121 69  71510 3033431 3      3331 2        syn-C2H3C(O)NH2, v=0
  247940.5877  0.0019 -6.4089 3  363.3121 69  71510 3033431 4      3331 3        syn-C2H3C(O)NH2, v=0
  248028.5034  0.0018 -6.2604 3  348.9338 69  71510 3033430 4      3330 3        syn-C2H3C(O)NH2, v=0
  248028.5034  0.0018 -6.2604 3  348.9338 69  71510 3033430 5      3330 4        syn-C2H3C(O)NH2, v=0
  248043.5106  0.0200 -3.5929 3   60.3853 43 -71510 30321 714      20 615        syn-C2H3C(O)NH2, v=0
  248084.7861  0.0200 -3.6971 3  407.6947113 -71510 30356 947      56 848        syn-C2H3C(O)NH2, v=0
  248090.4023  0.0013 -3.6970 3  407.6947113  71510 303561047      56 948        syn-C2H3C(O)NH2, v=0
  248123.0972  0.0017 -6.1411 3  335.0284 69  71510 3033429 5      3329 4        syn-C2H3C(O)NH2, v=0
  248123.0972  0.0017 -6.1411 3  335.0284 69  71510 3033429 6      3329 5        syn-C2H3C(O)NH2, v=0
  248147.0579  0.0029 -4.8672 3   90.8570 51  71510 30325 916      25 619        syn-C2H3C(O)NH2, v=0
  248156.8770  0.1644 -5.7091 3 1625.3809215  71510 303A72978      A72879        syn-C2H3C(O)NH2, v=0
  248164.2020  0.0060 -4.7766 3  570.9613129  71510 303641649      631746        syn-C2H3C(O)NH2, v=0
  248167.0161  0.0617 -6.3427 3 1510.8105199  71510 303993664      983761        syn-C2H3C(O)NH2, v=0
  248167.0162  0.0617 -6.3427 3 1510.8105199  71510 303993663      983762        syn-C2H3C(O)NH2, v=0
  248209.1902  0.0077 -4.2537 3  826.4536155  71510 303771959      771860        syn-C2H3C(O)NH2, v=0
  248225.4443  0.0016 -6.0405 3  321.5962 69  71510 3033428 6      3328 5        syn-C2H3C(O)NH2, v=0
  248225.4443  0.0016 -6.0405 3  321.5962 69  71510 3033428 7      3328 6        syn-C2H3C(O)NH2, v=0
  248247.6536  0.0039 -4.0786 3  716.1393145  71510 303721756      721657        syn-C2H3C(O)NH2, v=0
  248257.2537  0.0084 -5.0073 3  830.4202151  71510 303752452      742549        syn-C2H3C(O)NH2, v=0
  248300.0998  0.0027 -6.2759 3  175.4770 67  71510 303331419      341124        syn-C2H3C(O)NH2, v=0
  248302.0085  0.0084 -5.0072 3  830.4201151  71510 303752451      742550        syn-C2H3C(O)NH2, v=0
  248312.6579  0.0009 -5.2726 3  158.6912 67  71510 303331122      321121        syn-C2H3C(O)NH2, v=0
  248336.8268  0.0015 -5.9532 3  308.6377 69  71510 3033427 7      3327 6        syn-C2H3C(O)NH2, v=0
  248336.8268  0.0015 -5.9532 3  308.6377 69  71510 3033427 8      3327 7        syn-C2H3C(O)NH2, v=0
  248454.5316  0.0020 -4.4304 3  492.2879119  71510 303591644      581741        syn-C2H3C(O)NH2, v=0
  248457.1345  0.0373 -6.3820 3  791.4235103  71510 3035145 6      5244 9        syn-C2H3C(O)NH2, v=0
  248457.1345  0.0373 -6.3820 3  791.4235103  71510 3035145 7      5244 8        syn-C2H3C(O)NH2, v=0
  248458.7848  0.0014 -5.8760 3  296.1534 69  71510 3033426 8      3326 7        syn-C2H3C(O)NH2, v=0
  248458.7848  0.0014 -5.8760 3  296.1534 69  71510 3033426 9      3326 8        syn-C2H3C(O)NH2, v=0
  248542.5170  0.0701 -6.4730 3 1576.8036203  71510 303A13764      A03863        syn-C2H3C(O)NH2, v=0
  248542.5170  0.0701 -6.4730 3 1576.8036203  71510 303A13765      A03862        syn-C2H3C(O)NH2, v=0
  248593.1821  0.0014 -5.8067 3  284.1439 69  71510 3033425 9      3325 8        syn-C2H3C(O)NH2, v=0
  248593.1821  0.0014 -5.8067 3  284.1439 69  71510 303342510      3325 9        syn-C2H3C(O)NH2, v=0
  248742.2934  0.0013 -5.7438 3  272.6098 69  71510 303342410      3324 9        syn-C2H3C(O)NH2, v=0
  248742.2934  0.0013 -5.7438 3  272.6098 69  71510 303342411      332410        syn-C2H3C(O)NH2, v=0
  248745.8395  0.0044 -6.6388 3  137.7972 63  71510 303311022      32 527        syn-C2H3C(O)NH2, v=0
  248756.7514  0.1139 -5.1910 3 1346.3997197  71510 303982474      982375        syn-C2H3C(O)NH2, v=0
  248783.1295  0.0029 -3.9568 3  258.0118 87  71510 303431132      421231        syn-C2H3C(O)NH2, v=0
  248795.0413  0.0011 -5.2337 3  142.5246 65  71510 30332 923      31 922        syn-C2H3C(O)NH2, v=0
  248892.3276  0.0008 -5.2364 3  150.0866 67  71510 30333 925      32 924        syn-C2H3C(O)NH2, v=0
  248908.9206  0.0013 -5.6863 3  261.5521 69  71510 303342311      332310        syn-C2H3C(O)NH2, v=0
  248908.9206  0.0013 -5.6863 3  261.5521 69  71510 303342312      332311        syn-C2H3C(O)NH2, v=0
  248949.9643  0.0795 -6.6063 3 1644.2201207  71510 303A33865      A23964        syn-C2H3C(O)NH2, v=0
  248949.9643  0.0795 -6.6063 3 1644.2201207  71510 303A33866      A23963        syn-C2H3C(O)NH2, v=0
  249000.2866  0.0067 -4.9148 3  783.0603147  71510 303732351      722448        syn-C2H3C(O)NH2, v=0
  249002.2982  0.0200 -3.5694 3  377.5275 99 -71510 303491930      491831        syn-C2H3C(O)NH2, v=0
  249004.6999  0.0200 -3.5694 3  377.5274 99 -71510 303491931      491832        syn-C2H3C(O)NH2, v=0
  249014.0989  0.0863 -5.2230 3 1367.8656197  71510 303982771      982672        syn-C2H3C(O)NH2, v=0
  249072.8199  0.0065 -6.3340 3  635.4407145  71510 30372 864      73 767        syn-C2H3C(O)NH2, v=0
  249072.8199  0.0065 -6.3340 3  635.4407145  71510 30372 964      73 667        syn-C2H3C(O)NH2, v=0
  249088.3207  0.0040 -4.2440 3  830.7437153  71510 303762255      762156        syn-C2H3C(O)NH2, v=0
  249090.5768  0.0200 -3.7748 3  536.9950121 -71510 303602040      601941        syn-C2H3C(O)NH2, v=0
  249096.5509  0.0012 -5.6336 3  250.9717 69  71510 303342212      332211        syn-C2H3C(O)NH2, v=0
  249096.5509  0.0012 -5.6336 3  250.9717 69  71510 303342213      332212        syn-C2H3C(O)NH2, v=0
  249103.3369  0.0058 -5.8727 3   43.9286 39  71510 30319 415      19 118        syn-C2H3C(O)NH2, v=0
  249117.9943  0.0009 -5.2512 3  154.1401 67  71510 303331024      321023        syn-C2H3C(O)NH2, v=0
  249119.1484  0.0068 -4.9144 3  783.0601147  71510 303732350      722449        syn-C2H3C(O)NH2, v=0
  249132.2989  0.0325 -6.3928 3  745.9443 99  71510 3034944 5      5043 8        syn-C2H3C(O)NH2, v=0
  249132.2989  0.0325 -6.3928 3  745.9443 99  71510 3034944 6      5043 7        syn-C2H3C(O)NH2, v=0
  249176.3853  0.0200 -3.7372 3  259.6171 95 -71510 30347 443      47 344        syn-C2H3C(O)NH2, v=0
  249176.3853  0.0200 -3.7372 3  259.6171 95 -71510 30347 543      47 444        syn-C2H3C(O)NH2, v=0
  249291.9071  0.0043 -5.8621 3   39.7839 37  71510 30318 514      18 217        syn-C2H3C(O)NH2, v=0
  249309.5760  0.0011 -5.5848 3  240.8697 69  71510 303342113      332112        syn-C2H3C(O)NH2, v=0
  249309.5760  0.0011 -5.5848 3  240.8697 69  71510 303342114      332113        syn-C2H3C(O)NH2, v=0
  249355.3058  0.0200 -3.7739 3  536.9851121 -71510 303602041      601942        syn-C2H3C(O)NH2, v=0
  249364.2080  0.0159 -6.5360 3  817.3836163  71510 303811071      82 974        syn-C2H3C(O)NH2, v=0
  249364.2080  0.0159 -6.5360 3  817.3836163  71510 303811171      82 874        syn-C2H3C(O)NH2, v=0
  249553.6003  0.0011 -5.5397 3  231.2478 69  71510 303342014      332013        syn-C2H3C(O)NH2, v=0
  249553.6003  0.0011 -5.5397 3  231.2478 69  71510 303342015      332014        syn-C2H3C(O)NH2, v=0
  249635.1848  0.0200 -3.4535 3   58.3434 41 -71510 30320 813      19 712        syn-C2H3C(O)NH2, v=0
  249642.1243  0.0049 -6.2653 3  410.6351119  71510 30359 554      60 457        syn-C2H3C(O)NH2, v=0
  249642.1244  0.0049 -6.2653 3  410.6351119  71510 30359 654      60 357        syn-C2H3C(O)NH2, v=0
  249716.2734  0.0049 -4.6647 3  115.5666 59  71510 30329 821      29 524        syn-C2H3C(O)NH2, v=0
  249716.3396  0.0199 -4.5685 3 1012.3780169  71510 303842460      842361        syn-C2H3C(O)NH2, v=0
  249762.6828  0.0099 -4.3666 3  899.0381159  71510 303792356      792257        syn-C2H3C(O)NH2, v=0
  249797.2002  0.0283 -6.4272 3  701.8994 95  71510 3034743 4      4842 7        syn-C2H3C(O)NH2, v=0
  249797.2002  0.0283 -6.4272 3  701.8994 95  71510 3034743 5      4842 6        syn-C2H3C(O)NH2, v=0
  249835.8880  0.0011 -5.4979 3  222.1079 69  71510 303341915      331914        syn-C2H3C(O)NH2, v=0
  249835.8880  0.0011 -5.4979 3  222.1079 69  71510 303341916      331915        syn-C2H3C(O)NH2, v=0
  249888.2600  0.0017 -3.8692 3  572.3054131  71510 303651352      651253        syn-C2H3C(O)NH2, v=0
  249942.7821  0.0054 -4.8252 3  737.1457143  71510 303712250      702347        syn-C2H3C(O)NH2, v=0
  249948.9346  0.0030 -6.1587 3  381.6453101  71510 303501832      511537        syn-C2H3C(O)NH2, v=0
  249966.2894  0.0026 -4.4941 3  552.3458125  71510 303621844      611943        syn-C2H3C(O)NH2, v=0
  249996.6195  0.0030 -4.0115 3  672.3236141  71510 303701555      701456        syn-C2H3C(O)NH2, v=0
  250007.3190  0.0118 -4.4449 3  944.0419165  71510 303822162      822063        syn-C2H3C(O)NH2, v=0
  250105.3157  0.0200 -3.5544 3  365.3358 97 -71510 303481929      481830        syn-C2H3C(O)NH2, v=0
  250106.5096  0.0200 -3.5544 3  365.3358 97 -71510 303481930      481831        syn-C2H3C(O)NH2, v=0
  250159.7406  0.1906 -5.5620 3 1547.2715211  71510 303A52679      A52580        syn-C2H3C(O)NH2, v=0
  250160.2352  0.0019 -3.9839 3  675.3013137  71510 303682148      682049        syn-C2H3C(O)NH2, v=0
  250166.0275  0.0010 -5.4590 3  213.4524 69  71510 303341816      331815        syn-C2H3C(O)NH2, v=0
  250166.0275  0.0010 -5.4590 3  213.4524 69  71510 303341817      331816        syn-C2H3C(O)NH2, v=0
  250251.2810  0.0054 -4.8241 3  737.1451143  71510 303712249      702348        syn-C2H3C(O)NH2, v=0
  250275.5780  0.0016 -3.8679 3  572.3071131  71510 303651452      651353        syn-C2H3C(O)NH2, v=0
  250332.1981  0.3998 -6.4020 3 1989.9635239  71510 303B93089      B92990        syn-C2H3C(O)NH2, v=0
  250415.4933  0.2898 -5.9665 3 1761.8119225  71510 303B22884      B22785        syn-C2H3C(O)NH2, v=0
  250422.8731  0.1867 -6.4739 3 1303.6930195  71510 303972375      962472        syn-C2H3C(O)NH2, v=0
  250430.9392  0.0435 -4.7035 3 1081.9787177  71510 303882167      882068        syn-C2H3C(O)NH2, v=0
  250440.8352  0.0200 -3.2283 3   44.6534 25 -71510 3031212 0      1111 1        syn-C2H3C(O)NH2, v=0
  250440.8352  0.0200 -3.2283 3   44.6534 25 -71510 3031212 1      1111 0        syn-C2H3C(O)NH2, v=0
  250451.6406  0.0245 -6.4938 3  659.2896 91  71510 3034542 3      4641 6        syn-C2H3C(O)NH2, v=0
  250451.6406  0.0245 -6.4938 3  659.2896 91  71510 3034542 4      4641 5        syn-C2H3C(O)NH2, v=0
  250556.9564  0.0010 -5.4227 3  205.2845 69  71510 303341718      331717        syn-C2H3C(O)NH2, v=0
  250556.9565  0.0010 -5.4227 3  205.2845 69  71510 303341717      331716        syn-C2H3C(O)NH2, v=0
  250616.4206  0.0119 -4.5293 3  994.8195169  71510 303842263      842164        syn-C2H3C(O)NH2, v=0
  250650.5347  0.0028 -3.9344 3  213.2093 89  71510 30344 242      44 143        syn-C2H3C(O)NH2, v=0
  250650.5347  0.0028 -3.9344 3  213.2093 89  71510 30344 342      44 243        syn-C2H3C(O)NH2, v=0
  250672.2321  0.0030 -5.1988 3   22.6160 31  71510 30315 213      14 114        syn-C2H3C(O)NH2, v=0
  250771.4450  0.0200 -3.4506 3   58.3110 41 -71510 30320 812      19 713        syn-C2H3C(O)NH2, v=0
  250860.7116  0.0200 -3.2724 3   45.7928 29 -71510 3031411 4      1310 3        syn-C2H3C(O)NH2, v=0
  250860.7116  0.0200 -3.2724 3   45.7928 29 -71510 3031411 3      1310 4        syn-C2H3C(O)NH2, v=0
  250872.3352  0.0026 -6.2077 3  217.1739 75  71510 303371523      381226        syn-C2H3C(O)NH2, v=0
  250916.8487  0.0010 -5.2133 3  145.6885 67  71510 30333 726      32 725        syn-C2H3C(O)NH2, v=0
  250987.5640  0.0200 -3.6966 3  289.3501 99 -71510 30349 544      49 445        syn-C2H3C(O)NH2, v=0
  250987.5640  0.0200 -3.6966 3  289.3501 99 -71510 30349 644      49 545        syn-C2H3C(O)NH2, v=0
  251026.6106  0.0010 -5.3889 3  197.6086 69  71510 303341619      331618        syn-C2H3C(O)NH2, v=0
  251026.6123  0.0010 -5.3889 3  197.6086 69  71510 303341618      331617        syn-C2H3C(O)NH2, v=0
  251078.1357  0.0042 -4.7387 3  692.6791139  71510 303692149      682246        syn-C2H3C(O)NH2, v=0
  251095.4122  0.0212 -6.6084 3  618.1157 87  71510 3034341 2      4440 5        syn-C2H3C(O)NH2, v=0
  251095.4122  0.0212 -6.6084 3  618.1157 87  71510 3034341 3      4440 4        syn-C2H3C(O)NH2, v=0
  251103.9251  0.0871 -5.9856 3 1073.7989177  71510 303882168      872265        syn-C2H3C(O)NH2, v=0
  251127.1796  0.0008 -3.5406 3  353.4066 95  71510 303471928      471829        syn-C2H3C(O)NH2, v=0
  251127.7364  0.0008 -3.5406 3  353.4066 95  71510 303471929      471830        syn-C2H3C(O)NH2, v=0
  251180.5876  0.0062 -5.1559 3   75.9398 49  71510 30324 618      24 321        syn-C2H3C(O)NH2, v=0
  251193.1527  0.0200 -3.3180 3   48.4164 33 -71510 3031610 7      15 9 6        syn-C2H3C(O)NH2, v=0
  251193.1527  0.0200 -3.3180 3   48.4164 33 -71510 3031610 6      15 9 7        syn-C2H3C(O)NH2, v=0
  251200.2879  0.0056 -6.3423 3  350.0737111  71510 30355 451      56 354        syn-C2H3C(O)NH2, v=0
  251200.2879  0.0056 -6.3423 3  350.0737111  71510 30355 551      56 254        syn-C2H3C(O)NH2, v=0
  251208.9255  0.0024 -3.7172 3  198.2603 77  71510 30338 929      371028        syn-C2H3C(O)NH2, v=0
  251210.4042  0.0200 -3.3726 3   52.5644 37 -71510 30318 910      17 8 9        syn-C2H3C(O)NH2, v=0
  251217.6429  0.0200 -3.7479 3  521.9047119 -71510 303592039      591940        syn-C2H3C(O)NH2, v=0
  251224.2052  0.0200 -3.3726 3   52.5640 37 -71510 30318 9 9      17 810        syn-C2H3C(O)NH2, v=0
  251304.8125  0.0019 -3.9548 3  658.1402135  71510 303672146      672047        syn-C2H3C(O)NH2, v=0
  251364.3904  0.0030 -4.3400 3  463.0108115  71510 303571641      561740        syn-C2H3C(O)NH2, v=0
  251366.9462  0.0011 -3.7474 3  521.8991119  71510 303592040      591941        syn-C2H3C(O)NH2, v=0
  251442.6339  0.0008 -5.1561 3  169.2539 81  71510 30340 139      39 138        syn-C2H3C(O)NH2, v=0
  251442.6557  0.0200 -2.9855 3  169.2539 81 -71510 30340 139      39 238        syn-C2H3C(O)NH2, v=0
  251442.6557  0.0200 -2.9855 3  169.2539 81 -71510 30340 239      39 138        syn-C2H3C(O)NH2, v=0
  251442.6339  0.0008 -5.1561 3  169.2539 81  71510 30340 239      39 238        syn-C2H3C(O)NH2, v=0
  251449.9556  0.0009 -5.1423 3  169.7753 83  71510 30341 041      40 040        syn-C2H3C(O)NH2, v=0
  251449.9556  0.0009 -2.9456 3  169.7753 83  71510 30341 041      40 140        syn-C2H3C(O)NH2, v=0
  251449.9556  0.0009 -2.9456 3  169.7753 83  71510 30341 141      40 040        syn-C2H3C(O)NH2, v=0
  251449.9556  0.0009 -5.1423 3  169.7753 83  71510 30341 141      40 140        syn-C2H3C(O)NH2, v=0
  251450.0498  0.0008 -3.0291 3  168.2170 79  71510 30339 237      38 336        syn-C2H3C(O)NH2, v=0
  251450.0500  0.0008 -5.1691 3  168.2170 79  71510 30339 337      38 336        syn-C2H3C(O)NH2, v=0
  251450.0502  0.0008 -5.1691 3  168.2170 79  71510 30339 237      38 236        syn-C2H3C(O)NH2, v=0
  251450.0504  0.0008 -3.0291 3  168.2170 79  71510 30339 337      38 236        syn-C2H3C(O)NH2, v=0
  251493.0370  0.0200 -3.0778 3  166.6484 77 -71510 30338 335      37 434        syn-C2H3C(O)NH2, v=0
  251493.0016  0.0008 -5.1811 3  166.6484 77  71510 30338 435      37 434        syn-C2H3C(O)NH2, v=0
  251493.0182  0.0008 -5.1811 3  166.6484 77  71510 30338 335      37 334        syn-C2H3C(O)NH2, v=0
  251493.0370  0.0200 -3.0778 3  166.6484 77 -71510 30338 435      37 334        syn-C2H3C(O)NH2, v=0
  251600.7195  0.0009 -5.3573 3  190.4307 69  71510 303341520      331519        syn-C2H3C(O)NH2, v=0
  251600.7550  0.0009 -5.3573 3  190.4307 69  71510 303341519      331518        syn-C2H3C(O)NH2, v=0
  251609.6612  0.0200 -3.1339 3  164.5243 75 -71510 30337 433      36 532        syn-C2H3C(O)NH2, v=0
  251610.4662  0.0008 -5.1918 3  164.5243 75  71510 30337 533      36 532        syn-C2H3C(O)NH2, v=0
  251611.2207  0.0008 -5.1918 3  164.5243 75  71510 30337 433      36 432        syn-C2H3C(O)NH2, v=0
  251612.0425  0.0008 -3.1339 3  164.5243 75  71510 30337 533      36 432        syn-C2H3C(O)NH2, v=0
  251622.2716  0.0050 -6.2819 3  560.3437137  71510 30368 761      69 664        syn-C2H3C(O)NH2, v=0
  251622.2716  0.0050 -6.2819 3  560.3437137  71510 30368 861      69 564        syn-C2H3C(O)NH2, v=0
  251693.5931  0.0037 -4.2044 3  811.3811151  71510 303752254      752155        syn-C2H3C(O)NH2, v=0
  251693.7762  0.0796 -6.6079 3 1078.8266125  71510 303625111      635014        syn-C2H3C(O)NH2, v=0
  251693.7762  0.0796 -6.6079 3 1078.8266125  71510 303625112      635013        syn-C2H3C(O)NH2, v=0
  251746.6563  0.0008 -3.2930 3  158.4459 71  71510 30335 629      34 728        syn-C2H3C(O)NH2, v=0
  251789.7105  0.0027 -4.0055 3  672.3330141  71510 303701655      701556        syn-C2H3C(O)NH2, v=0
  251826.2202  0.0059 -4.1708 3  779.7231151  71510 303751858      751759        syn-C2H3C(O)NH2, v=0
  251843.1822  0.0026 -5.3028 3   54.8972 41  71510 30320 714      20 417        syn-C2H3C(O)NH2, v=0
  251847.8708  0.0200 -3.2017 3  161.8079 73 -71510 30336 531      35 630        syn-C2H3C(O)NH2, v=0
  251857.8536  0.0043 -4.7359 3  692.6774139  71510 303692148      682247        syn-C2H3C(O)NH2, v=0
  251867.8099  0.0033 -6.1961 3  442.1368109  71510 303541935      551640        syn-C2H3C(O)NH2, v=0
  251874.8416  0.0008 -5.2010 3  161.8079 73  71510 30336 631      35 630        syn-C2H3C(O)NH2, v=0
  251896.9406  0.0008 -5.2009 3  161.8062 73  71510 30336 531      35 530        syn-C2H3C(O)NH2, v=0
  251902.4009  0.0105 -4.3578 3  894.4097161  71510 303802061      801962        syn-C2H3C(O)NH2, v=0
  251923.9481  0.0200 -3.2014 3  161.8062 73 -71510 30336 631      35 530        syn-C2H3C(O)NH2, v=0
  251952.8719  0.0010 -5.2414 3  154.2813 67  71510 303331023      321022        syn-C2H3C(O)NH2, v=0
  252028.8416  0.0016 -6.4609 3   11.0726 19  71510 303 9 6 4       8 3 5        syn-C2H3C(O)NH2, v=0
  252046.1892  0.0009 -5.2080 3  139.8973 65  71510 30332 824      31 823        syn-C2H3C(O)NH2, v=0
  252074.1334  0.0200 -3.5280 3  341.7388 93 -71510 303461927      461828        syn-C2H3C(O)NH2, v=0
  252074.1334  0.0200 -3.5280 3  341.7388 93 -71510 303461928      461829        syn-C2H3C(O)NH2, v=0
  252107.3155  0.0015 -3.8155 3  532.6518127  71510 303631251      631152        syn-C2H3C(O)NH2, v=0
  252119.0038  0.0016 -3.5680 3  175.7066 73  71510 30336 828      35 927        syn-C2H3C(O)NH2, v=0
  252188.5903  0.0026 -5.6552 3   44.1523 35  71510 30317 8 9      17 512        syn-C2H3C(O)NH2, v=0
  252218.8372  0.0008 -5.2158 3  154.4342 69  71510 30334 827      33 826        syn-C2H3C(O)NH2, v=0
  252225.0629  0.3151 -6.4851 3 2037.3237241  71510 303C03288      C03189        syn-C2H3C(O)NH2, v=0
  252236.8279  0.0015 -3.8150 3  532.6523127  71510 303631351      631252        syn-C2H3C(O)NH2, v=0
  252317.7361  0.0009 -5.3276 3  183.7594 69  71510 303341421      331420        syn-C2H3C(O)NH2, v=0
  252318.3462  0.0009 -5.3276 3  183.7594 69  71510 303341420      331419        syn-C2H3C(O)NH2, v=0
  252326.7458  0.0008 -5.2081 3  158.4459 71  71510 30335 729      34 728        syn-C2H3C(O)NH2, v=0
  252332.3380  0.0034 -4.6561 3  649.6642135  71510 303672048      662145        syn-C2H3C(O)NH2, v=0
  252366.2431  0.0063 -6.5086 3  294.0357103  71510 30351 348      52 251        syn-C2H3C(O)NH2, v=0
  252366.2431  0.0063 -6.5086 3  294.0357103  71510 30351 448      52 151        syn-C2H3C(O)NH2, v=0
  252420.6365  0.0708 -6.5524 3 1025.2445121  71510 303605010      614913        syn-C2H3C(O)NH2, v=0
  252420.6365  0.0708 -6.5524 3 1025.2445121  71510 303605011      614912        syn-C2H3C(O)NH2, v=0
  252453.9255  0.0200 -3.6772 3  320.3587103 -71510 30351 645      51 546        syn-C2H3C(O)NH2, v=0
  252453.9255  0.0200 -3.6772 3  320.3587103 -71510 30351 745      51 646        syn-C2H3C(O)NH2, v=0
  252459.4889  0.0106 -6.4341 3  732.2940155  71510 30377 968      78 871        syn-C2H3C(O)NH2, v=0
  252459.4889  0.0106 -6.4341 3  732.2940155  71510 303771068      78 771        syn-C2H3C(O)NH2, v=0
  252629.0425  0.0028 -5.1949 3   22.6158 31  71510 30315 313      14 014        syn-C2H3C(O)NH2, v=0
  252664.3023  0.0053 -6.4711 3   32.6235 35  71510 30317 314      17 017        syn-C2H3C(O)NH2, v=0
  252717.6819  0.0076 -4.5350 3 1003.1791169  71510 303842362      842263        syn-C2H3C(O)NH2, v=0
  252725.3579  0.0049 -4.1012 3  734.1168147  71510 303731657      731558        syn-C2H3C(O)NH2, v=0
  252730.0201  0.0009 -5.2066 3  158.4131 71  71510 30335 629      34 628        syn-C2H3C(O)NH2, v=0
  252829.7985  0.0030 -6.4507 3  130.8244 57  71510 303281316      291019        syn-C2H3C(O)NH2, v=0
  252832.7344  0.0017 -3.9496 3  658.0811135  71510 303672147      672048        syn-C2H3C(O)NH2, v=0
  252889.8983  0.0039 -4.1410 3  773.6626147  71510 303732251      732152        syn-C2H3C(O)NH2, v=0
  252905.3444  0.0021 -4.4562 3  529.3987123  71510 303611745      601842        syn-C2H3C(O)NH2, v=0
  252951.3092  0.0200 -3.5166 3  330.3315 91 -71510 303451926      451827        syn-C2H3C(O)NH2, v=0
  252951.3092  0.0200 -3.5166 3  330.3315 91 -71510 303451927      451828        syn-C2H3C(O)NH2, v=0
  253059.5954  0.0025 -6.2010 3  217.1010 75  71510 303371522      381227        syn-C2H3C(O)NH2, v=0
  253110.9711  0.0200 -3.8089 3  240.9694 93 -71510 30346 343      46 244        syn-C2H3C(O)NH2, v=0
  253110.9711  0.0200 -3.8089 3  240.9694 93 -71510 30346 443      46 344        syn-C2H3C(O)NH2, v=0
  253122.6145  0.0179 -5.2578 3  760.8106149  71510 303741857      731954        syn-C2H3C(O)NH2, v=0
  253138.0658  0.0628 -6.5060 3  973.0914117  71510 3035849 9      594812        syn-C2H3C(O)NH2, v=0
  253138.0658  0.0628 -6.5060 3  973.0914117  71510 303584910      594811        syn-C2H3C(O)NH2, v=0
  253142.6787  0.0089 -4.5729 3 1024.8594171  71510 303852363      852264        syn-C2H3C(O)NH2, v=0
  253159.5110  0.0200 -3.7224 3  507.0894117 -71510 303582038      581939        syn-C2H3C(O)NH2, v=0
  253180.4463  0.0068 -4.4955 3  981.7405167  71510 303832361      832262        syn-C2H3C(O)NH2, v=0
  253236.4442  0.0009 -5.2996 3  177.6074 69  71510 303341322      331321        syn-C2H3C(O)NH2, v=0
  253242.2742  0.0200 -3.7221 3  507.0864117 -71510 303582039      581940        syn-C2H3C(O)NH2, v=0
  253244.9561  0.0009 -5.2996 3  177.6076 69  71510 303341321      331320        syn-C2H3C(O)NH2, v=0
  253310.0512  0.0037 -6.2521 3  507.0844117  71510 303582038      591743        syn-C2H3C(O)NH2, v=0
  253310.1540  0.0200 -3.2873 3  158.4131 71 -71510 30335 729      34 628        syn-C2H3C(O)NH2, v=0
  253387.7298  0.0018 -4.5701 3   30.9775 33  71510 30316 512      15 213        syn-C2H3C(O)NH2, v=0
  253480.8799  0.0027 -4.5787 3  608.1061131  71510 303651947      642044        syn-C2H3C(O)NH2, v=0
  253522.1953  0.0200 -3.7697 3  494.1984123 -71510 303611150      611051        syn-C2H3C(O)NH2, v=0
  253522.2942  0.0098 -4.9984 3  662.4330139  71510 303691753      681850        syn-C2H3C(O)NH2, v=0
  253551.1014  0.0200 -3.6737 3  352.6336107 -71510 30353 746      53 647        syn-C2H3C(O)NH2, v=0
  253551.1014  0.0200 -3.6737 3  352.6336107 -71510 30353 846      53 747        syn-C2H3C(O)NH2, v=0
  253559.8638  0.0029 -6.4485 3  130.8001 57  71510 303281315      291020        syn-C2H3C(O)NH2, v=0
  253562.5415  0.0200 -3.7696 3  494.1986123 -71510 303611250      611151        syn-C2H3C(O)NH2, v=0
  253631.4739  0.0296 -4.5615 3 1007.2549171  71510 303852065      851966        syn-C2H3C(O)NH2, v=0
  253705.7557  0.0200 -3.4072 3  162.8473 71 -71510 30335 728      34 827        syn-C2H3C(O)NH2, v=0
  253763.9122  0.0200 -3.5063 3  319.1835 89 -71510 303441925      441826        syn-C2H3C(O)NH2, v=0
  253763.9122  0.0200 -3.5063 3  319.1835 89 -71510 303441926      441827        syn-C2H3C(O)NH2, v=0
  253845.9230  0.0555 -6.4701 3  922.3685113  71510 3035648 8      574711        syn-C2H3C(O)NH2, v=0
  253845.9230  0.0555 -6.4701 3  922.3685113  71510 3035648 9      574710        syn-C2H3C(O)NH2, v=0
  253853.0526  0.0047 -6.2611 3  489.7490129  71510 30364 658      65 561        syn-C2H3C(O)NH2, v=0
  253853.0526  0.0047 -6.2611 3  489.7490129  71510 30364 758      65 461        syn-C2H3C(O)NH2, v=0
  253857.9749  0.0031 -4.0254 3  296.5528 93  71510 303461234      451333        syn-C2H3C(O)NH2, v=0
  253949.1404  0.0033 -4.1859 3  195.5436 87  71510 30343 142      43 043        syn-C2H3C(O)NH2, v=0
  253949.1404  0.0033 -4.1859 3  195.5436 87  71510 30343 242      43 143        syn-C2H3C(O)NH2, v=0
  254007.7706  0.0023 -4.5099 3  568.0129127  71510 303631846      621943        syn-C2H3C(O)NH2, v=0
  254138.2130  0.0024 -4.4566 3  507.3558121  71510 303601645      591742        syn-C2H3C(O)NH2, v=0
  254178.3439  0.0200 -3.9406 3  629.6863137 -71510 303681454      681355        syn-C2H3C(O)NH2, v=0
  254209.0731  0.2124 -5.9257 3 1747.7804223  71510 303B13081      B12982        syn-C2H3C(O)NH2, v=0
  254242.3183  0.0035 -4.6492 3  649.6596135  71510 303672047      662146        syn-C2H3C(O)NH2, v=0
  254249.4435  0.0013 -3.6829 3  386.1653111  71510 30355 847      55 748        syn-C2H3C(O)NH2, v=0
  254250.2081  0.0013 -3.6829 3  386.1653111  71510 30355 947      55 848        syn-C2H3C(O)NH2, v=0
  254291.5379  0.0200 -3.7320 3  456.9584119 -71510 303591049      59 950        syn-C2H3C(O)NH2, v=0
  254303.2228  0.0200 -3.7320 3  456.9584119 -71510 303591149      591050        syn-C2H3C(O)NH2, v=0
  254307.0524  0.0043 -6.3255 3  576.4857125  71510 303622141      631846        syn-C2H3C(O)NH2, v=0
  254413.3861  0.0064 -4.4548 3  960.5523165  71510 303822360      822261        syn-C2H3C(O)NH2, v=0
  254432.5933  0.0009 -5.2730 3  171.9935 69  71510 303341223      331222        syn-C2H3C(O)NH2, v=0
  254447.7246  0.0531 -4.9617 3 1235.2440187  71510 303932667      932568        syn-C2H3C(O)NH2, v=0
  254477.5087  0.0025 -6.1667 3  263.2753 83  71510 303411626      421329        syn-C2H3C(O)NH2, v=0
  254477.9269  0.0017 -3.9196 3  641.1757133  71510 303662145      662046        syn-C2H3C(O)NH2, v=0
  254486.8929  0.0034 -4.1650 3  792.2940149  71510 303742253      742154        syn-C2H3C(O)NH2, v=0
  254512.2479  0.0200 -3.7028 3  420.9436115 -71510 30357 948      57 849        syn-C2H3C(O)NH2, v=0
  254515.3219  0.0013 -3.7028 3  420.9436115  71510 303571048      57 949        syn-C2H3C(O)NH2, v=0
  254516.2761  0.0200 -3.4973 3  308.2942 87 -71510 303431924      431825        syn-C2H3C(O)NH2, v=0
  254516.2761  0.0200 -3.4973 3  308.2942 87 -71510 303431925      431826        syn-C2H3C(O)NH2, v=0
  254526.6058  0.0009 -5.2727 3  171.9967 69  71510 303341222      331221        syn-C2H3C(O)NH2, v=0
  254539.4202  0.0110 -4.6090 3 1046.7726173  71510 303862364      862265        syn-C2H3C(O)NH2, v=0
  254544.0581  0.0489 -6.4464 3  873.0765109  71510 3035447 7      554610        syn-C2H3C(O)NH2, v=0
  254544.0581  0.0489 -6.4464 3  873.0765109  71510 3035447 8      5546 9        syn-C2H3C(O)NH2, v=0
  254633.6630  0.0080 -4.2007 3  798.5157153  71510 303761759      761660        syn-C2H3C(O)NH2, v=0
  254641.5652  0.0098 -6.5458 3  473.4508117  71510 303581543      591248        syn-C2H3C(O)NH2, v=0
  254768.5286  0.0034 -6.5835 3  150.1758 65  71510 303321122      33 627        syn-C2H3C(O)NH2, v=0
  254775.0266  0.0076 -6.5212 3  308.9035 95  71510 303471235      48 940        syn-C2H3C(O)NH2, v=0
  254849.5823  0.0200 -3.9384 3  629.6894137 -71510 303681554      681455        syn-C2H3C(O)NH2, v=0
  254886.7440  0.0057 -6.4151 3  650.3377133  71510 303662244      671949        syn-C2H3C(O)NH2, v=0
  254891.7435  0.0137 -6.6395 3  811.3811149  71510 303742450      752155        syn-C2H3C(O)NH2, v=0
  254893.8135  0.0145 -4.5578 3 1016.3571171  71510 303852264      852165        syn-C2H3C(O)NH2, v=0
  254942.7148  0.0200 -3.6982 3  492.5470115 -71510 303572037      571938        syn-C2H3C(O)NH2, v=0
  254987.8025  0.0200 -3.6980 3  492.5454115 -71510 303572038      571939        syn-C2H3C(O)NH2, v=0
  254991.6514  0.0048 -4.6590 3  554.5414127  71510 303631648      621745        syn-C2H3C(O)NH2, v=0
  255074.1334  0.0086 -6.5200 3  728.6373141  71510 303702347      712052        syn-C2H3C(O)NH2, v=0
  255117.5246  0.0022 -6.6335 3  401.7509 71  71510 3033533 2      3433 1        syn-C2H3C(O)NH2, v=0
  255117.5246  0.0022 -6.6335 3  401.7509 71  71510 3033533 3      3433 2        syn-C2H3C(O)NH2, v=0
  255200.4495  0.0020 -6.4316 3  386.4305 71  71510 3033532 3      3432 2        syn-C2H3C(O)NH2, v=0
  255200.4495  0.0020 -6.4316 3  386.4305 71  71510 3033532 4      3432 3        syn-C2H3C(O)NH2, v=0
  255212.5871  0.0200 -3.4896 3  297.6625 85 -71510 303421923      421824        syn-C2H3C(O)NH2, v=0
  255212.5871  0.0200 -3.4896 3  297.6625 85 -71510 303421924      421825        syn-C2H3C(O)NH2, v=0
  255232.3125  0.0429 -6.4375 3  825.2164105  71510 3035246 6      5345 9        syn-C2H3C(O)NH2, v=0
  255232.3125  0.0429 -6.4375 3  825.2164105  71510 3035246 7      5345 8        syn-C2H3C(O)NH2, v=0
  255271.1208  0.0071 -6.3546 3  651.6938147  71510 30373 865      74 768        syn-C2H3C(O)NH2, v=0
  255271.1208  0.0071 -6.3546 3  651.6938147  71510 30373 965      74 668        syn-C2H3C(O)NH2, v=0
  255271.8779  0.0200 -3.7380 3  270.0237 97 -71510 30348 444      48 345        syn-C2H3C(O)NH2, v=0
  255271.8779  0.0200 -3.7380 3  270.0237 97 -71510 30348 544      48 445        syn-C2H3C(O)NH2, v=0
  255274.9638  0.0854 -5.0200 3 1263.1913191  71510 303952372      952273        syn-C2H3C(O)NH2, v=0
  255282.7286  0.0086 -4.2706 3  845.9101157  71510 303781960      781861        syn-C2H3C(O)NH2, v=0
  255285.4564  0.0196 -4.4305 3  935.0951165  71510 303821963      821864        syn-C2H3C(O)NH2, v=0
  255288.8724  0.0019 -6.2820 3  371.5825 71  71510 3033531 4      3431 3        syn-C2H3C(O)NH2, v=0
  255288.8724  0.0019 -6.2820 3  371.5825 71  71510 3033531 5      3431 4        syn-C2H3C(O)NH2, v=0
  255383.6347  0.0018 -6.1615 3  357.2071 71  71510 3033530 5      3430 4        syn-C2H3C(O)NH2, v=0
  255383.6347  0.0018 -6.1615 3  357.2071 71  71510 3033530 6      3430 5        syn-C2H3C(O)NH2, v=0
  255397.5926  0.0016 -3.9165 3  641.1404133  71510 303662146      662047        syn-C2H3C(O)NH2, v=0
  255485.7280  0.0017 -6.0597 3  343.3049 71  71510 3033529 6      3429 5        syn-C2H3C(O)NH2, v=0
  255485.7280  0.0017 -6.0597 3  343.3049 71  71510 3033529 7      3429 6        syn-C2H3C(O)NH2, v=0
  255552.4658  0.0127 -4.3104 3  865.5117159  71510 303791861      791762        syn-C2H3C(O)NH2, v=0
  255593.2009  0.1169 -5.4158 3 1480.3932205  71510 303A22874      A22775        syn-C2H3C(O)NH2, v=0
  255596.3279  0.0016 -5.9713 3  329.8761 71  71510 3033528 7      3428 6        syn-C2H3C(O)NH2, v=0
  255596.3279  0.0016 -5.9713 3  329.8761 71  71510 3033528 8      3428 7        syn-C2H3C(O)NH2, v=0
  255627.5419  0.0043 -4.0917 3  734.1334147  71510 303731757      731658        syn-C2H3C(O)NH2, v=0
  255629.9114  0.0176 -6.5605 3  835.8515165  71510 303821072      83 975        syn-C2H3C(O)NH2, v=0
  255629.9115  0.0176 -6.5605 3  835.8515165  71510 303821172      83 875        syn-C2H3C(O)NH2, v=0
  255682.3321  0.0037 -6.5542 3  158.4131 67  71510 303331123      34 628        syn-C2H3C(O)NH2, v=0
  255694.3886  0.0200 -3.4491 3   63.3606 43 -71510 30321 814      20 713        syn-C2H3C(O)NH2, v=0
  255716.8372  0.0015 -5.8928 3  316.9213 71  71510 3033527 8      3427 7        syn-C2H3C(O)NH2, v=0
  255716.8372  0.0015 -5.8928 3  316.9213 71  71510 3033527 9      3427 8        syn-C2H3C(O)NH2, v=0
  255745.3702  0.0051 -6.2805 3  423.6634121  71510 30360 555      61 458        syn-C2H3C(O)NH2, v=0
  255745.3702  0.0051 -6.2805 3  423.6634121  71510 30360 655      61 358        syn-C2H3C(O)NH2, v=0
  255801.6980  0.0138 -4.4684 3  964.9592167  71510 303832163      832064        syn-C2H3C(O)NH2, v=0
  255848.9418  0.0014 -5.8223 3  304.4411 71  71510 3033526 9      3426 8        syn-C2H3C(O)NH2, v=0
  255848.9418  0.0014 -5.8223 3  304.4411 71  71510 303352610      3426 9        syn-C2H3C(O)NH2, v=0
  255856.4770  0.0200 -3.4832 3  287.2878 83 -71510 303411922      411823        syn-C2H3C(O)NH2, v=0
  255856.4770  0.0200 -3.4832 3  287.2878 83 -71510 303411923      411824        syn-C2H3C(O)NH2, v=0
  255880.1151  0.0009 -5.2479 3  166.9418 69  71510 303341124      331123        syn-C2H3C(O)NH2, v=0
  255910.5182  0.0376 -6.4467 3  778.7891101  71510 3035045 5      5144 8        syn-C2H3C(O)NH2, v=0
  255910.5182  0.0376 -6.4467 3  778.7891101  71510 3035045 6      5144 7        syn-C2H3C(O)NH2, v=0
  255992.3593  0.0048 -6.6374 3  145.6011 65  71510 303321023      33 528        syn-C2H3C(O)NH2, v=0
  255994.6833  0.0014 -5.7582 3  292.4360 71  71510 303352510      3425 9        syn-C2H3C(O)NH2, v=0
  255994.6833  0.0014 -5.7582 3  292.4360 71  71510 303352511      342510        syn-C2H3C(O)NH2, v=0
  256012.7564  0.0010 -5.2008 3  154.0582 69  71510 30334 727      33 726        syn-C2H3C(O)NH2, v=0
  256091.7018  0.0008 -5.2147 3  158.3887 69  71510 30334 926      33 925        syn-C2H3C(O)NH2, v=0
  256156.5554  0.0013 -5.6996 3  280.9070 71  71510 303352411      342410        syn-C2H3C(O)NH2, v=0
  256156.5554  0.0013 -5.6996 3  280.9070 71  71510 303352412      342411        syn-C2H3C(O)NH2, v=0
  256156.8107  0.0016 -6.1777 3   13.3849 21  71510 30310 6 5       9 3 6        syn-C2H3C(O)NH2, v=0
  256165.6658  0.0032 -6.6283 3  142.1279 63  71510 303311121      32 626        syn-C2H3C(O)NH2, v=0
  256248.9113  0.0283 -5.6267 3 1166.4420177  71510 303883059      873156        syn-C2H3C(O)NH2, v=0
  256249.0832  0.0283 -5.6267 3 1166.4419177  71510 303883058      873157        syn-C2H3C(O)NH2, v=0
  256259.9105  0.0330 -5.7407 3 1224.3458181  71510 303903160      893257        syn-C2H3C(O)NH2, v=0
  256259.9693  0.0330 -5.7407 3 1224.3458181  71510 303903159      893258        syn-C2H3C(O)NH2, v=0
  256277.1271  0.0061 -4.4133 3  939.6226163  71510 303812359      812260        syn-C2H3C(O)NH2, v=0
  256319.0564  0.0241 -5.5156 3 1109.9713173  71510 303862958      853055        syn-C2H3C(O)NH2, v=0
  256319.5529  0.0241 -5.5156 3 1109.9713173  71510 303862957      853056        syn-C2H3C(O)NH2, v=0
  256337.6330  0.0012 -5.6456 3  269.8548 71  71510 303352312      342311        syn-C2H3C(O)NH2, v=0
  256337.6330  0.0012 -5.6456 3  269.8548 71  71510 303352313      342312        syn-C2H3C(O)NH2, v=0
  256341.5166  0.0383 -5.8576 3 1283.6814185  71510 303923261      913358        syn-C2H3C(O)NH2, v=0
  256341.5365  0.0383 -5.8576 3 1283.6814185  71510 303923260      913359        syn-C2H3C(O)NH2, v=0
  256451.3756  0.0200 -3.4781 3  277.1691 81 -71510 303401921      401822        syn-C2H3C(O)NH2, v=0
  256451.3756  0.0200 -3.4781 3  277.1691 81 -71510 303401922      401823        syn-C2H3C(O)NH2, v=0
  256461.9332  0.0029 -3.8568 3   57.6990 43  71510 30321 615      20 516        syn-C2H3C(O)NH2, v=0
  256473.6737  0.0016 -6.4691 3   10.9244 19  71510 303 9 6 3       8 3 6        syn-C2H3C(O)NH2, v=0
  256483.1983  0.0204 -5.4074 3 1054.9354169  71510 303842857      832954        syn-C2H3C(O)NH2, v=0
  256484.6140  0.0204 -5.4074 3 1054.9354169  71510 303842856      832955        syn-C2H3C(O)NH2, v=0
  256485.0318  0.0442 -5.9775 3 1344.4472189  71510 303943362      933459        syn-C2H3C(O)NH2, v=0
  256485.0385  0.0442 -5.9775 3 1344.4472189  71510 303943361      933460        syn-C2H3C(O)NH2, v=0
  256522.3991  0.0078 -4.3119 3  878.7579157  71510 303782355      782256        syn-C2H3C(O)NH2, v=0
  256541.7480  0.0012 -5.5957 3  259.2806 71  71510 303352213      342212        syn-C2H3C(O)NH2, v=0
  256541.7480  0.0012 -5.5957 3  259.2806 71  71510 303352214      342213        syn-C2H3C(O)NH2, v=0
  256578.4980  0.0328 -6.4795 3  733.7955 97  71510 3034844 4      4943 7        syn-C2H3C(O)NH2, v=0
  256578.4980  0.0328 -6.4795 3  733.7955 97  71510 3034844 5      4943 6        syn-C2H3C(O)NH2, v=0
  256587.0400  0.0010 -3.6752 3  478.2755113  71510 303562036      561937        syn-C2H3C(O)NH2, v=0
  256611.1489  0.0200 -3.6751 3  478.2746113 -71510 303562037      561938        syn-C2H3C(O)NH2, v=0
  256661.4832  0.0009 -5.2453 3  166.9741 69  71510 303341123      331122        syn-C2H3C(O)NH2, v=0
  256683.2201  0.0508 -6.1002 3 1406.6419193  71510 303963463      953560        syn-C2H3C(O)NH2, v=0
  256683.2223  0.0508 -6.1002 3 1406.6419193  71510 303963462      953561        syn-C2H3C(O)NH2, v=0
  256703.7897  0.0029 -3.9334 3  222.6061 91  71510 30345 243      45 144        syn-C2H3C(O)NH2, v=0
  256703.7897  0.0029 -3.9334 3  222.6061 91  71510 30345 343      45 244        syn-C2H3C(O)NH2, v=0
  256757.0656  0.0171 -5.3021 3 1001.3358165  71510 303822756      812853        syn-C2H3C(O)NH2, v=0
  256761.0462  0.0171 -5.3021 3 1001.3358165  71510 303822755      812854        syn-C2H3C(O)NH2, v=0
  256773.7334  0.0011 -5.5494 3  249.1858 71  71510 303352114      342113        syn-C2H3C(O)NH2, v=0
  256773.7334  0.0011 -5.5494 3  249.1858 71  71510 303352115      342114        syn-C2H3C(O)NH2, v=0
  256930.0147  0.0581 -6.2259 3 1470.2640197  71510 303983564      973661        syn-C2H3C(O)NH2, v=0
  256930.0154  0.0581 -6.2259 3 1470.2640197  71510 303983563      973662        syn-C2H3C(O)NH2, v=0
  256949.6896  0.0137 -4.6434 3 1068.9099175  71510 303872365      872266        syn-C2H3C(O)NH2, v=0
  256958.9772  0.0009 -5.2265 3  162.4498 69  71510 303341025      331024        syn-C2H3C(O)NH2, v=0
  257000.5332  0.0007 -3.4744 3  267.3059 79  71510 303391920      391821        syn-C2H3C(O)NH2, v=0
  257000.5338  0.0007 -3.4744 3  267.3059 79  71510 303391921      391822        syn-C2H3C(O)NH2, v=0
  257039.7696  0.0011 -5.5063 3  239.5721 71  71510 303352015      342014        syn-C2H3C(O)NH2, v=0
  257039.7696  0.0011 -5.5063 3  239.5721 71  71510 303352016      342015        syn-C2H3C(O)NH2, v=0
  257042.5584  0.0017 -3.8786 3  588.2219133  71510 303661353      661254        syn-C2H3C(O)NH2, v=0
  257061.3521  0.0032 -4.9925 3   84.3183 49  71510 30324 915      24 618        syn-C2H3C(O)NH2, v=0
  257117.5155  0.0200 -3.6987 3  300.3632101 -71510 30350 545      50 446        syn-C2H3C(O)NH2, v=0
  257117.5155  0.0200 -3.6987 3  300.3632101 -71510 30350 645      50 546        syn-C2H3C(O)NH2, v=0
  257150.7259  0.0024 -6.1585 3  263.1862 83  71510 303411625      421330        syn-C2H3C(O)NH2, v=0
  257159.8107  0.0142 -5.1996 3  949.1742161  71510 303802655      792752        syn-C2H3C(O)NH2, v=0
  257170.8313  0.0142 -5.1996 3  949.1742161  71510 303802654      792753        syn-C2H3C(O)NH2, v=0
  257220.2907  0.0661 -6.3546 3 1535.3120201  71510 303A03665      993762        syn-C2H3C(O)NH2, v=0
  257220.2909  0.0661 -6.3546 3 1535.3120201  71510 303A03664      993763        syn-C2H3C(O)NH2, v=0
  257236.0654  0.0286 -6.5446 3  690.2363 93  71510 3034643 3      4742 6        syn-C2H3C(O)NH2, v=0
  257236.0654  0.0286 -6.5446 3  690.2363 93  71510 3034643 4      4742 5        syn-C2H3C(O)NH2, v=0
  257276.7206  0.0058 -6.3558 3  362.0937113  71510 30356 452      57 355        syn-C2H3C(O)NH2, v=0
  257276.7206  0.0058 -6.3558 3  362.0937113  71510 30356 552      57 255        syn-C2H3C(O)NH2, v=0
  257277.1489  0.0200 -3.8779 3  588.2228133 -71510 303661453      661354        syn-C2H3C(O)NH2, v=0
  257288.9223  0.0200 -3.8864 3  624.4992131 -71510 303652144      652045        syn-C2H3C(O)NH2, v=0
  257347.8885  0.0010 -5.4662 3  230.4415 71  71510 303351916      341915        syn-C2H3C(O)NH2, v=0
  257347.8885  0.0010 -5.4662 3  230.4415 71  71510 303351917      341916        syn-C2H3C(O)NH2, v=0
  257361.6113  0.0031 -4.1262 3  773.4852147  71510 303732252      732153        syn-C2H3C(O)NH2, v=0
  257409.8214  0.0029 -4.4041 3  514.1599121  71510 303601743      591842        syn-C2H3C(O)NH2, v=0
  257412.3365  0.0032 -4.0975 3  755.0673145  71510 303722250      722151        syn-C2H3C(O)NH2, v=0
  257419.9688  0.0027 -6.1531 3  313.8388 91  71510 303451729      461432        syn-C2H3C(O)NH2, v=0
  257496.5951  0.0008 -5.1422 3  177.6412 83  71510 30341 140      40 139        syn-C2H3C(O)NH2, v=0
  257496.5975  0.0200 -2.9706 3  177.6412 83 -71510 30341 140      40 239        syn-C2H3C(O)NH2, v=0
  257496.5975  0.0200 -2.9706 3  177.6412 83 -71510 30341 240      40 139        syn-C2H3C(O)NH2, v=0
  257496.5951  0.0008 -5.1422 3  177.6412 83  71510 30341 240      40 239        syn-C2H3C(O)NH2, v=0
  257502.7112  0.0200 -3.0129 3  176.6045 81 -71510 30340 238      39 337        syn-C2H3C(O)NH2, v=0
  257502.7090  0.0008 -5.1549 3  176.6045 81  71510 30340 338      39 337        syn-C2H3C(O)NH2, v=0
  257502.7091  0.0008 -5.1549 3  176.6045 81  71510 30340 238      39 237        syn-C2H3C(O)NH2, v=0
  257502.7112  0.0200 -3.0129 3  176.6045 81 -71510 30340 338      39 237        syn-C2H3C(O)NH2, v=0
  257504.2219  0.0009 -5.1288 3  178.1628 85  71510 30342 042      41 041        syn-C2H3C(O)NH2, v=0
  257504.2229  0.0200 -2.9318 3  178.1628 85 -71510 30342 042      41 141        syn-C2H3C(O)NH2, v=0
  257504.2229  0.0200 -2.9318 3  178.1628 85 -71510 30342 142      41 041        syn-C2H3C(O)NH2, v=0
  257504.2219  0.0009 -5.1288 3  178.1628 85  71510 30342 142      41 141        syn-C2H3C(O)NH2, v=0
  257506.8686  0.0200 -3.4722 3  257.6973 77 -71510 303381919      381820        syn-C2H3C(O)NH2, v=0
  257506.8686  0.0200 -3.4722 3  257.6973 77 -71510 303381920      381821        syn-C2H3C(O)NH2, v=0
  257519.2123  0.0029 -4.5010 3  522.7461123  71510 303611646      601743        syn-C2H3C(O)NH2, v=0
  257541.7757  0.0200 -3.0599 3  175.0373 79 -71510 30339 336      38 435        syn-C2H3C(O)NH2, v=0
  257541.7667  0.0008 -5.1665 3  175.0373 79  71510 30339 436      38 435        syn-C2H3C(O)NH2, v=0
  257541.7751  0.0008 -5.1665 3  175.0373 79  71510 30339 336      38 335        syn-C2H3C(O)NH2, v=0
  257541.7757  0.0200 -3.0599 3  175.0373 79 -71510 30339 436      38 335        syn-C2H3C(O)NH2, v=0
  257549.6897  0.0750 -6.4862 3 1601.7847205  71510 303A23766      A13863        syn-C2H3C(O)NH2, v=0
  257549.6898  0.0750 -6.4862 3 1601.7847205  71510 303A23765      A13864        syn-C2H3C(O)NH2, v=0
  257571.7455  0.0298 -4.7221 3 1109.5275177  71510 303882563      882464        syn-C2H3C(O)NH2, v=0
  257607.1494  0.0016 -4.4548 3  145.6885 65  71510 303321022      32 725        syn-C2H3C(O)NH2, v=0
  257648.7081  0.0200 -3.1136 3  172.9172 77 -71510 30338 434      37 533        syn-C2H3C(O)NH2, v=0
  257649.1360  0.0008 -5.1769 3  172.9172 77  71510 30338 534      37 533        syn-C2H3C(O)NH2, v=0
  257649.5319  0.0008 -5.1769 3  172.9171 77  71510 30338 434      37 433        syn-C2H3C(O)NH2, v=0
  257649.9745  0.0200 -3.1136 3  172.9171 77 -71510 30338 534      37 433        syn-C2H3C(O)NH2, v=0
  257666.7413  0.0026 -4.7404 3   28.5580 33  71510 30316 413      15 114        syn-C2H3C(O)NH2, v=0
  257708.7280  0.0010 -5.4288 3  221.7970 71  71510 303351818      341817        syn-C2H3C(O)NH2, v=0
  257708.7281  0.0010 -5.4288 3  221.7970 71  71510 303351817      341816        syn-C2H3C(O)NH2, v=0
  257714.2107  0.0117 -5.1000 3  898.4524157  71510 303782554      772651        syn-C2H3C(O)NH2, v=0
  257734.0140  0.0200 -3.2118 3   47.5765 27 -71510 3031312 1      1211 2        syn-C2H3C(O)NH2, v=0
  257734.0140  0.0200 -3.2118 3   47.5765 27 -71510 3031312 2      1211 1        syn-C2H3C(O)NH2, v=0
  257744.2036  0.0117 -5.0999 3  898.4524157  71510 303782553      772652        syn-C2H3C(O)NH2, v=0
  257784.0551  0.0054 -6.3010 3  575.5892139  71510 30369 762      70 665        syn-C2H3C(O)NH2, v=0
  257784.0551  0.0054 -6.3010 3  575.5892139  71510 30369 862      70 565        syn-C2H3C(O)NH2, v=0
  257832.7027  0.0015 -3.8846 3  624.4785131  71510 303652145      652046        syn-C2H3C(O)NH2, v=0
  257876.6933  0.0200 -3.1778 3  170.2095 75 -71510 30337 532      36 631        syn-C2H3C(O)NH2, v=0
  257891.3940  0.0008 -5.1858 3  170.2095 75  71510 30337 632      36 631        syn-C2H3C(O)NH2, v=0
  257903.6704  0.0008 -5.1858 3  170.2086 75  71510 30337 532      36 531        syn-C2H3C(O)NH2, v=0
  257914.4820  0.0848 -6.6207 3 1669.6805209  71510 303A43866      A33965        syn-C2H3C(O)NH2, v=0
  257914.4820  0.0848 -6.6207 3 1669.6805209  71510 303A43867      A33964        syn-C2H3C(O)NH2, v=0
  257918.3727  0.0200 -3.1777 3  170.2086 75 -71510 30337 632      36 531        syn-C2H3C(O)NH2, v=0
  257932.2544  0.0200 -3.4437 3   63.2978 43 -71510 30321 813      20 714        syn-C2H3C(O)NH2, v=0
  257933.1095  0.0033 -4.0945 3  337.7635 99  71510 303491336      481435        syn-C2H3C(O)NH2, v=0
  257965.0700  0.0031 -4.0215 3  689.6905143  71510 303711556      711457        syn-C2H3C(O)NH2, v=0
  257973.1206  0.0200 -3.4715 3  248.3428 75 -71510 303371918      371819        syn-C2H3C(O)NH2, v=0
  257973.1206  0.0200 -3.4715 3  248.3428 75 -71510 303371919      371820        syn-C2H3C(O)NH2, v=0
  257984.4549  0.0031 -4.5624 3  608.0941131  71510 303651946      642045        syn-C2H3C(O)NH2, v=0
  257987.1714  0.0037 -4.5675 3  538.4712125  71510 303621647      611744        syn-C2H3C(O)NH2, v=0
  258001.6451  0.0200 -3.2616 3  166.8627 73 -71510 30336 630      35 729        syn-C2H3C(O)NH2, v=0
  258067.1736  0.1521 -5.3744 3 1458.1614205  71510 303A22577      A22478        syn-C2H3C(O)NH2, v=0
  258107.9188  0.0200 -3.6534 3  464.2730111 -71510 303552035      551936        syn-C2H3C(O)NH2, v=0
  258120.5953  0.0200 -3.6533 3  464.2726111 -71510 303552036      551937        syn-C2H3C(O)NH2, v=0
  258136.7078  0.0010 -5.3938 3  213.6421 71  71510 303351719      341718        syn-C2H3C(O)NH2, v=0
  258136.7080  0.0010 -5.3938 3  213.6421 71  71510 303351718      341717        syn-C2H3C(O)NH2, v=0
  258139.5139  0.0200 -3.2546 3   49.2122 31 -71510 3031511 5      1410 4        syn-C2H3C(O)NH2, v=0
  258139.5139  0.0200 -3.2546 3   49.2122 31 -71510 3031511 4      1410 5        syn-C2H3C(O)NH2, v=0
  258200.2318  0.0156 -4.5054 3  990.7054167  71510 303832459      832360        syn-C2H3C(O)NH2, v=0
  258221.9513  0.0010 -5.2025 3  150.8236 67  71510 30333 924      32 923        syn-C2H3C(O)NH2, v=0
  258278.5844  0.0200 -3.3584 3   57.0100 39 -71510 30319 911      18 810        syn-C2H3C(O)NH2, v=0
  258313.7213  0.0200 -3.3583 3   57.0090 39 -71510 30319 910      18 811        syn-C2H3C(O)NH2, v=0
  258339.1223  0.0008 -5.1926 3  166.8627 73  71510 30336 730      35 729        syn-C2H3C(O)NH2, v=0
  258362.5132  0.0039 -5.4911 3   51.7673 41  71510 30320 615      20 318        syn-C2H3C(O)NH2, v=0
  258401.8768  0.0200 -3.4725 3  239.2416 73 -71510 303361917      361818        syn-C2H3C(O)NH2, v=0
  258401.8768  0.0200 -3.4725 3  239.2416 73 -71510 303361918      361819        syn-C2H3C(O)NH2, v=0
  258420.2425  0.0200 -3.3009 3   52.3407 35 -71510 3031710 8      16 9 7        syn-C2H3C(O)NH2, v=0
  258420.2425  0.0200 -3.3009 3   52.3406 35 -71510 3031710 7      16 9 8        syn-C2H3C(O)NH2, v=0
  258421.4068  0.0065 -6.5206 3  305.0472105  71510 30352 349      53 252        syn-C2H3C(O)NH2, v=0
  258421.4068  0.0065 -6.5206 3  305.0472105  71510 30352 449      53 152        syn-C2H3C(O)NH2, v=0
  258445.6077  0.0096 -5.0032 3  849.1724153  71510 303762453      752550        syn-C2H3C(O)NH2, v=0
  258456.7927  0.0024 -5.8059 3   39.7531 33  71510 30316 8 8      16 511        syn-C2H3C(O)NH2, v=0
  258524.0444  0.0008 -5.1989 3  162.8473 71  71510 30335 828      34 827        syn-C2H3C(O)NH2, v=0
  258525.6847  0.0096 -5.0029 3  849.1723153  71510 303762452      752551        syn-C2H3C(O)NH2, v=0
  258552.5018  0.0020 -5.7697 3   16.4402 25  71510 30312 5 7      11 210        syn-C2H3C(O)NH2, v=0
  258581.7003  0.0008 -5.1917 3  166.8433 73  71510 30336 630      35 629        syn-C2H3C(O)NH2, v=0
  258619.1600  0.0028 -6.3198 3  166.9741 65  71510 303321419      331122        syn-C2H3C(O)NH2, v=0
  258623.6116  0.0058 -4.3712 3  918.9582161  71510 303802358      802259        syn-C2H3C(O)NH2, v=0
  258629.2725  0.0014 -3.6806 3  331.9791105  71510 30352 646      52 547        syn-C2H3C(O)NH2, v=0
  258629.2901  0.0014 -3.6806 3  331.9791105  71510 30352 746      52 647        syn-C2H3C(O)NH2, v=0
  258643.1726  0.0017 -4.4108 3  154.0582 67  71510 303331023      33 726        syn-C2H3C(O)NH2, v=0
  258651.9433  0.0010 -5.3611 3  205.9819 71  71510 303351620      341619        syn-C2H3C(O)NH2, v=0
  258651.9477  0.0010 -5.3611 3  205.9819 71  71510 303351619      341618        syn-C2H3C(O)NH2, v=0
  258685.8694  0.0117 -6.4572 3  749.7552157  71510 30378 969      79 872        syn-C2H3C(O)NH2, v=0
  258685.8694  0.0117 -6.4572 3  749.7552157  71510 303781069      79 772        syn-C2H3C(O)NH2, v=0
  258710.8784  0.0120 -4.3776 3  914.6950163  71510 303812062      811963        syn-C2H3C(O)NH2, v=0
  258713.9098  0.0200 -3.6072 3   65.6187 45 -71510 30322 715      21 616        syn-C2H3C(O)NH2, v=0
  258795.5304  0.0200 -3.4752 3  230.3932 71 -71510 303351916      351817        syn-C2H3C(O)NH2, v=0
  258795.5304  0.0200 -3.4752 3  230.3932 71 -71510 303351917      351818        syn-C2H3C(O)NH2, v=0
  258832.4272  0.0040 -6.5377 3  166.8433 69  71510 303341124      35 629        syn-C2H3C(O)NH2, v=0
  258919.2166  0.0200 -3.2583 3  166.8433 73 -71510 30336 730      35 629        syn-C2H3C(O)NH2, v=0
  258950.5652  0.3691 -6.1881 3 1889.1557233  71510 303B62987      B62888        syn-C2H3C(O)NH2, v=0
  258975.5984  0.0200 -3.8246 3  547.9469129 -71510 303641252      641153        syn-C2H3C(O)NH2, v=0
  259052.1623  0.0015 -3.8244 3  547.9472129  71510 303641352      641253        syn-C2H3C(O)NH2, v=0
  259061.2383  0.0039 -4.4270 3   38.7210 37  71510 30318 414      17 315        syn-C2H3C(O)NH2, v=0
  259097.9046  0.0030 -4.0178 3  689.6962143  71510 303711656      711557        syn-C2H3C(O)NH2, v=0
  259106.6365  0.2476 -5.7646 3 1666.8351219  71510 303A92782      A92683        syn-C2H3C(O)NH2, v=0
  259156.3955  0.0200 -3.4798 3  221.7970 69 -71510 303341915      341816        syn-C2H3C(O)NH2, v=0
  259156.3955  0.0200 -3.4798 3  221.7970 69 -71510 303341916      341817        syn-C2H3C(O)NH2, v=0
  259178.9443  0.0801 -6.6164 3 1063.5278123  71510 303615110      625013        syn-C2H3C(O)NH2, v=0
  259178.9443  0.0801 -6.6164 3 1063.5278123  71510 303615111      625012        syn-C2H3C(O)NH2, v=0
  259179.3991  0.0200 -3.8093 3  250.9718 95 -71510 30347 344      47 245        syn-C2H3C(O)NH2, v=0
  259179.3991  0.0200 -3.8093 3  250.9718 95 -71510 30347 444      47 345        syn-C2H3C(O)NH2, v=0
  259204.9629  0.0047 -6.4620 3   32.6236 35  71510 30317 414      17 117        syn-C2H3C(O)NH2, v=0
  259215.7690  0.0065 -4.1860 3  798.5441153  71510 303761859      761760        syn-C2H3C(O)NH2, v=0
  259266.9711  0.0008 -5.1875 3  148.3047 67  71510 30333 825      32 824        syn-C2H3C(O)NH2, v=0
  259283.5313  0.0009 -5.3304 3  198.8232 71  71510 303351521      341520        syn-C2H3C(O)NH2, v=0
  259283.6159  0.0009 -5.3304 3  198.8232 71  71510 303351520      341519        syn-C2H3C(O)NH2, v=0
  259377.3724  0.0077 -4.9093 3  801.3364149  71510 303742352      732449        syn-C2H3C(O)NH2, v=0
  259391.4412  0.0016 -5.9187 3   15.9775 23  71510 30311 6 6      10 3 7        syn-C2H3C(O)NH2, v=0
  259486.5320  0.0200 -3.4865 3  213.4524 67 -71510 303331914      331815        syn-C2H3C(O)NH2, v=0
  259486.5320  0.0200 -3.4865 3  213.4524 67 -71510 303331915      331816        syn-C2H3C(O)NH2, v=0
  259517.6338  0.0200 -3.6327 3  450.5382109 -71510 303542034      541935        syn-C2H3C(O)NH2, v=0
  259524.1692  0.0010 -3.6327 3  450.5380109  71510 303542035      541936        syn-C2H3C(O)NH2, v=0
  259586.5947  0.0078 -4.9085 3  801.3360149  71510 303742351      732450        syn-C2H3C(O)NH2, v=0
  259586.9115  0.0027 -6.3169 3  166.9418 65  71510 303321418      331123        syn-C2H3C(O)NH2, v=0
  259746.1764  0.0030 -6.1634 3  368.8632 99  71510 303491832      501535        syn-C2H3C(O)NH2, v=0
  259784.8328  0.0200 -3.6783 3  364.8623109 -71510 30354 747      54 648        syn-C2H3C(O)NH2, v=0
  259784.8328  0.0200 -3.6783 3  364.8624109 -71510 30354 847      54 748        syn-C2H3C(O)NH2, v=0
  259787.9801  0.0200 -3.4955 3  205.3588 65 -71510 303321913      321814        syn-C2H3C(O)NH2, v=0
  259787.9801  0.0200 -3.4955 3  205.3588 65 -71510 303321914      321815        syn-C2H3C(O)NH2, v=0
  259811.4539  0.0200 -3.8550 3  608.1061129 -71510 303642143      642044        syn-C2H3C(O)NH2, v=0
  259899.4918  0.0712 -6.5684 3 1010.4301119  71510 3035950 9      604912        syn-C2H3C(O)NH2, v=0
  259899.4918  0.0712 -6.5684 3 1010.4301119  71510 303595010      604911        syn-C2H3C(O)NH2, v=0
  259981.3426  0.0050 -6.2787 3  503.9868131  71510 30365 659      66 562        syn-C2H3C(O)NH2, v=0
  259981.3426  0.0050 -6.2787 3  503.9868131  71510 30365 759      66 462        syn-C2H3C(O)NH2, v=0
  259993.9333  0.0034 -4.1844 3  204.5369 89  71510 30344 143      44 044        syn-C2H3C(O)NH2, v=0
  259993.9333  0.0034 -4.1844 3  204.5369 89  71510 30344 243      44 144        syn-C2H3C(O)NH2, v=0
  260039.5913  0.0173 -4.5849 3 1038.0986173  71510 303862265      862166        syn-C2H3C(O)NH2, v=0
  260062.6373  0.0200 -3.5070 3  197.5157 63 -71510 303311912      311813        syn-C2H3C(O)NH2, v=0
  260062.6373  0.0200 -3.5070 3  197.5157 63 -71510 303311913      311814        syn-C2H3C(O)NH2, v=0
  260075.3008  0.0009 -5.3016 3  192.1758 71  71510 303351422      341421        syn-C2H3C(O)NH2, v=0
  260076.6437  0.0009 -5.3015 3  192.1759 71  71510 303351421      341420        syn-C2H3C(O)NH2, v=0
  260127.5382  0.0200 -3.8539 3  608.0941129 -71510 303642144      642045        syn-C2H3C(O)NH2, v=0
  260185.0327  0.2705 -6.1528 3 1874.5790231  71510 303B53184      B53085        syn-C2H3C(O)NH2, v=0
  260189.5862  0.0200 -3.7783 3  508.8757125 -71510 303621151      621052        syn-C2H3C(O)NH2, v=0
  260212.8874  0.0200 -3.7782 3  508.8757125 -71510 303621251      621152        syn-C2H3C(O)NH2, v=0
  260234.2908  0.0028 -4.0883 3  754.9566145  71510 303722251      722152        syn-C2H3C(O)NH2, v=0
  260312.2540  0.0200 -3.5214 3  189.9227 61 -71510 303301911      301812        syn-C2H3C(O)NH2, v=0
  260312.2540  0.0200 -3.5214 3  189.9227 61 -71510 303301912      301813        syn-C2H3C(O)NH2, v=0
  260321.8199  0.0616 -4.8589 3 1182.5110185  71510 303922270      922171        syn-C2H3C(O)NH2, v=0
  260350.8825  0.0020 -4.5253 3  137.4916 63  71510 303311021      31 724        syn-C2H3C(O)NH2, v=0
  260369.0997  0.0169 -4.6759 3 1091.2633177  71510 303882366      882267        syn-C2H3C(O)NH2, v=0
  260462.8605  0.0061 -4.9181 3   98.0319 55  71510 30327 720      27 423        syn-C2H3C(O)NH2, v=0
  260494.9243  0.0030 -5.2648 3   59.8544 43  71510 30321 715      21 418        syn-C2H3C(O)NH2, v=0
  260518.0702  0.0062 -4.8184 3  754.9471145  71510 303722251      712348        syn-C2H3C(O)NH2, v=0
  260538.6322  0.0200 -3.5391 3  182.5792 59 -71510 303291910      291811        syn-C2H3C(O)NH2, v=0
  260538.6322  0.0200 -3.5391 3  182.5792 59 -71510 303291911      291812        syn-C2H3C(O)NH2, v=0
  260556.9817  0.0013 -3.6887 3  399.0035113  71510 30356 848      56 749        syn-C2H3C(O)NH2, v=0
  260557.3961  0.0013 -3.6887 3  399.0035113  71510 30356 948      56 849        syn-C2H3C(O)NH2, v=0
  260610.4673  0.0632 -6.5308 3  958.7616115  71510 3035749 8      584811        syn-C2H3C(O)NH2, v=0
  260610.4673  0.0632 -6.5308 3  958.7616115  71510 3035749 9      584810        syn-C2H3C(O)NH2, v=0
  260627.8047  0.0025 -6.1433 3  313.7318 91  71510 303451728      461433        syn-C2H3C(O)NH2, v=0
  260688.9205  0.0041 -4.5168 3  142.1279 65  71510 30332 923      32 626        syn-C2H3C(O)NH2, v=0
  260743.2593  0.0200 -3.5606 3  175.4848 57 -71510 3032819 9      281810        syn-C2H3C(O)NH2, v=0
  260743.2593  0.0200 -3.5606 3  175.4848 57 -71510 303281910      281811        syn-C2H3C(O)NH2, v=0
  260808.6096  0.0014 -3.7397 3  471.0205121  71510 303601050      60 951        syn-C2H3C(O)NH2, v=0
  260815.1976  0.0200 -3.7397 3  471.0205121 -71510 303601150      601051        syn-C2H3C(O)NH2, v=0
  260826.2777  0.0200 -3.6132 3  437.0696107 -71510 303532033      531934        syn-C2H3C(O)NH2, v=0
  260829.6170  0.0200 -3.6132 3  437.0695107 -71510 303532034      531935        syn-C2H3C(O)NH2, v=0
  260912.3872  0.0200 -3.7096 3  434.3929117 -71510 30358 949      58 850        syn-C2H3C(O)NH2, v=0
  260914.1340  0.0200 -3.7096 3  434.3929117 -71510 303581049      58 950        syn-C2H3C(O)NH2, v=0
  260927.7743  0.0200 -3.5867 3  168.6390 55 -71510 3032719 8      2718 9        syn-C2H3C(O)NH2, v=0
  260927.7743  0.0200 -3.5867 3  168.6390 55 -71510 3032719 9      271810        syn-C2H3C(O)NH2, v=0
  261051.3708  0.0063 -4.8166 3  754.9459145  71510 303722250      712349        syn-C2H3C(O)NH2, v=0
  261093.2848  0.0009 -5.2742 3  186.0544 71  71510 303351323      341322        syn-C2H3C(O)NH2, v=0
  261093.5599  0.0200 -3.6184 3  162.0414 53 -71510 3032619 7      2618 8        syn-C2H3C(O)NH2, v=0
  261093.5599  0.0200 -3.6184 3  162.0414 53 -71510 3032619 8      2618 9        syn-C2H3C(O)NH2, v=0
  261110.5803  0.0009 -5.2741 3  186.0549 71  71510 303351322      341321        syn-C2H3C(O)NH2, v=0
  261138.9258  0.0200 -3.4496 3   68.6592 45 -71510 30322 815      21 714        syn-C2H3C(O)NH2, v=0
  261171.1904  0.0051 -4.1117 3  752.3110149  71510 303741658      741559        syn-C2H3C(O)NH2, v=0
  261183.7352  0.0009 -5.1888 3  162.5978 71  71510 30335 728      34 727        syn-C2H3C(O)NH2, v=0
  261226.9838  0.0010 -5.2121 3  162.6856 69  71510 303341024      331023        syn-C2H3C(O)NH2, v=0
  261242.0677  0.0200 -3.6570 3  155.6916 51 -71510 3032519 6      2518 7        syn-C2H3C(O)NH2, v=0
  261242.0677  0.0200 -3.6570 3  155.6916 51 -71510 3032519 7      2518 8        syn-C2H3C(O)NH2, v=0
  261297.2894  0.0027 -4.0570 3  736.7766143  71510 303712249      712150        syn-C2H3C(O)NH2, v=0
  261308.4641  0.0054 -4.3290 3  898.5652159  71510 303792357      792258        syn-C2H3C(O)NH2, v=0
  261311.7284  0.0559 -6.5055 3  908.5234111  71510 3035548 7      564710        syn-C2H3C(O)NH2, v=0
  261311.7284  0.0559 -6.5055 3  908.5234111  71510 3035548 8      5647 9        syn-C2H3C(O)NH2, v=0
  261363.5531  0.0200 -3.7398 3  280.6320 99 -71510 30349 445      49 346        syn-C2H3C(O)NH2, v=0
  261363.5531  0.0200 -3.7398 3  280.6320 99 -71510 30349 545      49 446        syn-C2H3C(O)NH2, v=0
  261374.5330  0.0200 -3.7046 3  149.5892 49 -71510 3032419 5      2418 6        syn-C2H3C(O)NH2, v=0
  261374.5330  0.0200 -3.7046 3  149.5892 49 -71510 3032419 6      2418 7        syn-C2H3C(O)NH2, v=0
  261451.1589  0.0022 -4.4628 3  544.8893125  71510 303621746      611843        syn-C2H3C(O)NH2, v=0
  261460.1890  0.0079 -6.3761 3  668.1479149  71510 30374 866      75 769        syn-C2H3C(O)NH2, v=0
  261460.1890  0.0079 -6.3761 3  668.1479149  71510 30374 966      75 669        syn-C2H3C(O)NH2, v=0
  261492.2393  0.0200 -3.7645 3  143.7338 47 -71510 3032319 4      2318 5        syn-C2H3C(O)NH2, v=0
  261492.2393  0.0200 -3.7645 3  143.7338 47 -71510 3032319 5      2318 6        syn-C2H3C(O)NH2, v=0
  261496.5856  0.0034 -6.1952 3  428.3469107  71510 303531935      541638        syn-C2H3C(O)NH2, v=0
  261554.8207  0.0515 -5.6669 3  956.2346167  71510 303832064      822161        syn-C2H3C(O)NH2, v=0
  261559.7909  0.0035 -4.1634 3  381.6453105  71510 303521438      511537        syn-C2H3C(O)NH2, v=0
  261574.5713  0.0200 -3.9514 3  646.4237139 -71510 303691455      691356        syn-C2H3C(O)NH2, v=0
  261578.3659  0.0745 -5.1408 3 1342.2990195  71510 303972770      972671        syn-C2H3C(O)NH2, v=0
  261596.4042  0.0200 -3.8421 3  138.1251 45 -71510 3032219 3      2218 4        syn-C2H3C(O)NH2, v=0
  261596.4042  0.0200 -3.8421 3  138.1251 45 -71510 3032219 4      2218 5        syn-C2H3C(O)NH2, v=0
  261614.8539  0.0026 -3.7823 3  232.2481 83  71510 303411031      401130        syn-C2H3C(O)NH2, v=0
  261687.9313  0.0008 -3.3574 3  171.4707 73  71510 30336 729      35 828        syn-C2H3C(O)NH2, v=0
  261688.1076  0.0013 -3.9477 3  132.7627 43  71510 3032119 2      2118 3        syn-C2H3C(O)NH2, v=0
  261688.1076  0.0013 -3.9477 3  132.7627 43  71510 3032119 3      2118 4        syn-C2H3C(O)NH2, v=0
  261768.4583  0.0014 -4.1042 3  127.6463 41  71510 3032019 1      2018 2        syn-C2H3C(O)NH2, v=0
  261768.4583  0.0014 -4.1042 3  127.6463 41  71510 3032019 2      2018 3        syn-C2H3C(O)NH2, v=0
  261831.0303  0.0049 -4.7310 3  710.0077141  71510 303702150      692247        syn-C2H3C(O)NH2, v=0
  261838.4631  0.0014 -4.3854 3  122.7755 39  71510 3031919 0      1918 1        syn-C2H3C(O)NH2, v=0
  261838.4631  0.0014 -4.3854 3  122.7755 39  71510 3031919 1      1918 2        syn-C2H3C(O)NH2, v=0
  261843.8257  0.0053 -6.2965 3  436.8933123  71510 30361 556      62 459        syn-C2H3C(O)NH2, v=0
  261843.8257  0.0053 -6.2965 3  436.8933123  71510 30361 656      62 359        syn-C2H3C(O)NH2, v=0
  261883.5498  0.0194 -6.5860 3  854.5201167  71510 303831073      84 976        syn-C2H3C(O)NH2, v=0
  261883.5499  0.0194 -6.5860 3  854.5201167  71510 303831173      84 876        syn-C2H3C(O)NH2, v=0
  261974.1094  0.0016 -5.6718 3   18.8439 25  71510 30312 6 7      11 3 8        syn-C2H3C(O)NH2, v=0
  261987.3972  0.0200 -3.9501 3  646.4255139 -71510 303691555      691456        syn-C2H3C(O)NH2, v=0
  262003.1244  0.0493 -6.4949 3  859.7164107  71510 3035347 6      5446 9        syn-C2H3C(O)NH2, v=0
  262003.1244  0.0493 -6.4949 3  859.7164107  71510 3035347 7      5446 8        syn-C2H3C(O)NH2, v=0
  262042.3819  0.0200 -3.5948 3  423.8659105 -71510 303522032      521933        syn-C2H3C(O)NH2, v=0
  262044.0283  0.0200 -3.5948 3  423.8659105 -71510 303522033      521934        syn-C2H3C(O)NH2, v=0
  262069.8078  0.1553 -5.6194 3 1597.3332213  71510 303A62977      A62878        syn-C2H3C(O)NH2, v=0
  262099.1204  0.0200 -3.8250 3  591.9926127 -71510 303632142      632043        syn-C2H3C(O)NH2, v=0
  262103.7522  0.0103 -4.6837 3 1099.9483177  71510 303882465      882366        syn-C2H3C(O)NH2, v=0
  262152.0015  0.0200 -3.4615 3  137.4916 65 -71510 30332 825      31 724        syn-C2H3C(O)NH2, v=0
  262188.6880  0.0200 -3.4291 3  145.6885 67 -71510 30333 826      32 725        syn-C2H3C(O)NH2, v=0
  262201.7852  0.0061 -4.2617 3  858.8087155  71510 303772354      772255        syn-C2H3C(O)NH2, v=0
  262221.7703  0.0159 -4.4911 3  986.0727169  71510 303842164      842065        syn-C2H3C(O)NH2, v=0
  262279.7282  0.0200 -3.8244 3  591.9859127 -71510 303632143      632044        syn-C2H3C(O)NH2, v=0
  262287.0822  0.0034 -6.3577 3   14.4281 25  71510 30312 4 8      11 111        syn-C2H3C(O)NH2, v=0
  262408.5169  0.0009 -5.2481 3  180.4805 71  71510 303351224      341223        syn-C2H3C(O)NH2, v=0
  262457.9721  0.0022 -6.4566 3  410.2607 73  71510 3033633 3      3533 2        syn-C2H3C(O)NH2, v=0
  262457.9721  0.0022 -6.4566 3  410.2607 73  71510 3033633 4      3533 3        syn-C2H3C(O)NH2, v=0
  262541.3407  0.0093 -4.6419 3 1077.4808175  71510 303872464      872365        syn-C2H3C(O)NH2, v=0
  262546.9869  0.0020 -6.3058 3  394.9431 73  71510 3033632 4      3532 3        syn-C2H3C(O)NH2, v=0
  262546.9869  0.0020 -6.3058 3  394.9431 73  71510 3033632 5      3532 4        syn-C2H3C(O)NH2, v=0
  262577.2226  0.0121 -4.7239 3 1122.6567179  71510 303892466      892367        syn-C2H3C(O)NH2, v=0
  262583.8056  0.0009 -5.2475 3  180.4868 71  71510 303351223      341222        syn-C2H3C(O)NH2, v=0
  262610.2587  0.0096 -4.2880 3  865.5592159  71510 303791961      791862        syn-C2H3C(O)NH2, v=0
  262642.0281  0.0019 -6.1841 3  380.0980 73  71510 3033631 5      3531 4        syn-C2H3C(O)NH2, v=0
  262642.0281  0.0019 -6.1841 3  380.0980 73  71510 3033631 6      3531 5        syn-C2H3C(O)NH2, v=0
  262684.4962  0.0433 -6.5026 3  812.3415103  71510 3035146 5      5245 8        syn-C2H3C(O)NH2, v=0
  262684.4962  0.0433 -6.5026 3  812.3415103  71510 3035146 6      5245 7        syn-C2H3C(O)NH2, v=0
  262706.6846  0.0038 -6.2463 3  492.2879115  71510 303572038      581741        syn-C2H3C(O)NH2, v=0
  262744.0129  0.0018 -6.0812 3  365.7258 73  71510 3033630 6      3530 5        syn-C2H3C(O)NH2, v=0
  262744.0129  0.0018 -6.0812 3  365.7258 73  71510 3033630 7      3530 6        syn-C2H3C(O)NH2, v=0
  262755.8675  0.0029 -3.9333 3  232.2048 93  71510 30346 244      46 145        syn-C2H3C(O)NH2, v=0
  262755.8675  0.0029 -3.9333 3  232.2048 93  71510 30346 344      46 245        syn-C2H3C(O)NH2, v=0
  262854.0230  0.0017 -5.9916 3  351.8269 73  71510 3033629 7      3529 6        syn-C2H3C(O)NH2, v=0
  262854.0230  0.0017 -5.9916 3  351.8269 73  71510 3033629 8      3529 7        syn-C2H3C(O)NH2, v=0
  262973.3410  0.0016 -5.9120 3  338.4019 73  71510 3033628 8      3528 7        syn-C2H3C(O)NH2, v=0
  262973.3410  0.0016 -5.9120 3  338.4019 73  71510 3033628 9      3528 8        syn-C2H3C(O)NH2, v=0
  263003.0066  0.0063 -5.4895 3   61.4752 45  71510 30322 517      22 220        syn-C2H3C(O)NH2, v=0
  263035.5563  0.0047 -4.1058 3  752.3211149  71510 303741758      741659        syn-C2H3C(O)NH2, v=0
  263044.0162  0.0200 -4.0513 3  736.7087143 -71510 303712250      712151        syn-C2H3C(O)NH2, v=0
  263086.7821  0.0008 -5.1955 3  166.9310 71  71510 30335 927      34 926        syn-C2H3C(O)NH2, v=0
  263103.4987  0.0015 -5.8403 3  325.4511 73  71510 3033627 9      3527 8        syn-C2H3C(O)NH2, v=0
  263103.4987  0.0015 -5.8403 3  325.4511 73  71510 303362710      3527 9        syn-C2H3C(O)NH2, v=0
  263151.8298  0.0051 -4.7264 3  710.0046141  71510 303702149      692248        syn-C2H3C(O)NH2, v=0
  263171.1773  0.0039 -4.6480 3  666.5228137  71510 303682049      672146        syn-C2H3C(O)NH2, v=0
  263173.1419  0.0200 -3.5776 3  410.9260103 -71510 303512031      511932        syn-C2H3C(O)NH2, v=0
  263174.0409  0.0200 -3.5776 3  410.9260103 -71510 303512032      511933        syn-C2H3C(O)NH2, v=0
  263241.5092  0.0200 -3.7018 3  311.5779103 -71510 30351 546      51 447        syn-C2H3C(O)NH2, v=0
  263241.5092  0.0200 -3.7018 3  311.5779103 -71510 30351 646      51 547        syn-C2H3C(O)NH2, v=0
  263246.3376  0.0014 -5.7750 3  312.9753 73  71510 303362610      3526 9        syn-C2H3C(O)NH2, v=0
  263246.3376  0.0014 -5.7750 3  312.9753 73  71510 303362611      352610        syn-C2H3C(O)NH2, v=0
  263246.5199  0.0024 -3.4897 3  129.4776 63  71510 30331 824      30 723        syn-C2H3C(O)NH2, v=0
  263349.7656  0.0060 -6.3702 3  374.3154115  71510 30357 453      58 356        syn-C2H3C(O)NH2, v=0
  263349.7656  0.0060 -6.3702 3  374.3154115  71510 30357 553      58 256        syn-C2H3C(O)NH2, v=0
  263355.6762  0.0380 -6.5338 3  766.3995 99  71510 3034945 4      5044 7        syn-C2H3C(O)NH2, v=0
  263355.6762  0.0380 -6.5338 3  766.3995 99  71510 3034945 5      5044 6        syn-C2H3C(O)NH2, v=0
  263392.2013  0.0085 -6.5029 3  710.8293139  71510 303692347      702050        syn-C2H3C(O)NH2, v=0
  263404.0896  0.0013 -5.7152 3  300.9751 73  71510 303362511      352510        syn-C2H3C(O)NH2, v=0
  263404.0896  0.0013 -5.7152 3  300.9751 73  71510 303362512      352511        syn-C2H3C(O)NH2, v=0
  263407.8417  0.0044 -6.3154 3  560.6838123  71510 303612141      621844        syn-C2H3C(O)NH2, v=0
  263418.2473  0.0109 -6.6049 3  541.0660125  71510 303621646      631351        syn-C2H3C(O)NH2, v=0
  263473.8075  0.0023 -5.9665 3   35.6495 31  71510 30315 8 7      15 510        syn-C2H3C(O)NH2, v=0
  263490.6946  0.0200 -3.3951 3  154.0582 69 -71510 30334 827      33 726        syn-C2H3C(O)NH2, v=0
  263537.9202  0.0028 -6.1519 3  368.7368 99  71510 303491831      501536        syn-C2H3C(O)NH2, v=0
  263550.2339  0.0009 -5.1295 3  186.2303 85  71510 30342 141      41 140        syn-C2H3C(O)NH2, v=0
  263550.2455  0.0200 -2.9570 3  186.2303 85 -71510 30342 141      41 240        syn-C2H3C(O)NH2, v=0
  263550.2455  0.0200 -2.9570 3  186.2303 85 -71510 30342 241      41 140        syn-C2H3C(O)NH2, v=0
  263550.2339  0.0009 -5.1295 3  186.2303 85  71510 30342 241      41 240        syn-C2H3C(O)NH2, v=0
  263555.1561  0.0200 -2.9980 3  185.1939 83 -71510 30341 239      40 338        syn-C2H3C(O)NH2, v=0
  263555.1540  0.0008 -5.1418 3  185.1939 83  71510 30341 339      40 338        syn-C2H3C(O)NH2, v=0
  263555.1541  0.0008 -5.1418 3  185.1939 83  71510 30341 239      40 238        syn-C2H3C(O)NH2, v=0
  263555.1561  0.0200 -2.9980 3  185.1939 83 -71510 30341 339      40 238        syn-C2H3C(O)NH2, v=0
  263558.1423  0.0010 -5.1164 3  186.7522 87  71510 30343 043      42 042        syn-C2H3C(O)NH2, v=0
  263558.1414  0.0200 -2.9191 3  186.7522 87 -71510 30343 043      42 142        syn-C2H3C(O)NH2, v=0
  263558.1414  0.0200 -2.9191 3  186.7522 87 -71510 30343 143      42 042        syn-C2H3C(O)NH2, v=0
  263558.1423  0.0010 -5.1164 3  186.7522 87  71510 30343 143      42 142        syn-C2H3C(O)NH2, v=0
  263579.4834  0.0013 -5.6600 3  289.4514 73  71510 303362412      352411        syn-C2H3C(O)NH2, v=0
  263579.4834  0.0013 -5.6600 3  289.4514 73  71510 303362413      352412        syn-C2H3C(O)NH2, v=0
  263590.6873  0.0200 -3.0434 3  183.6280 81 -71510 30340 337      39 436        syn-C2H3C(O)NH2, v=0
  263590.6851  0.0008 -5.1531 3  183.6280 81  71510 30340 437      39 436        syn-C2H3C(O)NH2, v=0
  263590.6892  0.0008 -5.1531 3  183.6280 81  71510 30340 337      39 336        syn-C2H3C(O)NH2, v=0
  263590.6873  0.0200 -3.0434 3  183.6280 81 -71510 30340 437      39 336        syn-C2H3C(O)NH2, v=0
  263619.1350  0.0030 -6.5159 3  123.5638 55  71510 303271315      281018        syn-C2H3C(O)NH2, v=0
  263627.9928  0.0056 -6.4013 3  633.5320131  71510 303652244      661947        syn-C2H3C(O)NH2, v=0
  263630.0714  0.0026 -6.2322 3  207.5842 73  71510 303361522      371225        syn-C2H3C(O)NH2, v=0
  263688.7936  0.0008 -3.0949 3  181.5114 79  71510 30339 435      38 534        syn-C2H3C(O)NH2, v=0
  263689.0132  0.0008 -5.1632 3  181.5114 79  71510 30339 535      38 534        syn-C2H3C(O)NH2, v=0
  263689.2195  0.0008 -5.1632 3  181.5114 79  71510 30339 435      38 434        syn-C2H3C(O)NH2, v=0
  263689.4763  0.0200 -3.0949 3  181.5114 79 -71510 30339 535      38 434        syn-C2H3C(O)NH2, v=0
  263692.6220  0.0082 -4.2114 3  817.5403155  71510 303771760      771661        syn-C2H3C(O)NH2, v=0
  263753.2229  0.0430 -4.7084 3 1104.3751179  71510 303892168      892069        syn-C2H3C(O)NH2, v=0
  263774.5597  0.0088 -4.5988 3 1055.2631173  71510 303862463      862364        syn-C2H3C(O)NH2, v=0
  263775.8871  0.0012 -5.6089 3  278.4053 73  71510 303362313      352312        syn-C2H3C(O)NH2, v=0
  263775.8871  0.0012 -5.6089 3  278.4053 73  71510 303362314      352313        syn-C2H3C(O)NH2, v=0
  263857.4000  0.0023 -4.3963 3  162.5978 69  71510 303341024      34 727        syn-C2H3C(O)NH2, v=0
  263902.7947  0.0200 -3.1559 3  178.8118 77 -71510 30338 533      37 632        syn-C2H3C(O)NH2, v=0
  263902.9724  0.0009 -5.2237 3  175.4770 71  71510 303351125      341124        syn-C2H3C(O)NH2, v=0
  263910.7358  0.0008 -5.1718 3  178.8118 77  71510 30338 633      37 632        syn-C2H3C(O)NH2, v=0
  263917.4907  0.0008 -5.1718 3  178.8114 77  71510 30338 533      37 532        syn-C2H3C(O)NH2, v=0
  263925.4569  0.0200 -3.1558 3  178.8114 77 -71510 30338 633      37 532        syn-C2H3C(O)NH2, v=0
  263938.2500  0.0058 -6.3209 3  591.0361141  71510 30370 763      71 666        syn-C2H3C(O)NH2, v=0
  263938.2500  0.0058 -6.3209 3  591.0361141  71510 30370 863      71 566        syn-C2H3C(O)NH2, v=0
  263997.5042  0.0012 -5.5614 3  267.8379 73  71510 303362214      352213        syn-C2H3C(O)NH2, v=0
  263997.5042  0.0012 -5.5614 3  267.8379 73  71510 303362215      352214        syn-C2H3C(O)NH2, v=0
  263997.7129  0.0030 -6.5148 3  123.5512 55  71510 303271314      281019        syn-C2H3C(O)NH2, v=0
  264016.4883  0.0332 -6.5973 3  721.8913 95  71510 3034744 3      4843 6        syn-C2H3C(O)NH2, v=0
  264016.4883  0.0332 -6.5973 3  721.8913 95  71510 3034744 4      4843 5        syn-C2H3C(O)NH2, v=0
  264042.3537  0.0151 -4.7625 3 1145.5971181  71510 303902467      902368        syn-C2H3C(O)NH2, v=0
  264060.8694  0.0025 -4.5069 3  583.9482129  71510 303641847      631944        syn-C2H3C(O)NH2, v=0
  264080.6781  0.0200 -3.8895 3  604.3352135 -71510 303671354      671255        syn-C2H3C(O)NH2, v=0
  264114.4726  0.0016 -6.2018 3   13.1196 21  71510 30310 6 4       9 3 7        syn-C2H3C(O)NH2, v=0
  264114.6475  0.1248 -6.1320 3 1173.9015185  71510 303922271      912368        syn-C2H3C(O)NH2, v=0
  264121.7821  0.0031 -4.4726 3  567.9828127  71510 303631845      621944        syn-C2H3C(O)NH2, v=0
  264146.0562  0.0200 -3.2335 3  175.4799 75 -71510 30337 631      36 730        syn-C2H3C(O)NH2, v=0
  264153.6992  0.0043 -6.5321 3  175.4687 71  71510 303351125      36 630        syn-C2H3C(O)NH2, v=0
  264170.4992  0.0031 -4.5718 3  624.4992133  71510 303661948      652045        syn-C2H3C(O)NH2, v=0
  264190.5277  0.0200 -3.7965 3  576.1560125 -71510 303622141      622042        syn-C2H3C(O)NH2, v=0
  264200.9301  0.0050 -4.2871 3  878.4480157  71510 303782356      782257        syn-C2H3C(O)NH2, v=0
  264221.5292  0.0200 -3.8890 3  604.3358135 -71510 303671454      671355        syn-C2H3C(O)NH2, v=0
  264225.3799  0.0200 -3.5614 3  398.2488101 -71510 303502030      501931        syn-C2H3C(O)NH2, v=0
  264225.3799  0.0200 -3.5614 3  398.2488101 -71510 303502031      501932        syn-C2H3C(O)NH2, v=0
  264243.6783  0.0200 -3.4855 3  184.7088 75 -71510 30337 829      36 928        syn-C2H3C(O)NH2, v=0
  264249.6454  0.0011 -5.5171 3  257.7509 73  71510 303362115      352114        syn-C2H3C(O)NH2, v=0
  264249.6454  0.0011 -5.5171 3  257.7509 73  71510 303362116      352115        syn-C2H3C(O)NH2, v=0
  264273.6640  0.0016 -5.4317 3   21.9732 27  71510 30313 6 8      12 3 9        syn-C2H3C(O)NH2, v=0
  264292.0512  0.0200 -3.7961 3  576.1522125 -71510 303622142      622043        syn-C2H3C(O)NH2, v=0
  264340.0289  0.0008 -5.1784 3  175.4799 75  71510 30337 731      36 730        syn-C2H3C(O)NH2, v=0
  264474.3935  0.0068 -6.5332 3  316.2605107  71510 30353 350      54 253        syn-C2H3C(O)NH2, v=0
  264474.3935  0.0068 -6.5332 3  316.2605107  71510 30353 450      54 153        syn-C2H3C(O)NH2, v=0
  264483.5658  0.0008 -5.1779 3  175.4687 75  71510 30337 631      36 630        syn-C2H3C(O)NH2, v=0
  264539.1171  0.0011 -5.4758 3  248.1460 73  71510 303362016      352015        syn-C2H3C(O)NH2, v=0
  264539.1171  0.0011 -5.4758 3  248.1460 73  71510 303362017      352016        syn-C2H3C(O)NH2, v=0
  264677.5650  0.0200 -3.2317 3  175.4687 75 -71510 30337 731      36 630        syn-C2H3C(O)NH2, v=0
  264686.4344  0.0008 -5.2042 3  171.0210 71  71510 303351026      341025        syn-C2H3C(O)NH2, v=0
  264688.0257  0.0200 -4.0188 3  718.7824141 -71510 303702248      702149        syn-C2H3C(O)NH2, v=0
  264717.6662  0.0008 -5.1837 3  171.4707 73  71510 30336 829      35 828        syn-C2H3C(O)NH2, v=0
  264748.3648  0.0206 -4.7069 3 1113.8257179  71510 303892367      892268        syn-C2H3C(O)NH2, v=0
  264795.9380  0.0200 -3.6850 3  343.8010107 -71510 30353 647      53 548        syn-C2H3C(O)NH2, v=0
  264795.9380  0.0200 -3.6850 3  343.8010107 -71510 30353 747      53 648        syn-C2H3C(O)NH2, v=0
  264869.5862  0.0025 -6.2285 3  207.5429 73  71510 303361521      371226        syn-C2H3C(O)NH2, v=0
  264870.7156  0.1156 -5.1953 3 1371.5556199  71510 303992475      992376        syn-C2H3C(O)NH2, v=0
  264874.7902  0.0010 -5.4373 3  239.0257 73  71510 303361917      351916        syn-C2H3C(O)NH2, v=0
  264874.7902  0.0010 -5.4373 3  239.0257 73  71510 303361918      351917        syn-C2H3C(O)NH2, v=0
  264901.8435  0.0130 -6.4811 3  767.4173159  71510 30379 970      80 873        syn-C2H3C(O)NH2, v=0
  264901.8435  0.0130 -6.4811 3  767.4173159  71510 303791070      80 773        syn-C2H3C(O)NH2, v=0
  265024.6907  0.0200 -3.1955 3   50.7454 29 -71510 3031412 2      1311 3        syn-C2H3C(O)NH2, v=0
  265024.6907  0.0200 -3.1955 3   50.7454 29 -71510 3031412 3      1311 2        syn-C2H3C(O)NH2, v=0
  265153.8268  0.0025 -3.5106 3  121.6633 61  71510 30330 823      29 722        syn-C2H3C(O)NH2, v=0
  265204.0536  0.0200 -3.5464 3  385.8333 99 -71510 303492029      491930        syn-C2H3C(O)NH2, v=0
  265204.0536  0.0200 -3.5464 3  385.8333 99 -71510 303492030      491931        syn-C2H3C(O)NH2, v=0
  265215.9487  0.0009 -5.2195 3  175.5354 71  71510 303351124      341123        syn-C2H3C(O)NH2, v=0
  265242.6952  0.0036 -4.2325 3  428.1994111  71510 303551540      541639        syn-C2H3C(O)NH2, v=0
  265245.7219  0.0200 -3.8106 3  261.1760 97 -71510 30348 345      48 246        syn-C2H3C(O)NH2, v=0
  265245.7219  0.0200 -3.8106 3  261.1760 97 -71510 30348 445      48 346        syn-C2H3C(O)NH2, v=0
  265260.3793  0.0079 -4.8535 3  644.6077137  71510 303681752      671849        syn-C2H3C(O)NH2, v=0
  265268.4585  0.0010 -5.4011 3  230.3932 73  71510 303361818      351817        syn-C2H3C(O)NH2, v=0
  265268.4585  0.0010 -5.4011 3  230.3932 73  71510 303361819      351818        syn-C2H3C(O)NH2, v=0
  265269.6883  0.0200 -3.3462 3   61.7130 41 -71510 30320 912      19 811        syn-C2H3C(O)NH2, v=0
  265293.2832  0.0434 -4.8871 3 1211.1065185  71510 303922666      922567        syn-C2H3C(O)NH2, v=0
  265325.5629  0.0200 -3.4404 3   68.5435 45 -71510 30322 814      21 715        syn-C2H3C(O)NH2, v=0
  265353.9849  0.0122 -4.4476 3  969.3817165  71510 303822458      822359        syn-C2H3C(O)NH2, v=0
  265354.1137  0.0200 -3.3460 3   61.7105 41 -71510 30320 911      19 812        syn-C2H3C(O)NH2, v=0
  265393.3666  0.0129 -4.3205 3  885.3706161  71510 303801862      801763        syn-C2H3C(O)NH2, v=0
  265408.5680  0.0200 -3.2378 3   52.8794 33 -71510 3031611 6      1510 5        syn-C2H3C(O)NH2, v=0
  265408.5680  0.0200 -3.2378 3   52.8794 33 -71510 3031611 5      1510 6        syn-C2H3C(O)NH2, v=0
  265527.9616  0.0046 -5.8683 3   43.9289 39  71510 30319 515      19 218        syn-C2H3C(O)NH2, v=0
  265555.4028  0.0082 -6.5240 3  364.1086103  71510 303511338      521043        syn-C2H3C(O)NH2, v=0
  265621.7989  0.0010 -3.2852 3   56.5161 37  71510 3031810 9      17 9 8        syn-C2H3C(O)NH2, v=0
  265622.3361  0.0010 -3.2852 3   56.5161 37  71510 3031810 8      17 9 9        syn-C2H3C(O)NH2, v=0
  265624.9809  0.0294 -4.5687 3 1028.7983173  71510 303862066      861967        syn-C2H3C(O)NH2, v=0
  265661.9935  0.0034 -4.0335 3  707.2508145  71510 303721557      721458        syn-C2H3C(O)NH2, v=0
  265664.7142  0.0085 -4.5548 3 1033.3034171  71510 303852462      852363        syn-C2H3C(O)NH2, v=0
  265702.1543  0.0360 -5.7478 3 1246.7112183  71510 303913161      903258        syn-C2H3C(O)NH2, v=0
  265702.2677  0.0360 -5.7478 3 1246.7112183  71510 303913160      903259        syn-C2H3C(O)NH2, v=0
  265705.1743  0.0416 -5.8660 3 1306.5259187  71510 303933262      923359        syn-C2H3C(O)NH2, v=0
  265705.2131  0.0416 -5.8660 3 1306.5259187  71510 303933261      923360        syn-C2H3C(O)NH2, v=0
  265710.3983  0.0200 -3.4556 3   74.2485 47 -71510 30323 816      22 715        syn-C2H3C(O)NH2, v=0
  265736.1893  0.0010 -5.3673 3  222.2527 73  71510 303361720      351719        syn-C2H3C(O)NH2, v=0
  265736.1898  0.0010 -5.3673 3  222.2527 73  71510 303361719      351718        syn-C2H3C(O)NH2, v=0
  265749.8548  0.0022 -4.0154 3  718.7415141  71510 303702249      702150        syn-C2H3C(O)NH2, v=0
  265770.8903  0.0009 -5.1718 3  156.9529 69  71510 30334 826      33 825        syn-C2H3C(O)NH2, v=0
  265771.1580  0.0200 -3.8350 3  563.4403131 -71510 303651253      651154        syn-C2H3C(O)NH2, v=0
  265777.7174  0.0478 -5.9871 3 1367.7709191  71510 303953363      943460        syn-C2H3C(O)NH2, v=0
  265777.7305  0.0478 -5.9871 3 1367.7709191  71510 303953362      943461        syn-C2H3C(O)NH2, v=0
  265778.6914  0.0309 -5.6325 3 1188.3284179  71510 303893060      883157        syn-C2H3C(O)NH2, v=0
  265779.0194  0.0309 -5.6325 3 1188.3284179  71510 303893059      883158        syn-C2H3C(O)NH2, v=0
  265816.0409  0.0200 -3.8348 3  563.4404131 -71510 303651353      651254        syn-C2H3C(O)NH2, v=0
  265885.0922  0.0134 -4.3974 3  935.1729165  71510 303822063      821964        syn-C2H3C(O)NH2, v=0
  265911.4622  0.0548 -6.1112 3 1430.4447195  71510 303973464      963561        syn-C2H3C(O)NH2, v=0
  265911.4665  0.0548 -6.1112 3 1430.4447195  71510 303973463      963562        syn-C2H3C(O)NH2, v=0
  265922.1630  0.0032 -6.1818 3  428.1994107  71510 303531934      541639        syn-C2H3C(O)NH2, v=0
  265940.3306  0.0202 -4.6110 3 1060.0391175  71510 303872266      872167        syn-C2H3C(O)NH2, v=0
  265946.9745  0.0265 -5.5200 3 1131.3790175  71510 303872959      863056        syn-C2H3C(O)NH2, v=0
  265947.9118  0.0265 -5.5200 3 1131.3790175  71510 303872958      863057        syn-C2H3C(O)NH2, v=0
  266002.0134  0.0200 -3.3615 3  162.5978 71 -71510 30335 828      34 727        syn-C2H3C(O)NH2, v=0
  266006.0220  0.0200 -3.6839 3  377.2922111 -71510 30355 748      55 649        syn-C2H3C(O)NH2, v=0
  266006.0220  0.0200 -3.6839 3  377.2922111 -71510 30355 848      55 749        syn-C2H3C(O)NH2, v=0
  266038.1308  0.0035 -4.1837 3  213.7320 91  71510 30345 144      45 045        syn-C2H3C(O)NH2, v=0
  266038.1308  0.0035 -4.1837 3  213.7320 91  71510 30345 244      45 145        syn-C2H3C(O)NH2, v=0
  266089.7673  0.3401 -6.3903 3 2005.7702239  71510 303B93287      B93188        syn-C2H3C(O)NH2, v=0
  266099.4537  0.0624 -6.2382 3 1494.5460199  71510 303993565      983662        syn-C2H3C(O)NH2, v=0
  266099.4551  0.0624 -6.2382 3 1494.5460199  71510 303993564      983663        syn-C2H3C(O)NH2, v=0
  266103.4735  0.0197 -4.4395 3  955.7931167  71510 303831964      831865        syn-C2H3C(O)NH2, v=0
  266103.6128  0.0052 -6.2970 3  518.4261133  71510 30366 660      67 563        syn-C2H3C(O)NH2, v=0
  266103.6128  0.0052 -6.2970 3  518.4261133  71510 30366 760      67 463        syn-C2H3C(O)NH2, v=0
  266114.2681  0.0011 -3.7692 3  560.5937123  71510 303612140      612041        syn-C2H3C(O)NH2, v=0
  266114.6207  0.0200 -3.5325 3  373.6784 97 -71510 303482028      481929        syn-C2H3C(O)NH2, v=0
  266114.6207  0.0200 -3.5325 3  373.6784 97 -71510 303482029      481930        syn-C2H3C(O)NH2, v=0
  266170.3675  0.0200 -3.7690 3  560.5917123 -71510 303612141      612042        syn-C2H3C(O)NH2, v=0
  266221.8868  0.0225 -5.4105 3 1075.8647171  71510 303852858      842955        syn-C2H3C(O)NH2, v=0
  266224.5290  0.0225 -5.4105 3 1075.8647171  71510 303852857      842956        syn-C2H3C(O)NH2, v=0
  266279.3379  0.0026 -4.6165 3  129.4776 61  71510 303301020      30 723        syn-C2H3C(O)NH2, v=0
  266300.5514  0.0009 -5.3356 3  214.6096 73  71510 303361621      351620        syn-C2H3C(O)NH2, v=0
  266300.5624  0.0009 -5.3356 3  214.6096 73  71510 303361620      351619        syn-C2H3C(O)NH2, v=0
  266331.6422  0.0042 -4.6370 3  666.5147137  71510 303682048      672147        syn-C2H3C(O)NH2, v=0
  266335.8342  0.0709 -6.3681 3 1560.0731203  71510 303A13666      A03763        syn-C2H3C(O)NH2, v=0
  266335.8347  0.0709 -6.3681 3 1560.0731203  71510 303A13665      A03764        syn-C2H3C(O)NH2, v=0
  266369.4902  0.0032 -4.0313 3  707.2542145  71510 303721657      721558        syn-C2H3C(O)NH2, v=0
  266498.7472  0.0236 -4.6560 3 1086.8070175  71510 303872562      872463        syn-C2H3C(O)NH2, v=0
  266506.2053  0.0009 -5.1772 3  171.3100 73  71510 30336 729      35 728        syn-C2H3C(O)NH2, v=0
  266536.7294  0.0189 -4.7992 3 1168.7605183  71510 303912468      912369        syn-C2H3C(O)NH2, v=0
  266595.1573  0.0033 -5.1170 3   78.0253 47  71510 30323 914      23 617        syn-C2H3C(O)NH2, v=0
  266615.6351  0.0802 -6.5009 3 1627.0247207  71510 303A33767      A23864        syn-C2H3C(O)NH2, v=0
  266615.6353  0.0802 -6.5009 3 1627.0247207  71510 303A33766      A23865        syn-C2H3C(O)NH2, v=0
  266621.5919  0.0190 -5.3038 3 1021.7871167  71510 303832757      822854        syn-C2H3C(O)NH2, v=0
  266628.9299  0.0190 -5.3038 3 1021.7871167  71510 303832756      822855        syn-C2H3C(O)NH2, v=0
  266688.0796  0.0072 -4.2020 3  817.5578155  71510 303771860      771761        syn-C2H3C(O)NH2, v=0
  266739.6737  0.0016 -5.1993 3   25.3520 29  71510 30314 6 9      13 310        syn-C2H3C(O)NH2, v=0
  266808.2926  0.0200 -3.7879 3  523.7521127 -71510 303631152      631053        syn-C2H3C(O)NH2, v=0
  266821.6324  0.0200 -3.7879 3  523.7521127 -71510 303631252      631153        syn-C2H3C(O)NH2, v=0
  266847.0011  0.0200 -3.6954 3  412.0426115 -71510 30357 849      57 750        syn-C2H3C(O)NH2, v=0
  266847.0011  0.0200 -3.6954 3  412.0426115 -71510 30357 949      57 850        syn-C2H3C(O)NH2, v=0
  266951.3968  0.0022 -4.5043 3   34.7408 35  71510 30317 513      16 214        syn-C2H3C(O)NH2, v=0
  266961.8207  0.0200 -3.5197 3  361.7833 95 -71510 303472027      471928        syn-C2H3C(O)NH2, v=0
  266961.8207  0.0200 -3.5197 3  361.7833 95 -71510 303472028      471929        syn-C2H3C(O)NH2, v=0
  266977.3847  0.0040 -4.1549 3   50.1456 41  71510 30320 515      19 416        syn-C2H3C(O)NH2, v=0
  266994.4789  0.0009 -5.3057 3  207.4720 73  71510 303361522      351521        syn-C2H3C(O)NH2, v=0
  266994.6739  0.0009 -5.3057 3  207.4720 73  71510 303361521      351520        syn-C2H3C(O)NH2, v=0
  267014.9748  0.0200 -4.2152 3  839.1776153 -71510 303762353      762254        syn-C2H3C(O)NH2, v=0
  267101.6705  0.0019 -5.5318 3   48.0994 37  71510 30318 811      18 514        syn-C2H3C(O)NH2, v=0
  267167.9596  0.0159 -5.2000 3  969.1481163  71510 303812656      802753        syn-C2H3C(O)NH2, v=0
  267188.0086  0.0159 -5.1999 3  969.1481163  71510 303812655      802754        syn-C2H3C(O)NH2, v=0
  267190.3874  0.0046 -4.2457 3  858.6098155  71510 303772355      772256        syn-C2H3C(O)NH2, v=0
  267275.3507  0.0022 -6.1434 3   31.8388 29  71510 30314 8 6      14 5 9        syn-C2H3C(O)NH2, v=0
  267288.0109  0.0200 -3.7174 3  448.0426119 -71510 30359 950      59 851        syn-C2H3C(O)NH2, v=0
  267289.0053  0.0014 -3.7174 3  448.0426119  71510 303591050      59 951        syn-C2H3C(O)NH2, v=0
  267291.5516  0.0200 -3.7485 3  485.2825123 -71510 303611051      61 952        syn-C2H3C(O)NH2, v=0
  267295.2469  0.0200 -3.7485 3  485.2825123 -71510 303611151      611052        syn-C2H3C(O)NH2, v=0
  267316.8830  0.0200 -3.6145 3  207.8290 79 -71510 30339 930      381029        syn-C2H3C(O)NH2, v=0
  267318.9166  0.0009 -5.1750 3  159.4369 69  71510 30334 925      33 924        syn-C2H3C(O)NH2, v=0
  267343.9048  0.1994 -5.5690 3 1574.3378213  71510 303A62680      A62581        syn-C2H3C(O)NH2, v=0
  267370.3434  0.0717 -6.5935 3  995.8603117  71510 3035850 8      594911        syn-C2H3C(O)NH2, v=0
  267370.3434  0.0717 -6.5935 3  995.8603117  71510 3035850 9      594910        syn-C2H3C(O)NH2, v=0
  267374.0729  0.0020 -5.6592 3   43.6454 35  71510 30317 810      17 513        syn-C2H3C(O)NH2, v=0
  267436.8093  0.0026 -3.5221 3  114.0699 59  71510 30329 822      28 721        syn-C2H3C(O)NH2, v=0
  267451.6896  0.0200 -3.7425 3  291.4420101 -71510 30350 446      50 347        syn-C2H3C(O)NH2, v=0
  267451.6896  0.0200 -3.7425 3  291.4420101 -71510 30350 546      50 447        syn-C2H3C(O)NH2, v=0
  267462.6358  0.4646 -6.4203 3 2020.8916241  71510 303C03090      C02991        syn-C2H3C(O)NH2, v=0
  267553.3156  0.0019 -5.4191 3   52.7859 39  71510 30319 812      19 515        syn-C2H3C(O)NH2, v=0
  267640.4706  0.0087 -6.3984 3  684.8032151  71510 30375 867      76 770        syn-C2H3C(O)NH2, v=0
  267640.4706  0.0087 -6.3984 3  684.8032151  71510 30375 967      76 670        syn-C2H3C(O)NH2, v=0
  267692.4631  0.0200 -3.9827 3  701.0785139 -71510 303692247      692148        syn-C2H3C(O)NH2, v=0
  267749.6777  0.0200 -3.5080 3  350.1471 93 -71510 303462026      461927        syn-C2H3C(O)NH2, v=0
  267749.6777  0.0200 -3.5080 3  350.1471 93 -71510 303462027      461928        syn-C2H3C(O)NH2, v=0
  267816.6336  0.0035 -6.2309 3  492.1176115  71510 303572037      581742        syn-C2H3C(O)NH2, v=0
  267867.8615  0.0009 -5.2775 3  200.8510 73  71510 303361423      351422        syn-C2H3C(O)NH2, v=0
  267870.7303  0.0009 -5.2775 3  200.8511 73  71510 303361422      351421        syn-C2H3C(O)NH2, v=0
  267886.2255  0.0132 -5.0990 3  917.9496159  71510 303792555      782652        syn-C2H3C(O)NH2, v=0
  267891.8272  0.0200 -3.7431 3  545.3038121 -71510 303602139      602040        syn-C2H3C(O)NH2, v=0
  267922.3282  0.0200 -3.7430 3  545.3027121 -71510 303602140      602041        syn-C2H3C(O)NH2, v=0
  267924.7907  0.0025 -6.1793 3  252.6551 81  71510 303401625      411328        syn-C2H3C(O)NH2, v=0
  267937.7274  0.0056 -6.3132 3  450.3247125  71510 30362 557      63 460        syn-C2H3C(O)NH2, v=0
  267937.7274  0.0056 -6.3132 3  450.3247125  71510 30362 657      63 360        syn-C2H3C(O)NH2, v=0
  267940.0156  0.0132 -5.0988 3  917.9495159  71510 303792554      782653        syn-C2H3C(O)NH2, v=0
  268025.5447  0.3170 -5.9780 3 1790.8025227  71510 303B32885      B32786        syn-C2H3C(O)NH2, v=0
  268062.8961  0.0083 -4.5104 3 1011.6089169  71510 303842461      842362        syn-C2H3C(O)NH2, v=0
  268074.8545  0.0636 -6.5665 3  944.6764113  71510 3035649 7      574810        syn-C2H3C(O)NH2, v=0
  268074.8545  0.0636 -6.5665 3  944.6764113  71510 3035649 8      5748 9        syn-C2H3C(O)NH2, v=0
  268098.0124  0.0280 -5.3665 3  845.4827157  71510 303781960      772057        syn-C2H3C(O)NH2, v=0
  268151.8051  0.0020 -5.8019 3   39.4296 33  71510 30316 8 9      16 512        syn-C2H3C(O)NH2, v=0
  268326.9010  0.0200 -3.9807 3  701.0542139 -71510 303692248      692149        syn-C2H3C(O)NH2, v=0
  268349.8716  0.0035 -4.7196 3   32.1003 35  71510 30317 314      16 215        syn-C2H3C(O)NH2, v=0
  268449.5034  0.2029 -5.8337 3 1718.6798221  71510 303B03080      B02981        syn-C2H3C(O)NH2, v=0
  268482.0605  0.0200 -3.4976 3  338.7690 91 -71510 303452025      451926        syn-C2H3C(O)NH2, v=0
  268482.0605  0.0200 -3.4976 3  338.7690 91 -71510 303452026      451927        syn-C2H3C(O)NH2, v=0
  268590.5501  0.1020 -5.3310 3 1453.7729203  71510 303A12873      A12774        syn-C2H3C(O)NH2, v=0
  268670.0689  0.0026 -4.4807 3  560.6838127  71510 303631747      621844        syn-C2H3C(O)NH2, v=0
  268769.5146  0.0563 -6.5543 3  894.9230109  71510 3035448 6      5547 9        syn-C2H3C(O)NH2, v=0
  268769.5146  0.0563 -6.5543 3  894.9230109  71510 3035448 7      5547 8        syn-C2H3C(O)NH2, v=0
  268802.3471  0.0108 -5.0008 3  868.1939155  71510 303772454      762551        syn-C2H3C(O)NH2, v=0
  268806.8145  0.0030 -3.9341 3  242.0054 95  71510 30347 245      47 146        syn-C2H3C(O)NH2, v=0
  268806.8145  0.0030 -3.9341 3  242.0054 95  71510 30347 345      47 246        syn-C2H3C(O)NH2, v=0
  268815.9315  0.0200 -3.9638 3  663.3569141 -71510 303701456      701357        syn-C2H3C(O)NH2, v=0
  268943.7480  0.0109 -5.0004 3  868.1936155  71510 303772453      762552        syn-C2H3C(O)NH2, v=0
  268952.6229  0.0019 -5.3211 3   57.6990 41  71510 30320 813      20 516        syn-C2H3C(O)NH2, v=0
  268961.6162  0.0200 -3.3162 3  180.3007 75 -71510 30337 730      36 829        syn-C2H3C(O)NH2, v=0
  268987.6184  0.0056 -4.7243 3  122.7818 61  71510 30330 822      30 525        syn-C2H3C(O)NH2, v=0
  268993.4170  0.0009 -5.2507 3  194.7635 73  71510 303361324      351323        syn-C2H3C(O)NH2, v=0
  269027.5581  0.0009 -5.2506 3  194.7647 73  71510 303361323      351322        syn-C2H3C(O)NH2, v=0
  269067.3467  0.0200 -3.9630 3  663.3579141 -71510 303701556      701457        syn-C2H3C(O)NH2, v=0
  269133.2186  0.0180 -4.5136 3 1007.3798171  71510 303852165      852066        syn-C2H3C(O)NH2, v=0
  269135.0726  0.0200 -3.4674 3   80.1377 49 -71510 30324 817      23 716        syn-C2H3C(O)NH2, v=0
  269162.5076  0.0200 -3.4883 3  327.6482 89 -71510 303442024      441925        syn-C2H3C(O)NH2, v=0
  269162.5076  0.0200 -3.4883 3  327.6482 89 -71510 303442025      441926        syn-C2H3C(O)NH2, v=0
  269234.3593  0.0021 -5.9611 3   35.4573 31  71510 30315 8 8      15 511        syn-C2H3C(O)NH2, v=0
  269247.8025  0.0054 -4.1247 3  770.6964151  71510 303751659      751560        syn-C2H3C(O)NH2, v=0
  269253.2623  0.0040 -6.2977 3  560.4890123  71510 303612140      621845        syn-C2H3C(O)NH2, v=0
  269261.2916  0.0034 -6.4911 3  189.2723 73  71510 303361225      37 730        syn-C2H3C(O)NH2, v=0
  269359.9989  0.0200 -3.7057 3  322.9943105 -71510 30352 547      52 448        syn-C2H3C(O)NH2, v=0
  269359.9989  0.0200 -3.7057 3  322.9943105 -71510 30352 647      52 548        syn-C2H3C(O)NH2, v=0
  269371.6459  0.0035 -4.3026 3  477.4261117  71510 303581642      571741        syn-C2H3C(O)NH2, v=0
  269419.5853  0.0063 -6.3852 3  386.7387117  71510 30358 454      59 357        syn-C2H3C(O)NH2, v=0
  269419.5853  0.0063 -6.3852 3  386.7387117  71510 30358 554      59 257        syn-C2H3C(O)NH2, v=0
  269454.1729  0.0497 -6.5603 3  846.6009105  71510 3035247 5      5346 8        syn-C2H3C(O)NH2, v=0
  269454.1729  0.0497 -6.5603 3  846.6009105  71510 3035247 6      5346 7        syn-C2H3C(O)NH2, v=0
  269470.7297  0.0024 -6.1747 3  252.6035 81  71510 303401624      411329        syn-C2H3C(O)NH2, v=0
  269535.9443  0.0200 -3.3294 3  171.3100 73 -71510 30336 829      35 728        syn-C2H3C(O)NH2, v=0
  269539.6695  0.0200 -3.7182 3  530.2844119 -71510 303592138      592039        syn-C2H3C(O)NH2, v=0
  269547.6699  0.0031 -5.1725 3   25.7497 33  71510 30316 214      15 115        syn-C2H3C(O)NH2, v=0
  269555.9992  0.0200 -3.7182 3  530.2838119 -71510 303592139      592040        syn-C2H3C(O)NH2, v=0
  269574.6918  0.0145 -5.0923 3  741.5945147  71510 303731856      721953        syn-C2H3C(O)NH2, v=0
  269603.5395  0.0009 -5.1180 3  195.0214 87  71510 30343 142      42 141        syn-C2H3C(O)NH2, v=0
  269603.5546  0.0200 -2.9445 3  195.0214 87 -71510 30343 142      42 241        syn-C2H3C(O)NH2, v=0
  269603.5546  0.0200 -2.9445 3  195.0214 87 -71510 30343 242      42 141        syn-C2H3C(O)NH2, v=0
  269603.5395  0.0009 -5.1180 3  195.0214 87  71510 30343 242      42 241        syn-C2H3C(O)NH2, v=0
  269607.3622  0.0008 -5.1299 3  193.9851 85  71510 30342 240      41 239        syn-C2H3C(O)NH2, v=0
  269607.3723  0.0200 -2.9843 3  193.9851 85 -71510 30342 240      41 339        syn-C2H3C(O)NH2, v=0
  269607.3723  0.0200 -2.9843 3  193.9851 85 -71510 30342 340      41 239        syn-C2H3C(O)NH2, v=0
  269607.3622  0.0008 -5.1299 3  193.9851 85  71510 30342 340      41 339        syn-C2H3C(O)NH2, v=0
  269611.7086  0.0010 -5.1052 3  195.5436 89  71510 30344 044      43 043        syn-C2H3C(O)NH2, v=0
  269611.7072  0.0200 -2.9076 3  195.5436 89 -71510 30344 044      43 143        syn-C2H3C(O)NH2, v=0
  269611.7072  0.0200 -2.9076 3  195.5436 89 -71510 30344 144      43 043        syn-C2H3C(O)NH2, v=0
  269611.7086  0.0010 -5.1052 3  195.5436 89  71510 30344 144      43 143        syn-C2H3C(O)NH2, v=0
  269615.9557  0.0025 -3.5234 3  106.7200 57  71510 30328 821      27 720        syn-C2H3C(O)NH2, v=0
  269639.6896  0.0200 -3.0282 3  192.4204 83 -71510 30341 338      40 437        syn-C2H3C(O)NH2, v=0
  269639.6883  0.0008 -5.1409 3  192.4204 83  71510 30341 438      40 437        syn-C2H3C(O)NH2, v=0
  269639.6903  0.0008 -5.1409 3  192.4204 83  71510 30341 338      40 337        syn-C2H3C(O)NH2, v=0
  269639.6896  0.0200 -3.0282 3  192.4204 83 -71510 30341 438      40 337        syn-C2H3C(O)NH2, v=0
  269650.6258  0.0028 -3.8567 3  268.8962 89  71510 303441133      431232        syn-C2H3C(O)NH2, v=0
  269713.0782  0.0023 -6.4838 3  434.8023 75  71510 3033734 3      3634 2        syn-C2H3C(O)NH2, v=0
  269713.0782  0.0023 -6.4838 3  434.8023 75  71510 3033734 4      3634 3        syn-C2H3C(O)NH2, v=0
  269729.9488  0.0200 -3.0778 3  190.3071 81 -71510 30340 436      39 535        syn-C2H3C(O)NH2, v=0
  269729.9014  0.0008 -5.1507 3  190.3071 81  71510 30340 536      39 535        syn-C2H3C(O)NH2, v=0
  269730.0084  0.0008 -5.1507 3  190.3071 81  71510 30340 436      39 435        syn-C2H3C(O)NH2, v=0
  269729.9488  0.0200 -3.0778 3  190.3071 81 -71510 30340 536      39 435        syn-C2H3C(O)NH2, v=0
  269794.2643  0.0200 -3.4802 3  316.7839 87 -71510 303432023      431924        syn-C2H3C(O)NH2, v=0
  269794.2643  0.0200 -3.4802 3  316.7839 87 -71510 303432024      431925        syn-C2H3C(O)NH2, v=0
  269802.7650  0.0021 -6.3319 3  419.0153 75  71510 3033733 4      3633 3        syn-C2H3C(O)NH2, v=0
  269802.7650  0.0021 -6.3319 3  419.0153 75  71510 3033733 5      3633 4        syn-C2H3C(O)NH2, v=0
  269872.8253  0.0015 -4.9796 3   28.9647 31  71510 30315 610      14 311        syn-C2H3C(O)NH2, v=0
  269878.3211  0.0008 -5.1787 3  175.7066 73  71510 30336 928      35 927        syn-C2H3C(O)NH2, v=0
  269898.1878  0.0020 -6.2090 3  403.7007 75  71510 3033732 5      3632 4        syn-C2H3C(O)NH2, v=0
  269898.1878  0.0020 -6.2090 3  403.7007 75  71510 3033732 6      3632 5        syn-C2H3C(O)NH2, v=0
  269928.6290  0.0200 -3.1358 3  187.6150 79 -71510 30339 534      38 633        syn-C2H3C(O)NH2, v=0
  269932.8950  0.0008 -5.1591 3  187.6150 79  71510 30339 634      38 633        syn-C2H3C(O)NH2, v=0
  269934.5669  0.0088 -4.9056 3  819.8834151  71510 303752353      742450        syn-C2H3C(O)NH2, v=0
  269936.5794  0.0008 -5.1591 3  187.6147 79  71510 30339 534      38 533        syn-C2H3C(O)NH2, v=0
  269940.8434  0.0200 -3.1358 3  187.6147 79 -71510 30339 634      38 533        syn-C2H3C(O)NH2, v=0
  269999.5287  0.0245 -4.7366 3 1136.5908181  71510 303902368      902269        syn-C2H3C(O)NH2, v=0
  270000.1977  0.0019 -6.1049 3  388.8588 75  71510 3033731 6      3631 5        syn-C2H3C(O)NH2, v=0
  270000.1977  0.0019 -6.1049 3  388.8588 75  71510 3033731 7      3631 6        syn-C2H3C(O)NH2, v=0
  270032.5879  0.0028 -6.3662 3  158.6912 63  71510 303311418      321121        syn-C2H3C(O)NH2, v=0
  270046.5924  0.0022 -6.3431 3   28.3135 27  71510 30313 8 5      13 5 8        syn-C2H3C(O)NH2, v=0
  270051.4304  0.0235 -4.8342 3 1192.1391185  71510 303922469      922370        syn-C2H3C(O)NH2, v=0
  270085.2242  0.0064 -6.3416 3  606.6842143  71510 30371 764      72 667        syn-C2H3C(O)NH2, v=0
  270085.2242  0.0064 -6.3416 3  606.6842143  71510 30371 864      72 567        syn-C2H3C(O)NH2, v=0
  270094.3771  0.0105 -4.3060 3  885.4003161  71510 303801962      801863        syn-C2H3C(O)NH2, v=0
  270109.7929  0.0017 -6.0141 3  374.4900 75  71510 3033730 7      3630 6        syn-C2H3C(O)NH2, v=0
  270109.7929  0.0017 -6.0141 3  374.4900 75  71510 3033730 8      3630 7        syn-C2H3C(O)NH2, v=0
  270119.7081  0.0037 -6.4697 3  198.5326 75  71510 303371226      38 731        syn-C2H3C(O)NH2, v=0
  270128.6707  0.0437 -6.5899 3  799.7111101  71510 3035046 4      5145 7        syn-C2H3C(O)NH2, v=0
  270128.6707  0.0437 -6.5899 3  799.7111101  71510 3035046 5      5145 6        syn-C2H3C(O)NH2, v=0
  270164.5461  0.0848 -5.0259 3 1287.4727193  71510 303962373      962274        syn-C2H3C(O)NH2, v=0
  270189.2423  0.0041 -4.2052 3  839.0524153  71510 303762354      762255        syn-C2H3C(O)NH2, v=0
  270226.1878  0.0200 -3.2083 3  184.2974 77 -71510 30338 632      37 731        syn-C2H3C(O)NH2, v=0
  270228.1506  0.0016 -5.9333 3  360.5948 75  71510 3033729 8      3629 7        syn-C2H3C(O)NH2, v=0
  270228.1506  0.0016 -5.9333 3  360.5948 75  71510 3033729 9      3629 8        syn-C2H3C(O)NH2, v=0
  270260.4743  0.0051 -6.3812 3  633.3110131  71510 303652243      661948        syn-C2H3C(O)NH2, v=0
  270297.7730  0.0089 -4.9044 3  819.8826151  71510 303752352      742451        syn-C2H3C(O)NH2, v=0
  270336.4356  0.0008 -5.1655 3  184.2974 77  71510 30338 732      37 731        syn-C2H3C(O)NH2, v=0
  270356.6679  0.0015 -5.8605 3  347.1737 75  71510 3033728 9      3628 8        syn-C2H3C(O)NH2, v=0
  270356.6679  0.0015 -5.8605 3  347.1737 75  71510 303372810      3628 9        syn-C2H3C(O)NH2, v=0
  270380.3102  0.0200 -3.4735 3  306.1755 85 -71510 303422022      421923        syn-C2H3C(O)NH2, v=0
  270380.3102  0.0200 -3.4735 3  306.1755 85 -71510 303422023      421924        syn-C2H3C(O)NH2, v=0
  270389.8575  0.0200 -3.9483 3  683.6599137 -71510 303682246      682147        syn-C2H3C(O)NH2, v=0
  270420.1572  0.0008 -5.1652 3  184.2909 77  71510 30338 632      37 631        syn-C2H3C(O)NH2, v=0
  270425.3177  0.0009 -5.2251 3  189.2335 73  71510 303361225      351224        syn-C2H3C(O)NH2, v=0
  270430.4558  0.0051 -4.1210 3  770.7026151  71510 303751759      751660        syn-C2H3C(O)NH2, v=0
  270450.4760  0.0021 -6.1393 3   31.7329 29  71510 30314 8 7      14 510        syn-C2H3C(O)NH2, v=0
  270497.0134  0.0015 -5.7940 3  334.2273 75  71510 303372710      3627 9        syn-C2H3C(O)NH2, v=0
  270497.0134  0.0015 -5.7940 3  334.2273 75  71510 303372711      362710        syn-C2H3C(O)NH2, v=0
  270525.2998  0.0071 -6.5466 3  327.6755109  71510 30354 351      55 254        syn-C2H3C(O)NH2, v=0
  270525.2998  0.0071 -6.5466 3  327.6755109  71510 30354 451      55 154        syn-C2H3C(O)NH2, v=0
  270530.4067  0.0200 -3.2072 3  184.2909 77 -71510 30338 732      37 631        syn-C2H3C(O)NH2, v=0
  270551.3519  0.0028 -6.3647 3  158.6739 63  71510 303311417      321122        syn-C2H3C(O)NH2, v=0
  270651.1951  0.0014 -5.7330 3  321.7562 75  71510 303372611      362610        syn-C2H3C(O)NH2, v=0
  270651.1951  0.0014 -5.7330 3  321.7562 75  71510 303372612      362611        syn-C2H3C(O)NH2, v=0
  270694.8898  0.0030 -5.1701 3   25.7496 33  71510 30316 314      15 015        syn-C2H3C(O)NH2, v=0
  270742.4894  0.0009 -5.2241 3  189.2457 73  71510 303361224      351223        syn-C2H3C(O)NH2, v=0
  270751.6253  0.0034 -5.2408 3   65.0154 45  71510 30322 716      22 419        syn-C2H3C(O)NH2, v=0
  270762.7832  0.0018 -3.9471 3  683.6457137  71510 303682247      682148        syn-C2H3C(O)NH2, v=0
  270764.5557  0.0010 -5.1840 3  171.3992 71  71510 303351025      341024        syn-C2H3C(O)NH2, v=0
  270821.6485  0.0013 -5.6766 3  309.7613 75  71510 303372512      362511        syn-C2H3C(O)NH2, v=0
  270821.6485  0.0013 -5.6766 3  309.7613 75  71510 303372513      362512        syn-C2H3C(O)NH2, v=0
  270822.5056  0.0079 -4.4657 3  990.1857167  71510 303832460      832361        syn-C2H3C(O)NH2, v=0
  270827.3109  0.0032 -6.5262 3  180.1997 71  71510 303351224      36 729        syn-C2H3C(O)NH2, v=0
  270828.0826  0.0008 -5.1701 3  180.3007 75  71510 30337 830      36 829        syn-C2H3C(O)NH2, v=0
  270863.6240  0.0060 -5.8883 3   48.2757 41  71510 30320 416      20 119        syn-C2H3C(O)NH2, v=0
  270863.7306  0.0076 -6.4803 3  710.5804139  71510 303692346      702051        syn-C2H3C(O)NH2, v=0
  270923.5274  0.0200 -3.4680 3  295.8222 83 -71510 303412021      411922        syn-C2H3C(O)NH2, v=0
  270923.5274  0.0200 -3.4680 3  295.8222 83 -71510 303412022      411923        syn-C2H3C(O)NH2, v=0
  270954.3959  0.0200 -3.6902 3  355.8243109 -71510 30354 648      54 549        syn-C2H3C(O)NH2, v=0
  270954.3959  0.0200 -3.6902 3  355.8243109 -71510 30354 748      54 649        syn-C2H3C(O)NH2, v=0
  271011.3541  0.0013 -5.6244 3  298.2435 75  71510 303372413      362412        syn-C2H3C(O)NH2, v=0
  271011.3541  0.0013 -5.6244 3  298.2435 75  71510 303372414      362413        syn-C2H3C(O)NH2, v=0
  271024.8560  0.0200 -3.9016 3  620.6459137 -71510 303681355      681256        syn-C2H3C(O)NH2, v=0
  271070.9929  0.0200 -3.6945 3  515.5339117 -71510 303582137      582038        syn-C2H3C(O)NH2, v=0
  271079.5641  0.0200 -3.6944 3  515.5336117 -71510 303582138      582039        syn-C2H3C(O)NH2, v=0
  271107.8975  0.0145 -6.5057 3  785.2804161  71510 30380 971      81 874        syn-C2H3C(O)NH2, v=0
  271107.8975  0.0145 -6.5057 3  785.2804161  71510 303801071      81 774        syn-C2H3C(O)NH2, v=0
  271108.5946  0.0200 -3.9013 3  620.6462137 -71510 303681455      681356        syn-C2H3C(O)NH2, v=0
  271150.8458  0.0042 -4.1717 3  819.8541151  71510 303752352      752253        syn-C2H3C(O)NH2, v=0
  271202.6759  0.0200 -3.4834 3   86.3332 51 -71510 30325 818      24 717        syn-C2H3C(O)NH2, v=0
  271207.3341  0.0021 -3.6319 3   71.0912 47  71510 30323 716      22 617        syn-C2H3C(O)NH2, v=0
  271223.9952  0.0012 -5.5757 3  287.2039 75  71510 303372314      362313        syn-C2H3C(O)NH2, v=0
  271223.9952  0.0012 -5.5757 3  287.2039 75  71510 303372315      362314        syn-C2H3C(O)NH2, v=0
  271225.1907  0.0023 -3.5154 3   99.6353 55  71510 30327 820      26 719        syn-C2H3C(O)NH2, v=0
  271272.0722  0.0071 -4.8137 3  773.0212147  71510 303732252      722349        syn-C2H3C(O)NH2, v=0
  271309.9777  0.0200 -3.8128 3  271.5820 99 -71510 30349 346      49 247        syn-C2H3C(O)NH2, v=0
  271309.9777  0.0200 -3.8128 3  271.5820 99 -71510 30349 446      49 347        syn-C2H3C(O)NH2, v=0
  271375.0622  0.0097 -4.3944 3  948.3928163  71510 303812457      812358        syn-C2H3C(O)NH2, v=0
  271414.5907  0.0136 -4.8439 3 1201.1470185  71510 303922568      922469        syn-C2H3C(O)NH2, v=0
  271415.5169  0.0037 -4.5463 3  624.4785133  71510 303661947      652046        syn-C2H3C(O)NH2, v=0
  271426.4906  0.0200 -3.4640 3  285.7234 81 -71510 303402020      401921        syn-C2H3C(O)NH2, v=0
  271426.4906  0.0200 -3.4640 3  285.7234 81 -71510 303402021      401922        syn-C2H3C(O)NH2, v=0
  271464.1758  0.0012 -5.5303 3  276.6439 75  71510 303372215      362214        syn-C2H3C(O)NH2, v=0
  271464.1758  0.0012 -5.5303 3  276.6439 75  71510 303372216      362215        syn-C2H3C(O)NH2, v=0
  271513.7069  0.0020 -5.2379 3   62.8329 43  71510 30321 814      21 517        syn-C2H3C(O)NH2, v=0
  271557.1863  0.0025 -6.1554 3  302.1863 89  71510 303441728      451431        syn-C2H3C(O)NH2, v=0
  271577.7223  0.0046 -6.5357 3  184.2909 73  71510 303361126      37 631        syn-C2H3C(O)NH2, v=0
  271616.7445  0.0009 -5.1599 3  165.8181 71  71510 30335 827      34 826        syn-C2H3C(O)NH2, v=0
  271665.7408  0.0021 -6.3406 3   28.2595 27  71510 30313 8 6      13 5 9        syn-C2H3C(O)NH2, v=0
  271737.7235  0.0011 -5.4878 3  266.5653 75  71510 303372116      362115        syn-C2H3C(O)NH2, v=0
  271737.7235  0.0011 -5.4878 3  266.5653 75  71510 303372117      362116        syn-C2H3C(O)NH2, v=0
  271823.5299  0.0124 -4.7998 3 1177.6513183  71510 303912567      912468        syn-C2H3C(O)NH2, v=0
  271854.6333  0.0020 -3.5008 3   92.8349 53  71510 30326 819      25 718        syn-C2H3C(O)NH2, v=0
  271888.7109  0.0200 -3.1387 3   53.0072 27 -71510 3031313 0      1212 1        syn-C2H3C(O)NH2, v=0
  271888.7109  0.0200 -3.1387 3   53.0072 27 -71510 3031313 1      1212 0        syn-C2H3C(O)NH2, v=0
  271891.6579  0.0200 -3.4614 3  275.8785 79 -71510 303392019      391920        syn-C2H3C(O)NH2, v=0
  271891.6579  0.0200 -3.4614 3  275.8785 79 -71510 303392020      391921        syn-C2H3C(O)NH2, v=0
  271907.5888  0.0009 -5.2016 3  184.2799 73  71510 303361126      351125        syn-C2H3C(O)NH2, v=0
  271939.3386  0.0163 -4.8865 3 1224.8829187  71510 303932569      932470        syn-C2H3C(O)NH2, v=0
  271991.3371  0.0009 -5.1660 3  180.1997 75  71510 30337 730      36 729        syn-C2H3C(O)NH2, v=0
  272025.2200  0.0022 -6.5727 3   25.0646 25  71510 30312 8 4      12 5 7        syn-C2H3C(O)NH2, v=0
  272052.1259  0.0011 -5.4480 3  256.9701 75  71510 303372017      362016        syn-C2H3C(O)NH2, v=0
  272052.1259  0.0011 -5.4480 3  256.9701 75  71510 303372018      362017        syn-C2H3C(O)NH2, v=0
  272081.7401  0.0036 -4.1840 3  223.1291 93  71510 30346 145      46 046        syn-C2H3C(O)NH2, v=0
  272081.7401  0.0036 -4.1840 3  223.1291 93  71510 30346 245      46 146        syn-C2H3C(O)NH2, v=0
  272155.1414  0.0200 -3.3364 3   66.6758 43 -71510 30321 913      20 812        syn-C2H3C(O)NH2, v=0
  272180.4760  0.0073 -4.8107 3  773.0191147  71510 303732251      722350        syn-C2H3C(O)NH2, v=0
  272215.6659  0.0200 -3.6904 3  389.9233113 -71510 30356 749      56 650        syn-C2H3C(O)NH2, v=0
  272215.6659  0.0200 -3.6904 3  389.9233113 -71510 30356 849      56 750        syn-C2H3C(O)NH2, v=0
  272220.1540  0.0056 -6.3161 3  533.0668135  71510 30367 661      68 564        syn-C2H3C(O)NH2, v=0
  272220.1540  0.0056 -6.3161 3  533.0668135  71510 30367 761      68 464        syn-C2H3C(O)NH2, v=0
  272237.4537  0.0016 -5.9752 3   15.5495 23  71510 30311 6 5      10 3 8        syn-C2H3C(O)NH2, v=0
  272253.8517  0.0086 -4.2249 3  836.7536157  71510 303781761      781662        syn-C2H3C(O)NH2, v=0
  272264.5893  0.0008 -5.1843 3  179.8500 73  71510 303361027      351026        syn-C2H3C(O)NH2, v=0
  272311.2741  0.0200 -3.1797 3   54.1606 31 -71510 3031512 3      1411 4        syn-C2H3C(O)NH2, v=0
  272311.2741  0.0200 -3.1797 3   54.1606 31 -71510 3031512 4      1411 3        syn-C2H3C(O)NH2, v=0
  272321.3390  0.0200 -3.4603 3  266.2868 77 -71510 303382018      381919        syn-C2H3C(O)NH2, v=0
  272321.3390  0.0200 -3.4603 3  266.2868 77 -71510 303382019      381920        syn-C2H3C(O)NH2, v=0
  272346.5058  0.0200 -3.3359 3   66.6703 43 -71510 30321 912      20 813        syn-C2H3C(O)NH2, v=0
  272417.1719  0.0010 -5.4108 3  247.8610 75  71510 303371918      361917        syn-C2H3C(O)NH2, v=0
  272417.1719  0.0010 -5.4108 3  247.8610 75  71510 303371919      361918        syn-C2H3C(O)NH2, v=0
  272465.2439  0.0231 -4.6364 3 1082.1749177  71510 303882267      882168        syn-C2H3C(O)NH2, v=0
  272496.4899  0.0200 -3.6718 3  501.0510115 -71510 303572136      572037        syn-C2H3C(O)NH2, v=0
  272500.8974  0.0200 -3.6718 3  501.0508115 -71510 303572137      572038        syn-C2H3C(O)NH2, v=0
  272505.2848  0.0200 -3.8465 3  579.1321133 -71510 303661254      661155        syn-C2H3C(O)NH2, v=0
  272531.4742  0.0200 -3.8464 3  579.1321133 -71510 303661354      661255        syn-C2H3C(O)NH2, v=0
  272664.9942  0.0200 -3.2220 3   56.7953 35 -71510 3031711 7      1610 6        syn-C2H3C(O)NH2, v=0
  272664.9942  0.0200 -3.2220 3   56.7953 35 -71510 3031711 6      1610 7        syn-C2H3C(O)NH2, v=0
  272717.6790  0.0200 -3.4608 3  256.9479 75 -71510 303372017      371918        syn-C2H3C(O)NH2, v=0
  272717.6790  0.0200 -3.4608 3  256.9479 75 -71510 303372018      371919        syn-C2H3C(O)NH2, v=0
  272728.2005  0.0056 -4.7256 3  727.6115143  71510 303712151      702248        syn-C2H3C(O)NH2, v=0
  272748.7969  0.0043 -5.4905 3   56.5208 43  71510 30321 616      21 319        syn-C2H3C(O)NH2, v=0
  272762.7160  0.0054 -6.4786 3   36.3637 37  71510 30318 315      18 018        syn-C2H3C(O)NH2, v=0
  272785.7570  0.0022 -6.5714 3   25.0392 25  71510 30312 8 5      12 5 8        syn-C2H3C(O)NH2, v=0
  272792.2450  0.0200 -3.2709 3   60.9439 39 -71510 303191010      18 9 9        syn-C2H3C(O)NH2, v=0
  272793.8703  0.0010 -3.2709 3   60.9439 39  71510 3031910 9      18 910        syn-C2H3C(O)NH2, v=0
  272837.9005  0.0016 -3.9155 3  666.5228135  71510 303672245      672146        syn-C2H3C(O)NH2, v=0
  272845.9308  0.0010 -5.3758 3  239.2416 75  71510 303371819      361818        syn-C2H3C(O)NH2, v=0
  272845.9308  0.0010 -5.3758 3  239.2416 75  71510 303371820      361819        syn-C2H3C(O)NH2, v=0
  272886.2580  0.0614 -5.0634 3 1317.1102193  71510 303962769      962670        syn-C2H3C(O)NH2, v=0
  273003.9084  0.0063 -4.7320 3  627.1295135  71510 303671751      661848        syn-C2H3C(O)NH2, v=0
  273053.0069  0.0119 -4.7544 3 1154.4046181  71510 303902566      902467        syn-C2H3C(O)NH2, v=0
  273053.5347  0.0200 -3.9148 3  666.5147135 -71510 303672246      672147        syn-C2H3C(O)NH2, v=0
  273082.7326  0.0200 -3.4631 3  247.8610 73 -71510 303362016      361917        syn-C2H3C(O)NH2, v=0
  273082.7326  0.0200 -3.4631 3  247.8610 73 -71510 303362017      361918        syn-C2H3C(O)NH2, v=0
  273120.7289  0.0200 -3.7031 3  425.2826117 -71510 30358 850      58 751        syn-C2H3C(O)NH2, v=0
  273120.7289  0.0200 -3.7030 3  425.2826117 -71510 30358 950      58 851        syn-C2H3C(O)NH2, v=0
  273132.7173  0.0037 -4.1655 3  819.7767151  71510 303752353      752254        syn-C2H3C(O)NH2, v=0
  273150.7885  0.0036 -4.0472 3  725.0055147  71510 303731558      731459        syn-C2H3C(O)NH2, v=0
  273153.6359  0.0200 -3.4414 3   74.0467 47 -71510 30323 815      22 716        syn-C2H3C(O)NH2, v=0
  273309.5235  0.0148 -4.4176 3  955.8425167  71510 303832064      831965        syn-C2H3C(O)NH2, v=0
  273314.0558  0.0040 -6.4598 3  207.9842 77  71510 303381227      39 732        syn-C2H3C(O)NH2, v=0
  273356.3067  0.0010 -5.3430 3  231.1167 75  71510 303371721      361720        syn-C2H3C(O)NH2, v=0
  273356.3080  0.0010 -5.3430 3  231.1167 75  71510 303371720      361719        syn-C2H3C(O)NH2, v=0
  273384.3610  0.0200 -3.7986 3  538.8278129 -71510 303641153      641054        syn-C2H3C(O)NH2, v=0
  273392.0601  0.0200 -3.7986 3  538.8278129 -71510 303641253      641154        syn-C2H3C(O)NH2, v=0
  273418.4009  0.0200 -3.4673 3  239.0257 71 -71510 303352015      351916        syn-C2H3C(O)NH2, v=0
  273418.4009  0.0200 -3.4673 3  239.0257 71 -71510 303352016      351917        syn-C2H3C(O)NH2, v=0
  273438.2205  0.0032 -4.4102 3  171.3100 71  71510 303351025      35 728        syn-C2H3C(O)NH2, v=0
  273444.8588  0.0025 -6.1499 3  302.1234 89  71510 303441727      451432        syn-C2H3C(O)NH2, v=0
  273474.9266  0.0203 -4.9274 3 1248.8497189  71510 303942570      942471        syn-C2H3C(O)NH2, v=0
  273491.1432  0.0028 -4.5107 3  600.1747131  71510 303651848      641945        syn-C2H3C(O)NH2, v=0
  273536.4930  0.0200 -3.7460 3  302.4537103 -71510 30351 447      51 348        syn-C2H3C(O)NH2, v=0
  273536.4930  0.0200 -3.7460 3  302.4537103 -71510 30351 547      51 448        syn-C2H3C(O)NH2, v=0
  273588.0629  0.0036 -4.0459 3  725.0075147  71510 303731658      731559        syn-C2H3C(O)NH2, v=0
  273641.5546  0.0014 -3.7261 3  461.8928121  71510 30360 951      60 852        syn-C2H3C(O)NH2, v=0
  273642.0744  0.0014 -3.7261 3  461.8928121  71510 303601051      60 952        syn-C2H3C(O)NH2, v=0
  273726.5172  0.0200 -3.4736 3  230.4415 69 -71510 303342014      341915        syn-C2H3C(O)NH2, v=0
  273726.5172  0.0200 -3.4736 3  230.4415 69 -71510 303342015      341916        syn-C2H3C(O)NH2, v=0
  273743.9623  0.0200 -3.7583 3  499.7445125 -71510 303621052      62 953        syn-C2H3C(O)NH2, v=0
  273746.0262  0.0200 -3.7583 3  499.7446125 -71510 303621152      621053        syn-C2H3C(O)NH2, v=0
  273809.5202  0.0074 -4.4213 3  969.0387165  71510 303822459      822360        syn-C2H3C(O)NH2, v=0
  273812.3782  0.0098 -6.4215 3  701.6596153  71510 30376 868      77 771        syn-C2H3C(O)NH2, v=0
  273812.3782  0.0098 -6.4215 3  701.6596153  71510 30376 968      77 671        syn-C2H3C(O)NH2, v=0
  273819.2344  0.0605 -4.8670 3 1205.9292187  71510 303932271      932172        syn-C2H3C(O)NH2, v=0
  273825.0575  0.0200 -3.6502 3  486.8343113 -71510 303562135      562036        syn-C2H3C(O)NH2, v=0
  273827.3041  0.0200 -3.6502 3  486.8342113 -71510 303562136      562037        syn-C2H3C(O)NH2, v=0
  273857.8316  0.0200 -3.2993 3  180.1997 75 -71510 30337 830      36 729        syn-C2H3C(O)NH2, v=0
  273973.6388  0.0009 -5.3121 3  223.4925 75  71510 303371622      361621        syn-C2H3C(O)NH2, v=0
  273973.6651  0.0009 -5.3121 3  223.4925 75  71510 303371621      361620        syn-C2H3C(O)NH2, v=0
  274008.8045  0.0200 -3.4822 3  222.1079 67 -71510 303332013      331914        syn-C2H3C(O)NH2, v=0
  274008.8045  0.0200 -3.4822 3  222.1079 67 -71510 303332014      331915        syn-C2H3C(O)NH2, v=0
  274027.2923  0.0059 -6.3306 3  463.9577127  71510 30363 558      64 461        syn-C2H3C(O)NH2, v=0
  274027.2923  0.0059 -6.3306 3  463.9577127  71510 30363 658      64 361        syn-C2H3C(O)NH2, v=0
  274031.4855  0.0009 -5.1949 3  184.3820 73  71510 303361125      351124        syn-C2H3C(O)NH2, v=0
  274035.5530  0.0031 -4.5131 3  576.7929129  71510 303641748      631845        syn-C2H3C(O)NH2, v=0
  274048.9219  0.0185 -4.5952 3 1064.4396173  71510 303862561      862462        syn-C2H3C(O)NH2, v=0
  274050.3096  0.0044 -4.6430 3  683.6599139  71510 303692050      682147        syn-C2H3C(O)NH2, v=0
  274182.3671  0.0035 -4.3749 3  529.3255123  71510 303611744      601843        syn-C2H3C(O)NH2, v=0
  274184.8263  0.0079 -4.2190 3  836.7643157  71510 303781861      781762        syn-C2H3C(O)NH2, v=0
  274185.0117  0.0013 -4.7806 3   32.7949 33  71510 30316 611      15 312        syn-C2H3C(O)NH2, v=0
  274220.9063  0.0066 -5.2032 3   81.7099 51  71510 30325 619      25 322        syn-C2H3C(O)NH2, v=0
  274266.8801  0.0200 -3.4933 3  214.0244 65 -71510 303322012      321913        syn-C2H3C(O)NH2, v=0
  274266.8801  0.0200 -3.4933 3  214.0244 65 -71510 303322013      321914        syn-C2H3C(O)NH2, v=0
  274292.4002  0.0024 -5.7028 3   19.1641 27  71510 30313 5 8      12 211        syn-C2H3C(O)NH2, v=0
  274424.5996  0.1533 -5.3817 3 1484.3394207  71510 303A32578      A32479        syn-C2H3C(O)NH2, v=0
  274502.3416  0.0200 -3.5072 3  206.1905 63 -71510 303312011      311912        syn-C2H3C(O)NH2, v=0
  274502.3416  0.0200 -3.5072 3  206.1905 63 -71510 303312012      311913        syn-C2H3C(O)NH2, v=0
  274532.7880  0.0286 -4.8677 3 1215.7255187  71510 303932470      932371        syn-C2H3C(O)NH2, v=0
  274574.0369  0.0028 -6.1565 3  356.1770 97  71510 303481831      491534        syn-C2H3C(O)NH2, v=0
  274575.3932  0.0133 -4.3341 3  905.4148163  71510 303811863      811764        syn-C2H3C(O)NH2, v=0
  274643.8730  0.0031 -4.7202 3  121.6633 59  71510 303291019      29 722        syn-C2H3C(O)NH2, v=0
  274663.3215  0.0346 -4.8180 3 1187.3383183  71510 303912665      912566        syn-C2H3C(O)NH2, v=0
  274669.5343  0.0035 -4.5691 3  641.1757135  71510 303671949      662046        syn-C2H3C(O)NH2, v=0
  274716.6275  0.0200 -3.5245 3  198.6057 61 -71510 303302010      301911        syn-C2H3C(O)NH2, v=0
  274716.6275  0.0200 -3.5245 3  198.6057 61 -71510 303302011      301912        syn-C2H3C(O)NH2, v=0
  274735.2377  0.0009 -5.2830 3  216.3779 75  71510 303371523      361522        syn-C2H3C(O)NH2, v=0
  274735.6740  0.0009 -5.2830 3  216.3780 75  71510 303371522      361521        syn-C2H3C(O)NH2, v=0
  274737.6663  0.2611 -6.0586 3 1844.4267229  71510 303B43183      B43084        syn-C2H3C(O)NH2, v=0
  274751.5848  0.0200 -3.4184 3  193.9311 77 -71510 30338 830      37 929        syn-C2H3C(O)NH2, v=0
  274760.6552  0.0200 -4.1307 3  800.8299149 -71510 303742351      742252        syn-C2H3C(O)NH2, v=0
  274763.6302  0.0035 -3.8974 3   62.8329 45  71510 30322 616      21 517        syn-C2H3C(O)NH2, v=0
  274856.6719  0.0031 -3.9358 3  252.0078 97  71510 30348 246      48 147        syn-C2H3C(O)NH2, v=0
  274856.6719  0.0031 -3.9358 3  252.0078 97  71510 30348 346      48 247        syn-C2H3C(O)NH2, v=0
  274911.0794  0.0200 -3.5456 3  191.2698 59 -71510 3032920 9      291910        syn-C2H3C(O)NH2, v=0
  274911.0794  0.0200 -3.5456 3  191.2698 59 -71510 303292010      291911        syn-C2H3C(O)NH2, v=0
  274929.9679  0.0059 -4.7183 3  727.6059143  71510 303712150      702249        syn-C2H3C(O)NH2, v=0
  274952.1448  0.0029 -4.7123 3   32.0983 35  71510 30317 414      16 115        syn-C2H3C(O)NH2, v=0
  274965.1721  0.0118 -4.7081 3 1131.4154179  71510 303892565      892466        syn-C2H3C(O)NH2, v=0
  275064.3779  0.0200 -3.6297 3  472.8826111 -71510 303552134      552035        syn-C2H3C(O)NH2, v=0
  275065.5002  0.0200 -3.6297 3  472.8825111 -71510 303552135      552036        syn-C2H3C(O)NH2, v=0
  275078.3514  0.0015 -3.8840 3  649.6642133  71510 303662244      662145        syn-C2H3C(O)NH2, v=0
  275087.2580  0.0200 -3.5713 3  184.1822 57 -71510 3032820 8      2819 9        syn-C2H3C(O)NH2, v=0
  275087.2580  0.0200 -3.5713 3  184.1822 57 -71510 3032820 9      281910        syn-C2H3C(O)NH2, v=0
  275149.3112  0.0517 -5.9984 3 1391.3562193  71510 303963364      953461        syn-C2H3C(O)NH2, v=0
  275149.3367  0.0517 -5.9984 3 1391.3562193  71510 303963363      953462        syn-C2H3C(O)NH2, v=0
  275153.7709  0.0451 -5.8760 3 1329.6327189  71510 303943263      933360        syn-C2H3C(O)NH2, v=0
  275153.8456  0.0451 -5.8760 3 1329.6327189  71510 303943262      933361        syn-C2H3C(O)NH2, v=0
  275201.0646  0.0015 -3.8836 3  649.6596133  71510 303662245      662146        syn-C2H3C(O)NH2, v=0
  275213.3152  0.0590 -6.1237 3 1454.5087197  71510 303983465      973562        syn-C2H3C(O)NH2, v=0
  275213.3238  0.0590 -6.1237 3 1454.5087197  71510 303983464      973563        syn-C2H3C(O)NH2, v=0
  275236.2554  0.0391 -5.7564 3 1269.3397185  71510 303923162      913259        syn-C2H3C(O)NH2, v=0
  275236.4718  0.0391 -5.7564 3 1269.3397185  71510 303923161      913260        syn-C2H3C(O)NH2, v=0
  275246.1524  0.0200 -3.6026 3  177.3426 55 -71510 3032720 7      2719 8        syn-C2H3C(O)NH2, v=0
  275246.1524  0.0200 -3.6026 3  177.3426 55 -71510 3032720 8      2719 9        syn-C2H3C(O)NH2, v=0
  275337.8171  0.0670 -6.2519 3 1519.0885201  71510 303A03566      993663        syn-C2H3C(O)NH2, v=0
  275337.8200  0.0670 -6.2519 3 1519.0885201  71510 303A03565      993664        syn-C2H3C(O)NH2, v=0
  275389.1972  0.0200 -3.6409 3  170.7505 53 -71510 3032620 6      2619 7        syn-C2H3C(O)NH2, v=0
  275389.1972  0.0200 -3.6409 3  170.7505 53 -71510 3032620 7      2619 8        syn-C2H3C(O)NH2, v=0
  275408.3285  0.0338 -5.6398 3 1210.4788181  71510 303903061      893158        syn-C2H3C(O)NH2, v=0
  275408.9480  0.0338 -5.6398 3 1210.4788181  71510 303903060      893159        syn-C2H3C(O)NH2, v=0
  275426.9515  0.0021 -5.1695 3   68.1826 45  71510 30322 815      22 518        syn-C2H3C(O)NH2, v=0
  275473.3652  0.0200 -3.7106 3  334.6122107 -71510 30353 548      53 449        syn-C2H3C(O)NH2, v=0
  275473.3652  0.0200 -3.7106 3  334.6122107 -71510 30353 648      53 549        syn-C2H3C(O)NH2, v=0
  275474.0881  0.0768 -5.8016 3 1050.8503175  71510 303872167      862264        syn-C2H3C(O)NH2, v=0
  275486.3277  0.0065 -6.4009 3  399.3637119  71510 30359 455      60 358        syn-C2H3C(O)NH2, v=0
  275486.3277  0.0065 -6.4009 3  399.3637119  71510 30359 555      60 258        syn-C2H3C(O)NH2, v=0
  275489.7189  0.1368 -5.5321 3 1569.6601211  71510 303A52976      A52877        syn-C2H3C(O)NH2, v=0
  275516.1287  0.0759 -6.3831 3 1585.0941205  71510 303A23667      A13764        syn-C2H3C(O)NH2, v=0
  275516.1297  0.0759 -6.3831 3 1585.0941205  71510 303A23666      A13765        syn-C2H3C(O)NH2, v=0
  275517.4190  0.0200 -3.6882 3  164.4057 51 -71510 3032520 5      2519 6        syn-C2H3C(O)NH2, v=0
  275517.4190  0.0200 -3.6882 3  164.4057 51 -71510 3032520 6      2519 7        syn-C2H3C(O)NH2, v=0
  275632.0248  0.0200 -3.7478 3  158.3077 49 -71510 3032420 4      2419 5        syn-C2H3C(O)NH2, v=0
  275632.0248  0.0200 -3.7478 3  158.3077 49 -71510 3032420 5      2419 6        syn-C2H3C(O)NH2, v=0
  275654.3647  0.0032 -3.9361 3  308.2071 95  71510 303471235      461334        syn-C2H3C(O)NH2, v=0
  275656.5016  0.0009 -5.1075 3  204.0144 89  71510 30344 143      43 142        syn-C2H3C(O)NH2, v=0
  275656.5387  0.0200 -2.9332 3  204.0144 89 -71510 30344 143      43 242        syn-C2H3C(O)NH2, v=0
  275656.5387  0.0200 -2.9332 3  204.0144 89 -71510 30344 243      43 142        syn-C2H3C(O)NH2, v=0
  275656.5016  0.0009 -5.1075 3  204.0144 89  71510 30344 243      43 242        syn-C2H3C(O)NH2, v=0
  275659.3126  0.0008 -5.1191 3  202.9783 87  71510 30343 241      42 240        syn-C2H3C(O)NH2, v=0
  275659.3444  0.0200 -2.9719 3  202.9783 87 -71510 30343 241      42 340        syn-C2H3C(O)NH2, v=0
  275659.3444  0.0200 -2.9719 3  202.9783 87 -71510 30343 341      42 240        syn-C2H3C(O)NH2, v=0
  275659.3126  0.0008 -5.1191 3  202.9783 87  71510 30343 341      42 340        syn-C2H3C(O)NH2, v=0
  275664.9123  0.0011 -5.0950 3  204.5369 91  71510 30345 045      44 044        syn-C2H3C(O)NH2, v=0
  275664.9315  0.0200 -2.8972 3  204.5369 91 -71510 30345 045      44 144        syn-C2H3C(O)NH2, v=0
  275664.9315  0.0200 -2.8972 3  204.5369 91 -71510 30345 145      44 044        syn-C2H3C(O)NH2, v=0
  275664.9123  0.0011 -5.0950 3  204.5369 91  71510 30345 145      44 144        syn-C2H3C(O)NH2, v=0
  275667.7268  0.0026 -6.2638 3  198.2767 71  71510 303351521      361224        syn-C2H3C(O)NH2, v=0
  275684.0652  0.0290 -5.5261 3 1153.0515177  71510 303882960      873057        syn-C2H3C(O)NH2, v=0
  275685.8155  0.0290 -5.5261 3 1153.0515177  71510 303882959      873058        syn-C2H3C(O)NH2, v=0
  275688.7365  0.0200 -3.0144 3  201.4147 85 -71510 30342 339      41 438        syn-C2H3C(O)NH2, v=0
  275688.7167  0.0008 -5.1298 3  201.4147 85  71510 30342 439      41 438        syn-C2H3C(O)NH2, v=0
  275688.7178  0.0008 -5.1298 3  201.4147 85  71510 30342 339      41 338        syn-C2H3C(O)NH2, v=0
  275688.7365  0.0200 -3.0144 3  201.4147 85 -71510 30342 439      41 338        syn-C2H3C(O)NH2, v=0
  275697.6931  0.0009 -5.2553 3  209.7861 75  71510 303371424      361423        syn-C2H3C(O)NH2, v=0
  275703.6499  0.0009 -5.2553 3  209.7863 75  71510 303371423      361422        syn-C2H3C(O)NH2, v=0
  275733.9639  0.0200 -3.8252 3  152.4562 47 -71510 3032320 3      2319 4        syn-C2H3C(O)NH2, v=0
  275733.9639  0.0200 -3.8252 3  152.4562 47 -71510 3032320 4      2319 5        syn-C2H3C(O)NH2, v=0
  275742.5927  0.0857 -6.5172 3 1652.5242209  71510 303A43768      A33865        syn-C2H3C(O)NH2, v=0
  275742.5931  0.0857 -6.5172 3 1652.5242209  71510 303A43767      A33866        syn-C2H3C(O)NH2, v=0
  275750.4439  0.0200 -3.2814 3  189.3346 77 -71510 30338 731      37 830        syn-C2H3C(O)NH2, v=0
  275771.6531  0.0200 -3.0621 3  199.3043 83 -71510 30341 437      40 536        syn-C2H3C(O)NH2, v=0
  275771.6252  0.0008 -5.1393 3  199.3043 83  71510 30341 537      40 536        syn-C2H3C(O)NH2, v=0
  275771.6803  0.0008 -5.1393 3  199.3043 83  71510 30341 437      40 436        syn-C2H3C(O)NH2, v=0
  275771.6531  0.0200 -3.0621 3  199.3043 83 -71510 30341 537      40 436        syn-C2H3C(O)NH2, v=0
  275824.3043  0.0014 -3.9305 3  146.8510 45  71510 3032220 2      2219 3        syn-C2H3C(O)NH2, v=0
  275824.3043  0.0014 -3.9305 3  146.8510 45  71510 3032220 3      2219 4        syn-C2H3C(O)NH2, v=0
  275876.3888  0.0009 -5.1518 3  168.3537 71  71510 30335 926      34 925        syn-C2H3C(O)NH2, v=0
  275901.5140  0.0424 -4.7187 3 1126.9398181  71510 303902169      902070        syn-C2H3C(O)NH2, v=0
  275903.9630  0.0200 -4.0869 3  141.4917 43 -71510 3032120 1      2119 2        syn-C2H3C(O)NH2, v=0
  275903.9630  0.0200 -4.0869 3  141.4917 43 -71510 3032120 2      2119 3        syn-C2H3C(O)NH2, v=0
  275934.4547  0.0200 -3.9775 3  680.4863143 -71510 303711457      711358        syn-C2H3C(O)NH2, v=0
  275955.4324  0.0200 -3.1175 3  196.6190 81 -71510 30340 535      39 634        syn-C2H3C(O)NH2, v=0
  275957.6980  0.0008 -5.1474 3  196.6190 81  71510 30340 635      39 634        syn-C2H3C(O)NH2, v=0
  275959.6916  0.0008 -5.1474 3  196.6188 81  71510 30340 535      39 534        syn-C2H3C(O)NH2, v=0
  275961.9701  0.0200 -3.1174 3  196.6188 81 -71510 30340 635      39 534        syn-C2H3C(O)NH2, v=0
  275973.9394  0.0015 -4.3681 3  136.3779 41  71510 3032020 0      2019 1        syn-C2H3C(O)NH2, v=0
  275973.9394  0.0015 -4.3681 3  136.3779 41  71510 3032020 1      2019 2        syn-C2H3C(O)NH2, v=0
  275976.4488  0.0033 -4.1269 3  800.7827149  71510 303742352      742253        syn-C2H3C(O)NH2, v=0
  276006.0195  0.0286 -4.7653 3 1159.5540183  71510 303912369      912270        syn-C2H3C(O)NH2, v=0
  276042.5087  0.0092 -6.5466 3  423.7938111  71510 303551441      561146        syn-C2H3C(O)NH2, v=0
  276051.4448  0.0032 -5.2375 3   71.9980 45  71510 30322 913      22 616        syn-C2H3C(O)NH2, v=0
  276054.7299  0.0257 -4.9665 3 1273.0387191  71510 303952571      952472        syn-C2H3C(O)NH2, v=0
  276075.8131  0.0199 -4.4527 3  976.6723169  71510 303841965      841866        syn-C2H3C(O)NH2, v=0
  276080.6409  0.0248 -5.4152 3 1097.0597173  71510 303862859      852956        syn-C2H3C(O)NH2, v=0
  276085.5164  0.0248 -5.4152 3 1097.0597173  71510 303862858      852957        syn-C2H3C(O)NH2, v=0
  276086.2205  0.0025 -3.9771 3  680.4869143  71510 303711557      711458        syn-C2H3C(O)NH2, v=0
  276221.1094  0.0010 -3.6102 3  459.1948109  71510 303542133      542034        syn-C2H3C(O)NH2, v=0
  276221.6599  0.0010 -3.6102 3  459.1948109  71510 303542134      542035        syn-C2H3C(O)NH2, v=0
  276225.3171  0.0070 -6.3631 3  622.5336145  71510 30372 765      73 668        syn-C2H3C(O)NH2, v=0
  276225.3171  0.0070 -6.3631 3  622.5336145  71510 30372 865      73 568        syn-C2H3C(O)NH2, v=0
  276270.5583  0.0200 -3.1855 3  193.3148 79 -71510 30339 633      38 732        syn-C2H3C(O)NH2, v=0
  276332.6066  0.0008 -5.1537 3  193.3148 79  71510 30339 733      38 732        syn-C2H3C(O)NH2, v=0
  276350.2709  0.0026 -6.2618 3  198.2539 71  71510 303351520      361225        syn-C2H3C(O)NH2, v=0
  276380.8210  0.0008 -5.1535 3  193.3111 79  71510 30339 633      38 632        syn-C2H3C(O)NH2, v=0
  276406.8139  0.0200 -4.5362 3 1028.8787173  71510 303862166      862067        syn-C2H3C(O)NH2, v=0
  276442.8407  0.0200 -3.1849 3  193.3111 79 -71510 30339 733      38 632        syn-C2H3C(O)NH2, v=0
  276478.4045  0.0008 -5.1640 3  184.7088 75  71510 30337 929      36 928        syn-C2H3C(O)NH2, v=0
  276481.9089  0.0078 -4.3450 3  927.7257161  71510 303802456      802357        syn-C2H3C(O)NH2, v=0
  276574.2131  0.0074 -6.5606 3  339.2922111  71510 30355 352      56 255        syn-C2H3C(O)NH2, v=0
  276574.2131  0.0074 -6.5606 3  339.2922111  71510 30355 452      56 155        syn-C2H3C(O)NH2, v=0
  276584.3613  0.0293 -4.5807 3 1050.5172175  71510 303872067      871968        syn-C2H3C(O)NH2, v=0
  276584.4096  0.2572 -5.7744 3 1694.9230221  71510 303B02783      B02684        syn-C2H3C(O)NH2, v=0
  276618.8786  0.0210 -5.3072 3 1042.5052169  71510 303842758      832855        syn-C2H3C(O)NH2, v=0
  276632.2484  0.0210 -5.3072 3 1042.5051169  71510 303842757      832856        syn-C2H3C(O)NH2, v=0
  276785.0422  0.0049 -4.6356 3  610.0045133  71510 303661750      651847        syn-C2H3C(O)NH2, v=0
  276839.4334  0.0027 -6.1500 3  356.1014 97  71510 303481830      491535        syn-C2H3C(O)NH2, v=0
  276880.4160  0.0008 -5.1579 3  189.3346 77  71510 30338 831      37 830        syn-C2H3C(O)NH2, v=0
  276909.4357  0.0068 -4.3774 3  948.1710163  71510 303812458      812359        syn-C2H3C(O)NH2, v=0
  276913.4373  0.4007 -6.2023 3 1919.1673235  71510 303B72988      B72889        syn-C2H3C(O)NH2, v=0
  276938.4136  0.0009 -5.2290 3  203.7362 75  71510 303371325      361324        syn-C2H3C(O)NH2, v=0
  276947.3580  0.0038 -4.5635 3  593.2290131  71510 303651749      641846        syn-C2H3C(O)NH2, v=0
  276954.2206  0.0010 -5.1508 3  174.8782 73  71510 30336 828      35 827        syn-C2H3C(O)NH2, v=0
  276957.4297  0.0050 -6.4715 3   36.3637 37  71510 30318 415      18 118        syn-C2H3C(O)NH2, v=0
  276965.6906  0.0025 -6.5131 3  460.0552 77  71510 3033835 3      3735 2        syn-C2H3C(O)NH2, v=0
  276965.6906  0.0025 -6.5131 3  460.0552 77  71510 3033835 4      3735 3        syn-C2H3C(O)NH2, v=0
  277003.9389  0.0009 -5.2288 3  203.7384 75  71510 303371324      361323        syn-C2H3C(O)NH2, v=0
  277016.1838  0.0032 -6.1799 3  414.6256105  71510 303521934      531637        syn-C2H3C(O)NH2, v=0
  277043.2291  0.0059 -4.1396 3  789.2746153  71510 303761660      761561        syn-C2H3C(O)NH2, v=0
  277056.1255  0.0023 -6.3600 3  443.7990 77  71510 3033834 4      3734 3        syn-C2H3C(O)NH2, v=0
  277056.1255  0.0023 -6.3600 3  443.7990 77  71510 3033834 5      3734 4        syn-C2H3C(O)NH2, v=0
  277105.3820  0.0200 -3.6964 3  368.0490111 -71510 30355 649      55 550        syn-C2H3C(O)NH2, v=0
  277105.3820  0.0200 -3.6964 3  368.0490111 -71510 30355 749      55 650        syn-C2H3C(O)NH2, v=0
  277127.8288  0.1740 -6.2905 3 1278.4331193  71510 303962374      952471        syn-C2H3C(O)NH2, v=0
  277142.0338  0.0200 -3.8537 3  633.0815131 -71510 303652243      652144        syn-C2H3C(O)NH2, v=0
  277152.0264  0.0021 -6.2360 3  428.0150 77  71510 3033833 5      3733 4        syn-C2H3C(O)NH2, v=0
  277152.0264  0.0021 -6.2360 3  428.0150 77  71510 3033833 6      3733 5        syn-C2H3C(O)NH2, v=0
  277210.8018  0.0200 -3.8535 3  633.0789131 -71510 303652244      652145        syn-C2H3C(O)NH2, v=0
  277254.1850  0.0020 -6.1308 3  412.7035 77  71510 3033832 6      3732 5        syn-C2H3C(O)NH2, v=0
  277254.1850  0.0020 -6.1308 3  412.7035 77  71510 3033832 7      3732 6        syn-C2H3C(O)NH2, v=0
  277301.1798  0.0010 -3.5918 3  445.7698107  71510 303532132      532033        syn-C2H3C(O)NH2, v=0
  277301.4447  0.0010 -3.5918 3  445.7698107  71510 303532133      532034        syn-C2H3C(O)NH2, v=0
  277304.4823  0.0161 -6.5312 3  803.3443163  71510 30381 972      82 875        syn-C2H3C(O)NH2, v=0
  277304.4823  0.0161 -6.5312 3  803.3443163  71510 303811072      82 775        syn-C2H3C(O)NH2, v=0
  277323.3623  0.0177 -5.2020 3  989.3898165  71510 303822657      812754        syn-C2H3C(O)NH2, v=0
  277359.3960  0.0177 -5.2019 3  989.3898165  71510 303822656      812755        syn-C2H3C(O)NH2, v=0
  277363.5252  0.0018 -6.0389 3  397.8650 77  71510 3033831 7      3731 6        syn-C2H3C(O)NH2, v=0
  277363.5252  0.0018 -6.0389 3  397.8650 77  71510 3033831 8      3731 7        syn-C2H3C(O)NH2, v=0
  277372.3157  0.0200 -3.8159 3  282.1898101 -71510 30350 347      50 248        syn-C2H3C(O)NH2, v=0
  277372.3157  0.0200 -3.8159 3  282.1898101 -71510 30350 447      50 348        syn-C2H3C(O)NH2, v=0
  277410.4564  0.0116 -4.6612 3 1108.6912177  71510 303882564      882465        syn-C2H3C(O)NH2, v=0
  277481.1309  0.0017 -5.9569 3  383.4999 77  71510 3033830 8      3730 7        syn-C2H3C(O)NH2, v=0
  277481.1309  0.0017 -5.9569 3  383.4999 77  71510 3033830 9      3730 8        syn-C2H3C(O)NH2, v=0
  277608.2812  0.0016 -5.8829 3  369.6087 77  71510 3033829 9      3729 8        syn-C2H3C(O)NH2, v=0
  277608.2812  0.0016 -5.8829 3  369.6087 77  71510 303382910      3729 9        syn-C2H3C(O)NH2, v=0
  277616.9421  0.0009 -5.1554 3  189.2723 77  71510 30338 731      37 730        syn-C2H3C(O)NH2, v=0
  277641.8831  0.0049 -4.5683 3  150.1758 67  71510 30333 924      33 627        syn-C2H3C(O)NH2, v=0
  277657.4836  0.0115 -4.3249 3  905.4333163  71510 303811963      811864        syn-C2H3C(O)NH2, v=0
  277746.4944  0.0015 -5.8153 3  356.1918 77  71510 303382810      3728 9        syn-C2H3C(O)NH2, v=0
  277746.4944  0.0015 -5.8153 3  356.1918 77  71510 303382811      372810        syn-C2H3C(O)NH2, v=0
  277785.0309  0.0056 -4.1373 3  789.2782153  71510 303761760      761661        syn-C2H3C(O)NH2, v=0
  277890.9987  0.0200 -3.9148 3  637.1543139 -71510 303691356      691257        syn-C2H3C(O)NH2, v=0
  277897.5857  0.0014 -5.7531 3  343.2501 77  71510 303382711      372710        syn-C2H3C(O)NH2, v=0
  277897.5857  0.0014 -5.7531 3  343.2501 77  71510 303382712      372711        syn-C2H3C(O)NH2, v=0
  277940.5177  0.0200 -3.9147 3  637.1544139 -71510 303691456      691357        syn-C2H3C(O)NH2, v=0
  277959.4295  0.0030 -4.0917 3  782.0981147  71510 303732350      732251        syn-C2H3C(O)NH2, v=0
  278063.7403  0.0014 -5.6956 3  330.7842 77  71510 303382612      372611        syn-C2H3C(O)NH2, v=0
  278063.7403  0.0014 -5.6956 3  330.7842 77  71510 303382613      372612        syn-C2H3C(O)NH2, v=0
  278124.7671  0.0037 -4.1851 3  232.7281 95  71510 30347 146      47 047        syn-C2H3C(O)NH2, v=0
  278124.7671  0.0037 -4.1851 3  232.7281 95  71510 30347 246      47 147        syn-C2H3C(O)NH2, v=0
  278221.0691  0.0148 -5.0997 3  937.7159161  71510 303802556      792653        syn-C2H3C(O)NH2, v=0
  278247.6116  0.0013 -5.6421 3  318.7950 77  71510 303382513      372512        syn-C2H3C(O)NH2, v=0
  278247.6116  0.0013 -5.6421 3  318.7950 77  71510 303382514      372513        syn-C2H3C(O)NH2, v=0
  278309.8960  0.0200 -3.5745 3  432.6067105 -71510 303522131      522032        syn-C2H3C(O)NH2, v=0
  278309.8960  0.0200 -3.5745 3  432.6067105 -71510 303522132      522033        syn-C2H3C(O)NH2, v=0
  278316.3279  0.0148 -5.0994 3  937.7157161  71510 303802555      792654        syn-C2H3C(O)NH2, v=0
  278331.2340  0.0060 -6.3359 3  547.9089137  71510 30368 662      69 565        syn-C2H3C(O)NH2, v=0
  278331.2340  0.0060 -6.3359 3  547.9089137  71510 30368 762      69 465        syn-C2H3C(O)NH2, v=0
  278414.6068  0.0200 -3.6978 3  402.7557115 -71510 30357 750      57 651        syn-C2H3C(O)NH2, v=0
  278414.6068  0.0200 -3.6978 3  402.7557115 -71510 30357 850      57 751        syn-C2H3C(O)NH2, v=0
  278452.4495  0.0012 -5.5922 3  307.2835 77  71510 303382414      372413        syn-C2H3C(O)NH2, v=0
  278452.4495  0.0012 -5.5922 3  307.2835 77  71510 303382415      372414        syn-C2H3C(O)NH2, v=0
  278475.3587  0.0009 -5.2039 3  198.2539 75  71510 303371226      361225        syn-C2H3C(O)NH2, v=0
  278682.2766  0.0012 -5.5457 3  296.2510 77  71510 303382315      372314        syn-C2H3C(O)NH2, v=0
  278682.2766  0.0012 -5.5457 3  296.2510 77  71510 303382316      372315        syn-C2H3C(O)NH2, v=0
  278692.9047  0.0029 -4.0894 3  782.0699147  71510 303732351      732252        syn-C2H3C(O)NH2, v=0
  278746.9288  0.0200 -3.2714 3  189.2723 77 -71510 30338 831      37 730        syn-C2H3C(O)NH2, v=0
  278765.7956  0.0043 -6.4595 3  217.6297 79  71510 303391228      40 733        syn-C2H3C(O)NH2, v=0
  278889.4732  0.0200 -3.3292 3   71.9015 45 -71510 30322 914      21 813        syn-C2H3C(O)NH2, v=0
  278919.5078  0.0036 -6.2232 3  477.5304113  71510 303562037      571740        syn-C2H3C(O)NH2, v=0
  278942.1282  0.0011 -5.5020 3  285.6990 77  71510 303382216      372215        syn-C2H3C(O)NH2, v=0
  278942.1282  0.0011 -5.5020 3  285.6990 77  71510 303382217      372216        syn-C2H3C(O)NH2, v=0
  279032.1343  0.0009 -5.2022 3  198.2767 75  71510 303371225      361224        syn-C2H3C(O)NH2, v=0
  279052.1155  0.0200 -3.8247 3  616.7724129 -71510 303642242      642143        syn-C2H3C(O)NH2, v=0
  279090.0445  0.0200 -3.8246 3  616.7710129 -71510 303642243      642144        syn-C2H3C(O)NH2, v=0
  279181.1826  0.0200 -3.1246 3   56.1736 29 -71510 3031413 1      1312 2        syn-C2H3C(O)NH2, v=0
  279181.1826  0.0200 -3.1246 3   56.1736 29 -71510 3031413 2      1312 1        syn-C2H3C(O)NH2, v=0
  279186.5833  0.0017 -3.8591 3  595.0225135  71510 303671255      671156        syn-C2H3C(O)NH2, v=0
  279186.6573  0.0050 -4.6257 3  683.6457139  71510 303692049      682148        syn-C2H3C(O)NH2, v=0
  279201.7104  0.0017 -3.8590 3  595.0226135  71510 303671355      671256        syn-C2H3C(O)NH2, v=0
  279238.3922  0.0011 -5.4611 3  275.6295 77  71510 303382117      372116        syn-C2H3C(O)NH2, v=0
  279238.3922  0.0011 -5.4611 3  275.6295 77  71510 303382118      372117        syn-C2H3C(O)NH2, v=0
  279251.8758  0.0200 -3.5582 3  419.7046103 -71510 303512130      512031        syn-C2H3C(O)NH2, v=0
  279251.8758  0.0200 -3.5582 3  419.7046103 -71510 303512131      512032        syn-C2H3C(O)NH2, v=0
  279301.3989  0.0200 -3.3282 3   71.8896 45 -71510 30322 913      21 814        syn-C2H3C(O)NH2, v=0
  279336.0416  0.0122 -5.0002 3  887.4859157  71510 303782455      772552        syn-C2H3C(O)NH2, v=0
  279379.6429  0.0014 -3.7116 3  438.7235119  71510 30359 851      59 752        syn-C2H3C(O)NH2, v=0
  279379.7069  0.0014 -3.7116 3  438.7235119  71510 30359 951      59 852        syn-C2H3C(O)NH2, v=0
  279478.5163  0.0260 -4.6616 3 1104.5033179  71510 303892268      892169        syn-C2H3C(O)NH2, v=0
  279579.2974  0.0010 -5.4227 3  266.0447 77  71510 303382018      372017        syn-C2H3C(O)NH2, v=0
  279579.2974  0.0010 -5.4227 3  266.0447 77  71510 303382019      372018        syn-C2H3C(O)NH2, v=0
  279582.4485  0.0123 -4.9995 3  887.4854157  71510 303782454      772553        syn-C2H3C(O)NH2, v=0
  279591.9500  0.0200 -3.1646 3   57.8228 33 -71510 3031612 4      1511 5        syn-C2H3C(O)NH2, v=0
  279591.9500  0.0200 -3.1646 3   57.8228 33 -71510 3031612 5      1511 4        syn-C2H3C(O)NH2, v=0
  279618.1386  0.0200 -3.7504 3  313.6672105 -71510 30352 448      52 349        syn-C2H3C(O)NH2, v=0
  279618.1386  0.0200 -3.7504 3  313.6672105 -71510 30352 548      52 449        syn-C2H3C(O)NH2, v=0
  279663.2419  0.0008 -5.1667 3  188.9318 75  71510 303371028      361027        syn-C2H3C(O)NH2, v=0
  279665.3411  0.0319 -5.0040 3 1297.4416193  71510 303962572      962473        syn-C2H3C(O)NH2, v=0
  279695.9826  0.0030 -6.1721 3  414.5363105  71510 303521933      531638        syn-C2H3C(O)NH2, v=0
  279760.6166  0.0037 -4.4504 3  583.8972129  71510 303641846      631945        syn-C2H3C(O)NH2, v=0
  279862.7452  0.0008 -5.1815 3  193.3497 75  71510 303371127      361126        syn-C2H3C(O)NH2, v=0
  279889.0089  0.0340 -4.8999 3 1239.5136189  71510 303942471      942372        syn-C2H3C(O)NH2, v=0
  279896.6457  0.0023 -3.6790 3  242.6042 85  71510 303421032      411131        syn-C2H3C(O)NH2, v=0
  279905.5584  0.0200 -3.2073 3   60.9606 37 -71510 3031811 8      1710 7        syn-C2H3C(O)NH2, v=0
  279905.5584  0.0200 -3.2073 3   60.9606 37 -71510 3031811 7      1710 8        syn-C2H3C(O)NH2, v=0
  279922.9588  0.0016 -3.8104 3  554.1030131  71510 303651154      651055        syn-C2H3C(O)NH2, v=0
  279924.7171  0.0200 -3.2583 3   65.6254 41 -71510 303201011      19 910        syn-C2H3C(O)NH2, v=0
  279927.2932  0.0200 -3.8103 3  554.1030131 -71510 303651254      651155        syn-C2H3C(O)NH2, v=0
  279929.0666  0.0010 -3.2583 3   65.6252 41  71510 303201010      19 911        syn-C2H3C(O)NH2, v=0
  279957.9604  0.1140 -5.2042 3 1396.8585201  71510 303A02476      A02377        syn-C2H3C(O)NH2, v=0
  279974.8463  0.0015 -3.7358 3  475.9436123  71510 30361 952      61 853        syn-C2H3C(O)NH2, v=0
  279975.1294  0.0015 -3.7358 3  475.9436123  71510 303611052      61 953        syn-C2H3C(O)NH2, v=0
  279975.6395  0.0010 -5.3866 3  256.9479 77  71510 303381919      371918        syn-C2H3C(O)NH2, v=0
  279975.6395  0.0010 -5.3866 3  256.9479 77  71510 303381920      371919        syn-C2H3C(O)NH2, v=0
  279976.2938  0.0109 -6.4453 3  718.7171155  71510 30377 869      78 772        syn-C2H3C(O)NH2, v=0
  279976.2938  0.0109 -6.4453 3  718.7171155  71510 30377 969      78 672        syn-C2H3C(O)NH2, v=0
  280030.6042  0.0062 -4.3342 3  927.5850161  71510 303802457      802358        syn-C2H3C(O)NH2, v=0
  280087.6343  0.0035 -4.0176 3  350.1829101  71510 303501337      491436        syn-C2H3C(O)NH2, v=0
  280112.7197  0.0062 -6.3487 3  477.7922129  71510 30364 559      65 462        syn-C2H3C(O)NH2, v=0
  280112.7197  0.0062 -6.3487 3  477.7922129  71510 30364 659      65 362        syn-C2H3C(O)NH2, v=0
  280124.1837  0.0013 -4.6104 3   36.8275 35  71510 30317 612      16 313        syn-C2H3C(O)NH2, v=0
  280131.5503  0.0200 -3.5429 3  407.0624101 -71510 303502129      502030        syn-C2H3C(O)NH2, v=0
  280131.5503  0.0200 -3.5429 3  407.0624101 -71510 303502130      502031        syn-C2H3C(O)NH2, v=0
  280168.9318  0.0200 -3.7691 3  514.4066127 -71510 303631053      63 954        syn-C2H3C(O)NH2, v=0
  280170.1249  0.0200 -3.7691 3  514.4066127 -71510 303631153      631054        syn-C2H3C(O)NH2, v=0
  280240.2273  0.0112 -4.6141 3 1086.2383175  71510 303872563      872464        syn-C2H3C(O)NH2, v=0
  280315.7399  0.0040 -6.2850 3  544.8893121  71510 303602140      611843        syn-C2H3C(O)NH2, v=0
  280355.7791  0.0848 -5.2508 3 1427.5332201  71510 303A02872      A02773        syn-C2H3C(O)NH2, v=0
  280414.7087  0.0147 -4.5390 3 1042.4109171  71510 303852560      852461        syn-C2H3C(O)NH2, v=0
  280414.9228  0.0010 -5.1576 3  180.4309 73  71510 303361026      351025        syn-C2H3C(O)NH2, v=0
  280435.2535  0.0091 -4.2407 3  856.1574159  71510 303791762      791663        syn-C2H3C(O)NH2, v=0
  280441.8974  0.0010 -5.3527 3  248.3428 77  71510 303381821      371820        syn-C2H3C(O)NH2, v=0
  280441.8975  0.0010 -5.3527 3  248.3428 77  71510 303381820      371819        syn-C2H3C(O)NH2, v=0
  280477.3289  0.0040 -4.0625 3  742.9552149  71510 303741559      741460        syn-C2H3C(O)NH2, v=0
  280586.1545  0.0024 -6.1986 3  242.3208 79  71510 303391624      401327        syn-C2H3C(O)NH2, v=0
  280652.9065  0.0178 -5.0155 3 1306.7703193  71510 303962671      962572        syn-C2H3C(O)NH2, v=0
  280674.8036  0.0100 -4.9039 3  838.7026153  71510 303762354      752451        syn-C2H3C(O)NH2, v=0
  280745.0257  0.0039 -4.0617 3  742.9564149  71510 303741659      741560        syn-C2H3C(O)NH2, v=0
  280826.2507  0.0012 -3.7968 3  600.7353127  71510 303632241      632142        syn-C2H3C(O)NH2, v=0
  280832.0068  0.0200 -4.0544 3  763.6537145 -71510 303722349      722250        syn-C2H3C(O)NH2, v=0
  280846.2100  0.0024 -5.1158 3   73.7436 47  71510 30323 816      23 519        syn-C2H3C(O)NH2, v=0
  280846.8325  0.0200 -3.7968 3  600.7346127 -71510 303632242      632143        syn-C2H3C(O)NH2, v=0
  280870.9203  0.0065 -4.2987 3  907.3692159  71510 303792455      792356        syn-C2H3C(O)NH2, v=0
  280886.6502  0.0162 -4.4384 3  976.7033169  71510 303842065      841966        syn-C2H3C(O)NH2, v=0
  280905.4766  0.0032 -3.9383 3  262.2120 99  71510 30349 247      49 148        syn-C2H3C(O)NH2, v=0
  280905.4766  0.0032 -3.9383 3  262.2120 99  71510 30349 347      49 248        syn-C2H3C(O)NH2, v=0
  280919.2128  0.0028 -6.4201 3  150.6817 61  71510 303301417      311120        syn-C2H3C(O)NH2, v=0
  280931.5592  0.0040 -4.4173 3   42.8669 39  71510 30319 415      18 316        syn-C2H3C(O)NH2, v=0
  280939.4760  0.3316 -6.2940 3 1974.5674237  71510 303B83286      B83187        syn-C2H3C(O)NH2, v=0
  280952.8077  0.0200 -3.5288 3  394.6795 99 -71510 303492128      492029        syn-C2H3C(O)NH2, v=0
  280952.8077  0.0200 -3.5288 3  394.6795 99 -71510 303492129      492030        syn-C2H3C(O)NH2, v=0
  280998.0294  0.0009 -5.3207 3  240.2348 77  71510 303381722      371721        syn-C2H3C(O)NH2, v=0
  280998.0328  0.0009 -5.3207 3  240.2348 77  71510 303381721      371720        syn-C2H3C(O)NH2, v=0
  281020.3103  0.0049 -6.5469 3  193.3111 75  71510 303371127      38 632        syn-C2H3C(O)NH2, v=0
  281030.0322  0.0162 -4.9691 3 1282.2469191  71510 303952670      952571        syn-C2H3C(O)NH2, v=0
  281049.7477  0.0016 -5.7825 3   18.2090 25  71510 30312 6 6      11 3 9        syn-C2H3C(O)NH2, v=0
  281188.6357  0.0028 -6.4194 3  150.6727 61  71510 303301416      311121        syn-C2H3C(O)NH2, v=0
  281231.4283  0.0214 -5.0604 3 1331.5329195  71510 303972672      972573        syn-C2H3C(O)NH2, v=0
  281233.1298  0.0049 -6.3638 3  616.6996129  71510 303642243      651946        syn-C2H3C(O)NH2, v=0
  281267.5015  0.0200 -4.0531 3  763.6371145 -71510 303722350      722251        syn-C2H3C(O)NH2, v=0
  281296.5566  0.0102 -4.9019 3  838.7012153  71510 303762353      752452        syn-C2H3C(O)NH2, v=0
  281456.6955  0.0024 -6.1962 3  242.2917 79  71510 303391623      401328        syn-C2H3C(O)NH2, v=0
  281550.1286  0.0069 -6.4173 3  412.1904121  71510 30360 456      61 359        syn-C2H3C(O)NH2, v=0
  281550.1286  0.0069 -6.4173 3  412.1904121  71510 30360 556      61 259        syn-C2H3C(O)NH2, v=0
  281581.9409  0.0200 -3.7163 3  346.4317109 -71510 30354 549      54 450        syn-C2H3C(O)NH2, v=0
  281581.9409  0.0200 -3.7163 3  346.4317109 -71510 30354 649      54 550        syn-C2H3C(O)NH2, v=0
  281632.0536  0.0200 -3.5252 3  217.6307 81 -71510 30340 931      391030        syn-C2H3C(O)NH2, v=0
  281664.7724  0.0086 -4.2370 3  856.1639159  71510 303791862      791763        syn-C2H3C(O)NH2, v=0
  281672.5127  0.0009 -5.2906 3  232.6312 77  71510 303381623      371622        syn-C2H3C(O)NH2, v=0
  281672.5743  0.0009 -5.2906 3  232.6312 77  71510 303381622      371621        syn-C2H3C(O)NH2, v=0
  281696.9961  0.0072 -6.4587 3  692.9584137  71510 303682346      692049        syn-C2H3C(O)NH2, v=0
  281704.8911  0.0200 -3.4478 3   79.8045 49 -71510 30324 816      23 717        syn-C2H3C(O)NH2, v=0
  281709.1098  0.0010 -5.0981 3  213.2093 91  71510 30345 144      44 143        syn-C2H3C(O)NH2, v=0
  281709.1180  0.0200 -2.9230 3  213.2093 91 -71510 30345 144      44 243        syn-C2H3C(O)NH2, v=0
  281709.1180  0.0200 -2.9230 3  213.2093 91 -71510 30345 244      44 143        syn-C2H3C(O)NH2, v=0
  281709.1098  0.0010 -5.0981 3  213.2093 91  71510 30345 244      44 243        syn-C2H3C(O)NH2, v=0
  281710.9861  0.0009 -5.1095 3  212.1733 89  71510 30344 242      43 241        syn-C2H3C(O)NH2, v=0
  281710.9957  0.0200 -2.9606 3  212.1733 89 -71510 30344 242      43 341        syn-C2H3C(O)NH2, v=0
  281710.9957  0.0200 -2.9606 3  212.1733 89 -71510 30344 342      43 241        syn-C2H3C(O)NH2, v=0
  281710.9861  0.0009 -5.1095 3  212.1733 89  71510 30344 342      43 341        syn-C2H3C(O)NH2, v=0
  281717.7451  0.0011 -5.0860 3  213.7320 93  71510 30346 046      45 045        syn-C2H3C(O)NH2, v=0
  281717.7428  0.0200 -2.8879 3  213.7320 93 -71510 30346 046      45 145        syn-C2H3C(O)NH2, v=0
  281717.7428  0.0200 -2.8879 3  213.7320 93 -71510 30346 146      45 045        syn-C2H3C(O)NH2, v=0
  281717.7451  0.0011 -5.0860 3  213.7320 93  71510 30346 146      45 145        syn-C2H3C(O)NH2, v=0
  281719.3327  0.0200 -3.5158 3  382.5550 97 -71510 303482127      482028        syn-C2H3C(O)NH2, v=0
  281719.3327  0.0200 -3.5158 3  382.5550 97 -71510 303482128      482029        syn-C2H3C(O)NH2, v=0
  281737.7183  0.0200 -3.0018 3  210.6106 87 -71510 30343 340      42 439        syn-C2H3C(O)NH2, v=0
  281737.7180  0.0008 -5.1198 3  210.6106 87  71510 30343 440      42 439        syn-C2H3C(O)NH2, v=0
  281737.7185  0.0008 -5.1198 3  210.6106 87  71510 30343 340      42 339        syn-C2H3C(O)NH2, v=0
  281737.7183  0.0200 -3.0018 3  210.6106 87 -71510 30343 440      42 339        syn-C2H3C(O)NH2, v=0
  281812.5591  0.0025 -4.4569 3   38.6991 37  71510 30318 514      17 215        syn-C2H3C(O)NH2, v=0
  281814.0426  0.0200 -3.0477 3  208.5031 85 -71510 30342 438      41 537        syn-C2H3C(O)NH2, v=0
  281814.0303  0.0008 -5.1290 3  208.5031 85  71510 30342 538      41 537        syn-C2H3C(O)NH2, v=0
  281814.0586  0.0008 -5.1290 3  208.5031 85  71510 30342 438      41 437        syn-C2H3C(O)NH2, v=0
  281814.0426  0.0200 -3.0477 3  208.5031 85 -71510 30342 538      41 437        syn-C2H3C(O)NH2, v=0
  281939.2471  0.0032 -4.5232 3  616.6996133  71510 303661849      651946        syn-C2H3C(O)NH2, v=0
  281983.6729  0.0200 -3.1007 3  205.8239 83 -71510 30341 536      40 635        syn-C2H3C(O)NH2, v=0
  281984.8821  0.0008 -5.1369 3  205.8239 83  71510 30341 636      40 635        syn-C2H3C(O)NH2, v=0
  281985.9528  0.0008 -5.1369 3  205.8238 83  71510 30341 536      40 535        syn-C2H3C(O)NH2, v=0
  281987.1712  0.0200 -3.1007 3  205.8238 83 -71510 30341 636      40 535        syn-C2H3C(O)NH2, v=0
  281993.7102  0.0017 -4.3831 3  184.1164 73  71510 303361125      36 828        syn-C2H3C(O)NH2, v=0
  282003.0155  0.0010 -5.1434 3  184.1164 75  71510 30337 829      36 828        syn-C2H3C(O)NH2, v=0
  282051.0601  0.0034 -6.2142 3  477.4261113  71510 303562036      571741        syn-C2H3C(O)NH2, v=0
  282192.5290  0.0081 -4.8110 3  791.3698149  71510 303742253      732350        syn-C2H3C(O)NH2, v=0
  282221.3578  0.0200 -3.2517 3  198.5703 79 -71510 30339 732      38 831        syn-C2H3C(O)NH2, v=0
  282252.0465  0.0158 -4.9214 3 1257.9719189  71510 303942669      942570        syn-C2H3C(O)NH2, v=0
  282281.1486  0.1805 -5.7439 3 1689.9547219  71510 303A93079      A92980        syn-C2H3C(O)NH2, v=0
  282296.3434  0.0200 -3.1648 3  202.5323 81 -71510 30340 634      39 733        syn-C2H3C(O)NH2, v=0
  282322.0942  0.0115 -4.9449 3  722.7089145  71510 303721855      711952        syn-C2H3C(O)NH2, v=0
  282330.9307  0.0008 -5.1430 3  202.5323 81  71510 30340 734      39 733        syn-C2H3C(O)NH2, v=0
  282358.3811  0.0008 -5.1429 3  202.5302 81  71510 30340 634      39 633        syn-C2H3C(O)NH2, v=0
  282358.8422  0.0078 -6.3853 3  638.5843147  71510 30373 766      74 669        syn-C2H3C(O)NH2, v=0
  282358.8422  0.0078 -6.3853 3  638.5843147  71510 30373 866      74 569        syn-C2H3C(O)NH2, v=0
  282392.9857  0.0200 -3.1645 3  202.5302 81 -71510 30340 734      39 633        syn-C2H3C(O)NH2, v=0
  282434.3909  0.0200 -3.5038 3  370.6882 95 -71510 303472126      472027        syn-C2H3C(O)NH2, v=0
  282434.3909  0.0200 -3.5038 3  370.6882 95 -71510 303472127      472028        syn-C2H3C(O)NH2, v=0
  282478.4225  0.0200 -3.7701 3  584.9685125 -71510 303622240      622141        syn-C2H3C(O)NH2, v=0
  282489.4168  0.0200 -3.7700 3  584.9680125 -71510 303622241      622142        syn-C2H3C(O)NH2, v=0
  282498.7398  0.0050 -5.8776 3   48.2758 41  71510 30320 516      20 219        syn-C2H3C(O)NH2, v=0
  282507.6421  0.0009 -5.2621 3  225.5421 77  71510 303381524      371523        syn-C2H3C(O)NH2, v=0
  282508.5910  0.0009 -5.2621 3  225.5422 77  71510 303381523      371522        syn-C2H3C(O)NH2, v=0
  282563.2207  0.0038 -5.2287 3   70.3792 47  71510 30323 717      23 420        syn-C2H3C(O)NH2, v=0
  282611.9952  0.0274 -4.7543 3 1163.9271181  71510 303902664      902565        syn-C2H3C(O)NH2, v=0
  282634.8006  0.0326 -4.7934 3 1182.7114185  71510 303922370      922271        syn-C2H3C(O)NH2, v=0
  282698.7955  0.0493 -4.9914 3 1292.2943191  71510 303952768      952669        syn-C2H3C(O)NH2, v=0
  282839.2460  0.0270 -5.1036 3 1356.5254197  71510 303982673      982574        syn-C2H3C(O)NH2, v=0
  282895.1422  0.0008 -5.1469 3  198.5703 79  71510 30339 832      38 831        syn-C2H3C(O)NH2, v=0
  282908.3328  0.0008 -5.1512 3  193.9311 77  71510 30338 930      37 929        syn-C2H3C(O)NH2, v=0
  282953.1887  0.0028 -3.9925 3  697.8125145  71510 303721458      721359        syn-C2H3C(O)NH2, v=0
  282962.3760  0.0036 -6.4299 3  232.8531 81  71510 303401328      41 833        syn-C2H3C(O)NH2, v=0
  283037.4385  0.0433 -5.4884 3  934.6008165  71510 303822063      812160        syn-C2H3C(O)NH2, v=0
  283044.0552  0.0200 -3.9922 3  697.8129145 -71510 303721558      721459        syn-C2H3C(O)NH2, v=0
  283101.1191  0.0200 -3.4931 3  359.0783 93 -71510 303462125      462026        syn-C2H3C(O)NH2, v=0
  283101.1191  0.0200 -3.4931 3  359.0783 93 -71510 303462126      462027        syn-C2H3C(O)NH2, v=0
  283104.3994  0.0056 -4.2919 3  907.2815159  71510 303792456      792357        syn-C2H3C(O)NH2, v=0
  283146.8563  0.0018 -4.3492 3  193.5230 75  71510 303371126      37 829        syn-C2H3C(O)NH2, v=0
  283156.1616  0.0009 -5.1714 3  193.5227 75  71510 303371126      361125        syn-C2H3C(O)NH2, v=0
  283248.0562  0.0138 -4.3505 3  925.6469165  71510 303821864      821765        syn-C2H3C(O)NH2, v=0
  283249.3618  0.0200 -3.7034 3  380.4752113 -71510 30356 650      56 551        syn-C2H3C(O)NH2, v=0
  283249.3618  0.0200 -3.7034 3  380.4752113 -71510 30356 750      56 651        syn-C2H3C(O)NH2, v=0
  283317.2770  0.0066 -4.9745 3  104.6195 57  71510 30328 721      28 424        syn-C2H3C(O)NH2, v=0
  283317.3648  0.0106 -4.5673 3 1064.0617173  71510 303862562      862463        syn-C2H3C(O)NH2, v=0
  283351.3171  0.0009 -5.1454 3  198.5326 79  71510 30339 732      38 731        syn-C2H3C(O)NH2, v=0
  283432.8400  0.0027 -3.8198 3  292.9994103  71510 30351 348      51 249        syn-C2H3C(O)NH2, v=0
  283432.8400  0.0027 -3.8198 3  292.9994103  71510 30351 448      51 349        syn-C2H3C(O)NH2, v=0
  283440.3172  0.0200 -4.0187 3  745.4926143 -71510 303712348      712249        syn-C2H3C(O)NH2, v=0
  283494.5878  0.0039 -4.0992 3  394.8256107  71510 303531439      521538        syn-C2H3C(O)NH2, v=0
  283567.1475  0.0009 -5.2350 3  218.9824 77  71510 303381425      371424        syn-C2H3C(O)NH2, v=0
  283579.1816  0.0009 -5.2349 3  218.9828 77  71510 303381424      371423        syn-C2H3C(O)NH2, v=0
  283694.8328  0.0200 -4.0180 3  745.4829143 -71510 303712349      712250        syn-C2H3C(O)NH2, v=0
  283716.7384  0.0084 -4.8061 3  791.3661149  71510 303742252      732351        syn-C2H3C(O)NH2, v=0
  283722.3521  0.0200 -3.4835 3  347.7246 91 -71510 303452124      452025        syn-C2H3C(O)NH2, v=0
  283722.3521  0.0200 -3.4835 3  347.7246 91 -71510 303452125      452026        syn-C2H3C(O)NH2, v=0
  283724.1051  0.0064 -4.7227 3  745.4926145  71510 303722152      712249        syn-C2H3C(O)NH2, v=0
  283756.1289  0.0008 -5.1334 3  177.5560 73  71510 30336 927      35 926        syn-C2H3C(O)NH2, v=0
  283801.4455  0.0038 -6.4154 3  243.1369 83  71510 303411329      42 834        syn-C2H3C(O)NH2, v=0
  283829.0852  0.0828 -5.0371 3 1311.9120195  71510 303972374      972275        syn-C2H3C(O)NH2, v=0
  283906.7723  0.0200 -3.3645 3  203.3679 79 -71510 30339 831      38 930        syn-C2H3C(O)NH2, v=0
  283926.6740  0.0220 -4.5592 3 1050.5683175  71510 303872167      872068        syn-C2H3C(O)NH2, v=0
  283934.6723  0.1997 -5.5793 3 1601.5368215  71510 303A72681      A72582        syn-C2H3C(O)NH2, v=0
  283937.0364  0.0038 -6.2745 3  544.7686121  71510 303602139      611844        syn-C2H3C(O)NH2, v=0
  284019.9472  0.0200 -3.7444 3  569.4704123 -71510 303612239      612140        syn-C2H3C(O)NH2, v=0
  284025.1295  0.0200 -3.2458 3  198.5326 79 -71510 30339 832      38 731        syn-C2H3C(O)NH2, v=0
  284025.7776  0.0011 -3.7444 3  569.4702123  71510 303612240      612141        syn-C2H3C(O)NH2, v=0
  284167.2164  0.0039 -4.1870 3  242.5290 97  71510 30348 147      48 048        syn-C2H3C(O)NH2, v=0
  284167.2164  0.0039 -4.1870 3  242.5290 97  71510 30348 247      48 148        syn-C2H3C(O)NH2, v=0
  284182.1001  0.0159 -4.8727 3 1233.9538187  71510 303932668      932569        syn-C2H3C(O)NH2, v=0
  284215.7326  0.0027 -6.5445 3  486.0190 79  71510 3033936 3      3836 2        syn-C2H3C(O)NH2, v=0
  284215.7326  0.0027 -6.5445 3  486.0190 79  71510 3033936 4      3836 3        syn-C2H3C(O)NH2, v=0
  284248.7922  0.0388 -5.0399 3 1322.0513195  71510 303972573      972474        syn-C2H3C(O)NH2, v=0
  284300.8023  0.0200 -3.4751 3  336.6265 89 -71510 303442123      442024        syn-C2H3C(O)NH2, v=0
  284300.8023  0.0200 -3.4751 3  336.6265 89 -71510 303442124      442025        syn-C2H3C(O)NH2, v=0
  284306.9883  0.0025 -6.3903 3  469.2938 79  71510 3033935 4      3835 3        syn-C2H3C(O)NH2, v=0
  284306.9883  0.0025 -6.3903 3  469.2938 79  71510 3033935 5      3835 4        syn-C2H3C(O)NH2, v=0
  284403.4581  0.0023 -6.2652 3  453.0406 79  71510 3033934 5      3834 4        syn-C2H3C(O)NH2, v=0
  284403.4581  0.0023 -6.2652 3  453.0406 79  71510 3033934 6      3834 5        syn-C2H3C(O)NH2, v=0
  284437.0999  0.0066 -6.3564 3  562.9524139  71510 30369 663      70 566        syn-C2H3C(O)NH2, v=0
  284437.0999  0.0066 -6.3564 3  562.9524139  71510 30369 763      70 466        syn-C2H3C(O)NH2, v=0
  284505.8802  0.0021 -6.1588 3  437.2598 79  71510 3033933 6      3833 5        syn-C2H3C(O)NH2, v=0
  284505.8802  0.0021 -6.1588 3  437.2598 79  71510 3033933 7      3833 6        syn-C2H3C(O)NH2, v=0
  284592.0967  0.0635 -6.1377 3 1478.8342199  71510 303993466      983563        syn-C2H3C(O)NH2, v=0
  284592.1134  0.0635 -6.1377 3 1478.8342199  71510 303993465      983564        syn-C2H3C(O)NH2, v=0
  284603.5685  0.0558 -6.0112 3 1415.2039195  71510 303973365      963462        syn-C2H3C(O)NH2, v=0
  284603.6176  0.0558 -6.0112 3 1415.2039195  71510 303973364      963463        syn-C2H3C(O)NH2, v=0
  284603.6835  0.0200 -3.7060 3  415.7892117 -71510 30358 751      58 652        syn-C2H3C(O)NH2, v=0
  284603.6835  0.0200 -3.7060 3  415.7892117 -71510 30358 851      58 752        syn-C2H3C(O)NH2, v=0
  284615.1121  0.0019 -6.0657 3  421.9517 79  71510 3033932 7      3832 6        syn-C2H3C(O)NH2, v=0
  284615.1121  0.0019 -6.0657 3  421.9517 79  71510 3033932 8      3832 7        syn-C2H3C(O)NH2, v=0
  284620.1715  0.0034 -4.8285 3  114.0699 57  71510 303281018      28 721        syn-C2H3C(O)NH2, v=0
  284622.3139  0.0063 -4.1562 3  808.0463155  71510 303771661      771562        syn-C2H3C(O)NH2, v=0
  284648.0554  0.0719 -6.2673 3 1543.8920203  71510 303A13567      A03664        syn-C2H3C(O)NH2, v=0
  284648.0611  0.0719 -6.2673 3 1543.8920203  71510 303A13566      A03665        syn-C2H3C(O)NH2, v=0
  284655.0815  0.0034 -6.4567 3  222.7552 79  71510 303391327      40 832        syn-C2H3C(O)NH2, v=0
  284691.3097  0.0200 -3.9292 3  653.8606141 -71510 303701357      701258        syn-C2H3C(O)NH2, v=0
  284691.5880  0.0488 -5.8875 3 1353.0027191  71510 303953264      943361        syn-C2H3C(O)NH2, v=0
  284691.7305  0.0488 -5.8875 3 1353.0027191  71510 303953263      943362        syn-C2H3C(O)NH2, v=0
  284701.3942  0.0055 -4.2548 3  887.3146157  71510 303782454      782355        syn-C2H3C(O)NH2, v=0
  284720.3085  0.0200 -3.9292 3  653.8607141 -71510 303701457      701358        syn-C2H3C(O)NH2, v=0
  284732.1551  0.0018 -5.9826 3  407.1169 79  71510 3033931 8      3831 7        syn-C2H3C(O)NH2, v=0
  284732.1551  0.0018 -5.9826 3  407.1169 79  71510 3033931 9      3831 8        syn-C2H3C(O)NH2, v=0
  284763.8141  0.0813 -6.3997 3 1610.3756207  71510 303A33668      A23765        syn-C2H3C(O)NH2, v=0
  284763.8160  0.0813 -6.3997 3 1610.3756207  71510 303A33667      A23766        syn-C2H3C(O)NH2, v=0
  284765.9374  0.0039 -4.5717 3  658.1402137  71510 303681950      672047        syn-C2H3C(O)NH2, v=0
  284837.1765  0.0030 -5.3543 3   66.2536 43  71510 30321 912      21 615        syn-C2H3C(O)NH2, v=0
  284838.9676  0.0200 -3.4679 3  325.7833 87 -71510 303432122      432023        syn-C2H3C(O)NH2, v=0
  284838.9676  0.0200 -3.4679 3  325.7833 87 -71510 303432123      432024        syn-C2H3C(O)NH2, v=0
  284841.6259  0.0024 -6.1643 3  290.8234 87  71510 303431727      441430        syn-C2H3C(O)NH2, v=0
  284858.1841  0.0017 -5.9074 3  392.7557 79  71510 3033930 9      3830 8        syn-C2H3C(O)NH2, v=0
  284858.1841  0.0017 -5.9074 3  392.7557 79  71510 303393010      3830 9        syn-C2H3C(O)NH2, v=0
  284861.3009  0.0050 -4.6414 3  701.0785141  71510 303702051      692148        syn-C2H3C(O)NH2, v=0
  284867.1326  0.0425 -5.7667 3 1292.2320187  71510 303933163      923260        syn-C2H3C(O)NH2, v=0
  284867.5413  0.0425 -5.7667 3 1292.2320187  71510 303933162      923261        syn-C2H3C(O)NH2, v=0
  284916.4453  0.0021 -4.4422 3  174.8782 71  71510 303351124      35 827        syn-C2H3C(O)NH2, v=0
  284928.7044  0.0009 -5.2090 3  212.9739 77  71510 303381326      371325        syn-C2H3C(O)NH2, v=0
  284932.9377  0.0915 -6.5350 3 1678.2836211  71510 303A53769      A43866        syn-C2H3C(O)NH2, v=0
  284932.9383  0.0915 -6.5350 3 1678.2836211  71510 303A53768      A43867        syn-C2H3C(O)NH2, v=0
  284994.5861  0.0016 -5.8387 3  378.8687 79  71510 303392910      3829 9        syn-C2H3C(O)NH2, v=0
  284994.5861  0.0016 -5.8387 3  378.8687 79  71510 303392911      382910        syn-C2H3C(O)NH2, v=0
  285051.0431  0.0009 -5.2087 3  212.9783 77  71510 303381325      371324        syn-C2H3C(O)NH2, v=0
  285082.8714  0.0062 -4.1548 3  808.0485155  71510 303771761      771662        syn-C2H3C(O)NH2, v=0
  285143.0087  0.0015 -5.7754 3  365.4565 79  71510 303392811      382810        syn-C2H3C(O)NH2, v=0
  285143.0087  0.0015 -5.7754 3  365.4565 79  71510 303392812      382811        syn-C2H3C(O)NH2, v=0
  285143.5138  0.0369 -5.6488 3 1232.8937183  71510 303913062      903159        syn-C2H3C(O)NH2, v=0
  285144.6710  0.0369 -5.6488 3 1232.8937183  71510 303913061      903160        syn-C2H3C(O)NH2, v=0
  285241.2939  0.0125 -4.3447 3  925.6583165  71510 303821964      821865        syn-C2H3C(O)NH2, v=0
  285305.4226  0.0014 -5.7167 3  352.5198 79  71510 303392712      382711        syn-C2H3C(O)NH2, v=0
  285305.4226  0.0014 -5.7167 3  352.5198 79  71510 303392713      382712        syn-C2H3C(O)NH2, v=0
  285339.1112  0.0200 -3.4621 3  315.1944 85 -71510 303422121      422022        syn-C2H3C(O)NH2, v=0
  285339.1112  0.0200 -3.4621 3  315.1944 85 -71510 303422122      422023        syn-C2H3C(O)NH2, v=0
  285376.3052  0.0203 -4.4692 3  997.7358171  71510 303851966      851867        syn-C2H3C(O)NH2, v=0
  285382.7519  0.0047 -6.3519 3  616.5613129  71510 303642242      651947        syn-C2H3C(O)NH2, v=0
  285401.1906  0.0200 -3.3249 3   77.3939 47 -71510 30323 915      22 814        syn-C2H3C(O)NH2, v=0
  285460.3795  0.0200 -3.7197 3  554.2397121 -71510 303602238      602139        syn-C2H3C(O)NH2, v=0
  285463.3780  0.0200 -3.7197 3  554.2396121 -71510 303602239      602140        syn-C2H3C(O)NH2, v=0
  285484.2026  0.0013 -5.6620 3  340.0594 79  71510 303392613      382612        syn-C2H3C(O)NH2, v=0
  285484.2026  0.0013 -5.6620 3  340.0594 79  71510 303392614      382613        syn-C2H3C(O)NH2, v=0
  285505.5271  0.0342 -5.1451 3 1381.7391199  71510 303992674      992575        syn-C2H3C(O)NH2, v=0
  285536.9469  0.0318 -5.5337 3 1174.9895179  71510 303892961      883058        syn-C2H3C(O)NH2, v=0
  285540.1796  0.0318 -5.5337 3 1174.9895179  71510 303892960      883059        syn-C2H3C(O)NH2, v=0
  285586.0458  0.0226 -5.1998 3  825.2068155  71510 303771959      762056        syn-C2H3C(O)NH2, v=0
  285624.9969  0.0200 -3.7211 3  452.3654121 -71510 30360 852      60 753        syn-C2H3C(O)NH2, v=0
  285624.9969  0.0200 -3.7211 3  452.3654121 -71510 30360 952      60 853        syn-C2H3C(O)NH2, v=0
  285682.2345  0.0013 -5.6110 3  328.0763 79  71510 303392514      382513        syn-C2H3C(O)NH2, v=0
  285682.2345  0.0013 -5.6110 3  328.0763 79  71510 303392515      382514        syn-C2H3C(O)NH2, v=0
  285696.8811  0.0200 -3.7557 3  325.0824107 -71510 30353 449      53 350        syn-C2H3C(O)NH2, v=0
  285696.8811  0.0200 -3.7557 3  325.0824107 -71510 30353 549      53 450        syn-C2H3C(O)NH2, v=0
  285767.2598  0.5008 -6.4371 3 2051.9229243  71510 303C13091      C12992        syn-C2H3C(O)NH2, v=0
  285786.1093  0.3271 -5.9908 3 1819.9107229  71510 303B42886      B42787        syn-C2H3C(O)NH2, v=0
  285803.5410  0.0200 -3.4576 3  304.8592 83 -71510 303412120      412021        syn-C2H3C(O)NH2, v=0
  285803.5410  0.0200 -3.4576 3  304.8592 83 -71510 303412121      412022        syn-C2H3C(O)NH2, v=0
  285818.0267  0.0119 -4.4867 3 1020.7076169  71510 303842559      842460        syn-C2H3C(O)NH2, v=0
  285821.6098  0.0200 -3.8727 3  611.1119137 -71510 303681256      681157        syn-C2H3C(O)NH2, v=0
  285829.4542  0.0021 -3.9844 3  727.6115141  71510 303702347      702248        syn-C2H3C(O)NH2, v=0
  285830.2891  0.0018 -3.8727 3  611.1119137  71510 303681356      681257        syn-C2H3C(O)NH2, v=0
  285892.6377  0.0027 -3.6667 3   76.7969 49  71510 30324 717      23 618        syn-C2H3C(O)NH2, v=0
  285897.5733  0.0065 -5.5142 3   66.6329 47  71510 30323 518      23 221        syn-C2H3C(O)NH2, v=0
  285903.0574  0.0012 -5.5633 3  316.5716 79  71510 303392415      382414        syn-C2H3C(O)NH2, v=0
  285903.0574  0.0012 -5.5633 3  316.5716 79  71510 303392416      382415        syn-C2H3C(O)NH2, v=0
  285925.0308  0.0024 -6.1613 3  290.7873 87  71510 303431726      441431        syn-C2H3C(O)NH2, v=0
  285975.9904  0.0200 -3.9840 3  727.6059141 -71510 303702348      702249        syn-C2H3C(O)NH2, v=0
  286000.4874  0.0394 -4.9312 3 1263.4987191  71510 303952472      952373        syn-C2H3C(O)NH2, v=0
  286067.1535  0.0273 -5.4215 3 1118.5212175  71510 303872860      862957        syn-C2H3C(O)NH2, v=0
  286076.0490  0.0273 -5.4215 3 1118.5212175  71510 303872859      862958        syn-C2H3C(O)NH2, v=0
  286080.0138  0.0045 -4.5301 3  641.1404135  71510 303671948      662047        syn-C2H3C(O)NH2, v=0
  286083.0796  0.0050 -4.2507 3  887.2608157  71510 303782455      782356        syn-C2H3C(O)NH2, v=0
  286115.3804  0.0592 -4.8803 3 1229.5146189  71510 303942272      942173        syn-C2H3C(O)NH2, v=0
  286132.5714  0.0122 -6.4699 3  735.9757157  71510 30378 870      79 773        syn-C2H3C(O)NH2, v=0
  286132.5714  0.0122 -6.4699 3  735.9757157  71510 30378 970      79 673        syn-C2H3C(O)NH2, v=0
  286151.0580  0.0012 -5.5185 3  305.5468 79  71510 303392316      382315        syn-C2H3C(O)NH2, v=0
  286151.0580  0.0012 -5.5185 3  305.5468 79  71510 303392317      382316        syn-C2H3C(O)NH2, v=0
  286194.1928  0.0066 -6.3675 3  491.8282131  71510 30365 560      66 463        syn-C2H3C(O)NH2, v=0
  286194.1928  0.0066 -6.3675 3  491.8282131  71510 30365 660      66 363        syn-C2H3C(O)NH2, v=0
  286234.2516  0.0200 -3.4546 3  294.7772 81 -71510 303402119      402020        syn-C2H3C(O)NH2, v=0
  286234.2516  0.0200 -3.4546 3  294.7772 81 -71510 303402120      402021        syn-C2H3C(O)NH2, v=0
  286246.2100  0.0200 -3.3229 3   77.3698 47 -71510 30323 914      22 815        syn-C2H3C(O)NH2, v=0
  286289.6867  0.0200 -3.7464 3  490.1950125 -71510 30362 953      62 854        syn-C2H3C(O)NH2, v=0
  286289.6867  0.0200 -3.7464 3  490.1950125 -71510 303621053      62 954        syn-C2H3C(O)NH2, v=0
  286393.3131  0.0046 -6.4673 3  227.4710 81  71510 303401229      41 734        syn-C2H3C(O)NH2, v=0
  286414.0523  0.0067 -6.4451 3  692.8012137  71510 303682345      692050        syn-C2H3C(O)NH2, v=0
  286427.8449  0.0200 -3.8231 3  569.5778133 -71510 303661155      661056        syn-C2H3C(O)NH2, v=0
  286430.2803  0.0200 -3.8230 3  569.5779133 -71510 303661255      661156        syn-C2H3C(O)NH2, v=0
  286431.7374  0.0011 -5.4764 3  295.0035 79  71510 303392217      382216        syn-C2H3C(O)NH2, v=0
  286431.7374  0.0011 -5.4764 3  295.0035 79  71510 303392218      382217        syn-C2H3C(O)NH2, v=0
  286446.4739  0.0041 -4.1803 3  442.1368113  71510 303561541      551640        syn-C2H3C(O)NH2, v=0
  286471.4354  0.0200 -3.1107 3   59.5857 31 -71510 3031513 2      1412 3        syn-C2H3C(O)NH2, v=0
  286471.4354  0.0200 -3.1107 3   59.5857 31 -71510 3031513 3      1412 2        syn-C2H3C(O)NH2, v=0
  286523.6147  0.0099 -4.5208 3 1042.1650171  71510 303852561      852462        syn-C2H3C(O)NH2, v=0
  286545.6647  0.0009 -5.1845 3  207.5429 77  71510 303381227      371226        syn-C2H3C(O)NH2, v=0
  286568.9891  0.0016 -3.7808 3  529.2689129  71510 303641054      64 955        syn-C2H3C(O)NH2, v=0
  286569.6243  0.0016 -3.7808 3  529.2689129  71510 303641154      641055        syn-C2H3C(O)NH2, v=0
  286633.2474  0.0200 -3.4531 3  284.9478 79 -71510 303392118      392019        syn-C2H3C(O)NH2, v=0
  286633.2474  0.0200 -3.4531 3  284.9478 79 -71510 303392119      392020        syn-C2H3C(O)NH2, v=0
  286670.1445  0.0158 -4.8235 3 1210.2004185  71510 303922667      922568        syn-C2H3C(O)NH2, v=0
  286682.8498  0.0294 -4.5968 3 1072.4160177  71510 303882068      881969        syn-C2H3C(O)NH2, v=0
  286752.0904  0.0011 -5.4369 3  284.9439 79  71510 303392118      382117        syn-C2H3C(O)NH2, v=0
  286752.0904  0.0011 -5.4369 3  284.9439 79  71510 303392119      382118        syn-C2H3C(O)NH2, v=0
  286757.7468  0.0233 -5.3122 3 1063.4908171  71510 303852759      842856        syn-C2H3C(O)NH2, v=0
  286781.8238  0.0233 -5.3121 3 1063.4907171  71510 303852758      842857        syn-C2H3C(O)NH2, v=0
  286807.6326  0.0200 -3.6961 3  539.2753119 -71510 303592237      592138        syn-C2H3C(O)NH2, v=0
  286809.1378  0.0011 -3.6961 3  539.2752119  71510 303592238      592139        syn-C2H3C(O)NH2, v=0
  286850.1278  0.0288 -4.6869 3 1127.0225181  71510 303902269      902170        syn-C2H3C(O)NH2, v=0
  286861.2008  0.0008 -5.1515 3  198.2603 77  71510 303381029      371028        syn-C2H3C(O)NH2, v=0
  286864.6610  0.0200 -3.1502 3   61.7325 35 -71510 3031712 6      1611 5        syn-C2H3C(O)NH2, v=0
  286864.6610  0.0200 -3.1502 3   61.7325 35 -71510 3031712 5      1611 6        syn-C2H3C(O)NH2, v=0
  286953.2610  0.0033 -3.9417 3  272.6181101  71510 30350 248      50 149        syn-C2H3C(O)NH2, v=0
  286953.2610  0.0033 -3.9417 3  272.6181101  71510 30350 348      50 249        syn-C2H3C(O)NH2, v=0
  286986.3106  0.0010 -5.1368 3  193.5230 77  71510 30338 830      37 829        syn-C2H3C(O)NH2, v=0
  286996.2095  0.0419 -4.7337 3 1149.6789183  71510 303912170      912071        syn-C2H3C(O)NH2, v=0
  287002.3025  0.0200 -3.4532 3  275.3705 77 -71510 303382117      382018        syn-C2H3C(O)NH2, v=0
  287002.3025  0.0200 -3.4532 3  275.3705 77 -71510 303382118      382019        syn-C2H3C(O)NH2, v=0
  287010.4039  0.0200 -3.2473 3   70.5618 43 -71510 303211012      20 911        syn-C2H3C(O)NH2, v=0
  287021.7734  0.0010 -3.2473 3   70.5615 43  71510 303211011      20 912        syn-C2H3C(O)NH2, v=0
  287052.1037  0.0041 -6.4430 3   16.9551 27  71510 30313 4 9      12 112        syn-C2H3C(O)NH2, v=0
  287070.6991  0.0041 -6.4111 3  253.6105 85  71510 303421330      43 835        syn-C2H3C(O)NH2, v=0
  287121.1539  0.0010 -5.3996 3  275.3705 79  71510 303392019      382018        syn-C2H3C(O)NH2, v=0
  287121.1539  0.0010 -5.3996 3  275.3705 79  71510 303392020      382019        syn-C2H3C(O)NH2, v=0
  287126.5736  0.0200 -3.1938 3   65.3763 39 -71510 3031911 9      1810 8        syn-C2H3C(O)NH2, v=0
  287126.5736  0.0200 -3.1938 3   65.3763 39 -71510 3031911 8      1810 9        syn-C2H3C(O)NH2, v=0
  287126.6849  0.0026 -6.3020 3  189.2457 69  71510 303341520      351223        syn-C2H3C(O)NH2, v=0
  287333.8933  0.0071 -4.7111 3  745.4829145  71510 303722151      712250        syn-C2H3C(O)NH2, v=0
  287343.1893  0.0200 -3.4551 3  266.0447 75 -71510 303372116      372017        syn-C2H3C(O)NH2, v=0
  287343.1893  0.0200 -3.4551 3  266.0447 75 -71510 303372117      372018        syn-C2H3C(O)NH2, v=0
  287346.9380  0.0041 -4.4479 3  180.1997 73  71510 303361026      36 729        syn-C2H3C(O)NH2, v=0
  287491.9728  0.0026 -6.3010 3  189.2335 69  71510 303341519      351224        syn-C2H3C(O)NH2, v=0
  287492.9738  0.0009 -5.1817 3  207.5842 77  71510 303381226      371225        syn-C2H3C(O)NH2, v=0
  287550.8288  0.0010 -5.3646 3  266.2868 79  71510 303391920      381919        syn-C2H3C(O)NH2, v=0
  287550.8288  0.0010 -5.3646 3  266.2868 79  71510 303391921      381920        syn-C2H3C(O)NH2, v=0
  287611.1123  0.0072 -6.4344 3  425.2186123  71510 30361 457      62 360        syn-C2H3C(O)NH2, v=0
  287611.1123  0.0072 -6.4344 3  425.2186123  71510 30361 557      62 260        syn-C2H3C(O)NH2, v=0
  287635.7039  0.0197 -5.2057 3 1009.9004167  71510 303832658      822755        syn-C2H3C(O)NH2, v=0
  287657.6094  0.0200 -3.4589 3  256.9701 73 -71510 303362115      362016        syn-C2H3C(O)NH2, v=0
  287657.6094  0.0200 -3.4589 3  256.9701 73 -71510 303362116      362017        syn-C2H3C(O)NH2, v=0
  287674.6799  0.0044 -4.0790 3  761.1007151  71510 303751560      751461        syn-C2H3C(O)NH2, v=0
  287686.0191  0.0200 -3.7229 3  358.4528111 -71510 30355 550      55 451        syn-C2H3C(O)NH2, v=0
  287686.0191  0.0200 -3.7229 3  358.4528111 -71510 30355 650      55 551        syn-C2H3C(O)NH2, v=0
  287699.6871  0.0198 -5.2055 3 1009.9003167  71510 303832657      822756        syn-C2H3C(O)NH2, v=0
  287706.7894  0.1148 -5.4491 3 1542.3700209  71510 303A42975      A42876        syn-C2H3C(O)NH2, v=0
  287732.5273  0.0008 -5.1635 3  202.6850 77  71510 303381128      371127        syn-C2H3C(O)NH2, v=0
  287761.3544  0.0010 -5.0898 3  222.6061 93  71510 30346 145      45 144        syn-C2H3C(O)NH2, v=0
  287761.3479  0.0200 -2.9139 3  222.6061 93 -71510 30346 145      45 244        syn-C2H3C(O)NH2, v=0
  287761.3479  0.0200 -2.9139 3  222.6061 93 -71510 30346 245      45 144        syn-C2H3C(O)NH2, v=0
  287761.3544  0.0010 -5.0898 3  222.6061 93  71510 30346 245      45 244        syn-C2H3C(O)NH2, v=0
  287762.3648  0.0009 -5.1008 3  221.5701 91  71510 30345 243      44 242        syn-C2H3C(O)NH2, v=0
  287762.4120  0.0200 -2.9505 3  221.5701 91 -71510 30345 243      44 342        syn-C2H3C(O)NH2, v=0
  287762.4120  0.0200 -2.9505 3  221.5701 91 -71510 30345 343      44 242        syn-C2H3C(O)NH2, v=0
  287762.3648  0.0009 -5.1008 3  221.5701 91  71510 30345 343      44 342        syn-C2H3C(O)NH2, v=0
  287770.1987  0.0012 -5.0779 3  223.1291 95  71510 30347 047      46 046        syn-C2H3C(O)NH2, v=0
  287770.2096  0.0200 -2.8796 3  223.1291 95 -71510 30347 047      46 146        syn-C2H3C(O)NH2, v=0
  287770.2096  0.0200 -2.8796 3  223.1291 95 -71510 30347 147      46 046        syn-C2H3C(O)NH2, v=0
  287770.1987  0.0012 -5.0779 3  223.1291 95  71510 30347 147      46 146        syn-C2H3C(O)NH2, v=0
  287786.6581  0.0200 -2.9904 3  220.0084 89 -71510 30344 341      43 440        syn-C2H3C(O)NH2, v=0
  287786.6458  0.0008 -5.1109 3  220.0084 89  71510 30344 441      43 440        syn-C2H3C(O)NH2, v=0
  287786.6460  0.0008 -5.1109 3  220.0084 89  71510 30344 341      43 340        syn-C2H3C(O)NH2, v=0
  287786.6581  0.0200 -2.9904 3  220.0084 89 -71510 30344 441      43 340        syn-C2H3C(O)NH2, v=0
  287837.1274  0.0044 -4.0786 3  761.1013151  71510 303751660      751561        syn-C2H3C(O)NH2, v=0
  287856.9860  0.0200 -3.0347 3  217.9034 87 -71510 30343 439      42 538        syn-C2H3C(O)NH2, v=0
  287856.9822  0.0008 -5.1198 3  217.9034 87  71510 30343 539      42 538        syn-C2H3C(O)NH2, v=0
  287856.9966  0.0008 -5.1198 3  217.9034 87  71510 30343 439      42 438        syn-C2H3C(O)NH2, v=0
  287856.9860  0.0200 -3.0347 3  217.9034 87 -71510 30343 539      42 438        syn-C2H3C(O)NH2, v=0
  287878.5604  0.0027 -5.0762 3   79.5125 49  71510 30324 817      24 520        syn-C2H3C(O)NH2, v=0
  287947.0641  0.0200 -3.4647 3  248.1460 71 -71510 303352114      352015        syn-C2H3C(O)NH2, v=0
  287947.0641  0.0200 -3.4647 3  248.1460 71 -71510 303352115      352016        syn-C2H3C(O)NH2, v=0
  287980.3065  0.0014 -4.4736 3   41.0515 37  71510 30318 613      17 314        syn-C2H3C(O)NH2, v=0
  288013.5217  0.0008 -3.0855 3  215.2299 85  71510 30342 537      41 636        syn-C2H3C(O)NH2, v=0
  288014.1572  0.0008 -5.1275 3  215.2299 85  71510 30342 637      41 636        syn-C2H3C(O)NH2, v=0
  288014.7283  0.0008 -5.1275 3  215.2299 85  71510 30342 537      41 536        syn-C2H3C(O)NH2, v=0
  288015.4068  0.0200 -3.0855 3  215.2299 85 -71510 30342 637      41 536        syn-C2H3C(O)NH2, v=0
  288032.5718  0.0200 -3.9513 3  710.0077139 -71510 303692346      692247        syn-C2H3C(O)NH2, v=0
  288057.1568  0.0010 -5.3315 3  257.6973 79  71510 303391822      381821        syn-C2H3C(O)NH2, v=0
  288057.1572  0.0010 -5.3315 3  257.6973 79  71510 303391821      381820        syn-C2H3C(O)NH2, v=0
  288068.6553  0.0200 -3.6735 3  524.5759117 -71510 303582236      582137        syn-C2H3C(O)NH2, v=0
  288069.4208  0.0010 -3.6735 3  524.5759117  71510 303582237      582138        syn-C2H3C(O)NH2, v=0
  288095.3803  0.0047 -4.2130 3  867.5548155  71510 303772453      772354        syn-C2H3C(O)NH2, v=0
  288115.6294  0.0200 -3.9511 3  710.0046139 -71510 303692347      692248        syn-C2H3C(O)NH2, v=0
  288208.1355  0.0032 -5.1495 3   29.0856 35  71510 30317 215      16 116        syn-C2H3C(O)NH2, v=0
  288213.1278  0.0200 -3.4728 3  239.5721 69 -71510 303342113      342014        syn-C2H3C(O)NH2, v=0
  288213.1278  0.0200 -3.4728 3  239.5721 69 -71510 303342114      342015        syn-C2H3C(O)NH2, v=0
  288251.4752  0.0047 -5.4962 3   61.4762 45  71510 30322 617      22 320        syn-C2H3C(O)NH2, v=0
  288313.4553  0.0008 -3.1462 3  211.9498 83  71510 30341 635      40 734        syn-C2H3C(O)NH2, v=0
  288326.4334  0.0097 -4.2584 3  875.7530161  71510 303801763      801664        syn-C2H3C(O)NH2, v=0
  288332.5760  0.0008 -5.1334 3  211.9498 83  71510 30341 735      40 734        syn-C2H3C(O)NH2, v=0
  288348.0435  0.0008 -5.1334 3  211.9487 83  71510 30341 635      40 634        syn-C2H3C(O)NH2, v=0
  288367.1471  0.0200 -3.1460 3  211.9487 83 -71510 30341 735      40 634        syn-C2H3C(O)NH2, v=0
  288431.5141  0.0035 -4.6950 3   35.8411 37  71510 30318 315      17 216        syn-C2H3C(O)NH2, v=0
  288457.1399  0.0200 -3.4835 3  231.2478 67 -71510 303332112      332013        syn-C2H3C(O)NH2, v=0
  288457.1399  0.0200 -3.4835 3  231.2478 67 -71510 303332113      332014        syn-C2H3C(O)NH2, v=0
  288481.0855  0.0026 -6.1563 3  343.7839 95  71510 303471830      481533        syn-C2H3C(O)NH2, v=0
  288486.0899  0.0087 -6.4081 3  654.8361149  71510 30374 767      75 670        syn-C2H3C(O)NH2, v=0
  288486.0899  0.0087 -6.4081 3  654.8361149  71510 30374 867      75 570        syn-C2H3C(O)NH2, v=0
  288491.3355  0.0200 -3.2257 3  208.0067 81 -71510 30340 733      39 832        syn-C2H3C(O)NH2, v=0
  288538.9112  0.0176 -4.4600 3  997.7551171  71510 303852066      851967        syn-C2H3C(O)NH2, v=0
  288662.3998  0.0009 -5.3004 3  249.6079 79  71510 303391723      381722        syn-C2H3C(O)NH2, v=0
  288662.4080  0.0009 -5.3004 3  249.6079 79  71510 303391722      381721        syn-C2H3C(O)NH2, v=0
  288680.5065  0.0200 -3.4970 3  223.1729 65 -71510 303322111      322012        syn-C2H3C(O)NH2, v=0
  288680.5065  0.0200 -3.4970 3  223.1729 65 -71510 303322112      322013        syn-C2H3C(O)NH2, v=0
  288728.1920  0.0166 -5.1021 3  957.7525163  71510 303812557      802654        syn-C2H3C(O)NH2, v=0
  288761.3889  0.0025 -4.3429 3  203.0959 77  71510 303381127      38 830        syn-C2H3C(O)NH2, v=0
  288863.3918  0.0031 -5.1481 3   29.0855 35  71510 30317 315      16 016        syn-C2H3C(O)NH2, v=0
  288884.4927  0.0200 -3.5139 3  215.3469 63 -71510 303312110      312011        syn-C2H3C(O)NH2, v=0
  288884.4927  0.0200 -3.5139 3  215.3469 63 -71510 303312111      312012        syn-C2H3C(O)NH2, v=0
  288887.7655  0.0008 -5.1372 3  208.0067 81  71510 30340 833      39 832        syn-C2H3C(O)NH2, v=0
  288894.7687  0.0167 -5.1015 3  957.7521163  71510 303812556      802655        syn-C2H3C(O)NH2, v=0
  288936.3449  0.0045 -4.2105 3  867.5223155  71510 303772454      772355        syn-C2H3C(O)NH2, v=0
  288947.5552  0.0043 -4.1715 3   54.8972 43  71510 30321 516      20 417        syn-C2H3C(O)NH2, v=0
  288949.7959  0.0037 -4.5470 3  633.5320135  71510 303671850      661947        syn-C2H3C(O)NH2, v=0
  288969.9626  0.2344 -5.9663 3 1814.6505227  71510 303B33182      B33083        syn-C2H3C(O)NH2, v=0
  289000.5047  0.0032 -6.4986 3  212.8381 77  71510 303381326      39 831        syn-C2H3C(O)NH2, v=0
  289070.4155  0.0200 -3.5346 3  207.7693 61 -71510 3033021 9      302010        syn-C2H3C(O)NH2, v=0
  289070.4155  0.0200 -3.5346 3  207.7693 61 -71510 303302110      302011        syn-C2H3C(O)NH2, v=0
  289100.7217  0.0093 -4.2562 3  875.7570161  71510 303801863      801764        syn-C2H3C(O)NH2, v=0
  289165.1149  0.0009 -5.1362 3  207.9842 81  71510 30340 733      39 732        syn-C2H3C(O)NH2, v=0
  289195.4450  0.0009 -5.1401 3  203.3679 79  71510 30339 931      38 930        syn-C2H3C(O)NH2, v=0
  289212.4276  0.0426 -5.1850 3 1407.1657201  71510 303A02675      A02576        syn-C2H3C(O)NH2, v=0
  289239.3291  0.0200 -3.5599 3  200.4399 59 -71510 3032921 8      2920 9        syn-C2H3C(O)NH2, v=0
  289239.3291  0.0200 -3.5599 3  200.4399 59 -71510 3032921 9      292010        syn-C2H3C(O)NH2, v=0
  289249.8393  0.0200 -3.6519 3  510.1405115 -71510 303572235      572136        syn-C2H3C(O)NH2, v=0
  289249.8393  0.0200 -3.6519 3  510.1405115 -71510 303572236      572137        syn-C2H3C(O)NH2, v=0
  289325.3345  0.0218 -4.6953 3 1140.8587179  71510 303892663      892564        syn-C2H3C(O)NH2, v=0
  289373.8091  0.1111 -5.9487 3 1149.9015183  71510 303912270      902367        syn-C2H3C(O)NH2, v=0
  289386.7972  0.0200 -3.7112 3  393.1028115 -71510 30357 651      57 552        syn-C2H3C(O)NH2, v=0
  289386.7972  0.0200 -3.7112 3  393.1028115 -71510 30357 751      57 652        syn-C2H3C(O)NH2, v=0
  289392.4501  0.0200 -3.5908 3  193.3581 57 -71510 3032821 7      2820 8        syn-C2H3C(O)NH2, v=0
  289392.4501  0.0200 -3.5908 3  193.3581 57 -71510 3032821 8      2820 9        syn-C2H3C(O)NH2, v=0
  289398.5997  0.0009 -5.2709 3  242.0268 79  71510 303391624      381623        syn-C2H3C(O)NH2, v=0
  289398.7396  0.0009 -5.2709 3  242.0268 79  71510 303391623      381622        syn-C2H3C(O)NH2, v=0
  289470.7999  0.0041 -4.2613 3  492.1176119  71510 303591643      581742        syn-C2H3C(O)NH2, v=0
  289491.6088  0.0200 -3.8245 3  304.0108105 -71510 30352 349      52 250        syn-C2H3C(O)NH2, v=0
  289491.6088  0.0200 -3.8245 3  304.0108105 -71510 30352 449      52 350        syn-C2H3C(O)NH2, v=0
  289530.8201  0.0200 -3.6288 3  186.5238 55 -71510 3032721 6      2720 7        syn-C2H3C(O)NH2, v=0
  289530.8201  0.0200 -3.6288 3  186.5238 55 -71510 3032721 7      2720 8        syn-C2H3C(O)NH2, v=0
  289561.5595  0.0200 -3.2224 3  207.9842 81 -71510 30340 833      39 732        syn-C2H3C(O)NH2, v=0
  289565.7007  0.0155 -4.7741 3 1186.7183183  71510 303912666      912567        syn-C2H3C(O)NH2, v=0
  289655.4609  0.0200 -3.6758 3  179.9365 53 -71510 3032621 5      2620 6        syn-C2H3C(O)NH2, v=0
  289655.4609  0.0200 -3.6758 3  179.9365 53 -71510 3032621 6      2620 7        syn-C2H3C(O)NH2, v=0
  289700.7770  0.1502 -5.3937 3 1510.6629209  71510 303A42579      A42480        syn-C2H3C(O)NH2, v=0
  289709.5615  0.0460 -5.0746 3 1346.8618197  71510 303982574      982475        syn-C2H3C(O)NH2, v=0
  289748.6575  0.0364 -4.8213 3 1206.0605187  71510 303932371      932272        syn-C2H3C(O)NH2, v=0
  289763.3603  0.0091 -4.4751 3 1020.5505169  71510 303842560      842461        syn-C2H3C(O)NH2, v=0
  289767.4075  0.0200 -3.7351 3  173.5960 51 -71510 3032521 4      2520 5        syn-C2H3C(O)NH2, v=0
  289767.4075  0.0200 -3.7351 3  173.5960 51 -71510 3032521 5      2520 6        syn-C2H3C(O)NH2, v=0
  289802.8848  0.0026 -6.1526 3  343.7398 95  71510 303471829      481534        syn-C2H3C(O)NH2, v=0
  289821.0645  0.0230 -5.1983 3 1416.8128201  71510 303A02774      A02675        syn-C2H3C(O)NH2, v=0
  289851.8164  0.0026 -3.7570 3  280.0339 91  71510 303451134      441233        syn-C2H3C(O)NH2, v=0
  289867.5499  0.0200 -3.8122 3  167.5018 49 -71510 3032421 3      2420 4        syn-C2H3C(O)NH2, v=0
  289867.5499  0.0200 -3.8122 3  167.5018 49 -71510 3032421 4      2420 5        syn-C2H3C(O)NH2, v=0
  289889.0603  0.0200 -4.0086 3  715.3358147 -71510 303731459      731360        syn-C2H3C(O)NH2, v=0
  289941.8141  0.0009 -5.1337 3  189.7845 75  71510 303371027      361026        syn-C2H3C(O)NH2, v=0
  289943.0382  0.0200 -4.0085 3  715.3360147 -71510 303731559      731460        syn-C2H3C(O)NH2, v=0
  289956.8090  0.0200 -3.9173 3  161.6537 47 -71510 3032321 2      2320 3        syn-C2H3C(O)NH2, v=0
  289956.8090  0.0200 -3.9173 3  161.6537 47 -71510 3032321 3      2320 4        syn-C2H3C(O)NH2, v=0
  290036.0332  0.0200 -4.0735 3  156.0515 45 -71510 3032221 1      2220 2        syn-C2H3C(O)NH2, v=0
  290036.0332  0.0200 -4.0735 3  156.0515 45 -71510 3032221 2      2220 3        syn-C2H3C(O)NH2, v=0
  290052.8926  0.0138 -5.0014 3  907.0498159  71510 303792456      782553        syn-C2H3C(O)NH2, v=0
  290074.4460  0.0200 -3.9194 3  692.6791137 -71510 303682345      682246        syn-C2H3C(O)NH2, v=0
  290106.0505  0.0016 -4.3546 3  150.6948 43  71510 3032121 0      2120 1        syn-C2H3C(O)NH2, v=0
  290106.0505  0.0016 -4.3546 3  150.6948 43  71510 3032121 1      2120 2        syn-C2H3C(O)NH2, v=0
  290120.8703  0.0017 -3.9193 3  692.6774137  71510 303682346      682247        syn-C2H3C(O)NH2, v=0
  290146.4449  0.2370 -6.4609 3 1387.3885201  71510 303A02477      992574        syn-C2H3C(O)NH2, v=0
  290163.5116  0.0209 -5.1496 3 1391.2625199  71510 303992773      992674        syn-C2H3C(O)NH2, v=0
  290209.0915  0.0040 -4.1898 3  252.5317 99  71510 30349 148      49 049        syn-C2H3C(O)NH2, v=0
  290209.0915  0.0040 -4.1898 3  252.5317 99  71510 30349 248      49 149        syn-C2H3C(O)NH2, v=0
  290313.6935  0.0009 -5.2430 3  234.9656 79  71510 303391525      381524        syn-C2H3C(O)NH2, v=0
  290315.7016  0.0009 -5.2430 3  234.9656 79  71510 303391524      381523        syn-C2H3C(O)NH2, v=0
  290356.1080  0.0200 -3.6313 3  495.9681113 -71510 303562234      562135        syn-C2H3C(O)NH2, v=0
  290356.1080  0.0200 -3.6313 3  495.9681113 -71510 303562235      562136        syn-C2H3C(O)NH2, v=0
  290455.5611  0.0278 -5.2455 3 1442.6013203  71510 303A12775      A12676        syn-C2H3C(O)NH2, v=0
  290462.4550  0.0099 -4.4376 3  999.3181167  71510 303832558      832459        syn-C2H3C(O)NH2, v=0
  290476.6001  0.0140 -5.0001 3  907.0488159  71510 303792455      782554        syn-C2H3C(O)NH2, v=0
  290537.9798  0.0072 -6.3776 3  578.1973141  71510 30370 664      71 567        syn-C2H3C(O)NH2, v=0
  290537.9798  0.0072 -6.3776 3  578.1973141  71510 30370 764      71 467        syn-C2H3C(O)NH2, v=0
  290609.8024  0.0686 -5.1760 3 1401.6700199  71510 303992871      992772        syn-C2H3C(O)NH2, v=0
  290778.8517  0.0017 -5.6206 3   21.0929 27  71510 30313 6 7      12 310        syn-C2H3C(O)NH2, v=0
  290783.5497  0.0200 -3.7151 3  429.0240119 -71510 30359 752      59 653        syn-C2H3C(O)NH2, v=0
  290783.5497  0.0200 -3.7151 3  429.0240119 -71510 30359 852      59 753        syn-C2H3C(O)NH2, v=0
  290887.8641  0.0009 -5.1197 3  187.0210 75  71510 30337 928      36 927        syn-C2H3C(O)NH2, v=0
  290980.1520  0.0062 -4.7858 3  130.1913 63  71510 30331 823      31 526        syn-C2H3C(O)NH2, v=0
  290993.3009  0.0089 -4.8196 3  704.1723143  71510 303711854      701951        syn-C2H3C(O)NH2, v=0
  291047.7105  0.0392 -4.9248 3 1267.8395189  71510 303942767      942668        syn-C2H3C(O)NH2, v=0
  291143.5101  0.0041 -4.1730 3  848.0842153  71510 303762452      762353        syn-C2H3C(O)NH2, v=0
  291317.2412  0.0027 -4.5209 3  165.8181 69  71510 303341123      34 826        syn-C2H3C(O)NH2, v=0
  291357.6422  0.0200 -3.4610 3   85.8130 51 -71510 30325 817      24 718        syn-C2H3C(O)NH2, v=0
  291371.7535  0.0029 -6.4816 3  142.9413 59  71510 303291416      301119        syn-C2H3C(O)NH2, v=0
  291374.6333  0.0206 -5.0996 3 1365.9599197  71510 303982772      982673        syn-C2H3C(O)NH2, v=0
  291392.7887  0.0200 -3.6118 3  482.0577111 -71510 303552233      552134        syn-C2H3C(O)NH2, v=0
  291392.7887  0.0200 -3.6118 3  482.0577111 -71510 303552234      552135        syn-C2H3C(O)NH2, v=0
  291434.6359  0.0200 -3.9447 3  670.7651143 -71510 303711358      711259        syn-C2H3C(O)NH2, v=0
  291451.5154  0.0023 -3.9446 3  670.7652143  71510 303711458      711359        syn-C2H3C(O)NH2, v=0
  291478.5166  0.0009 -5.2163 3  228.4412 79  71510 303391426      381425        syn-C2H3C(O)NH2, v=0
  291502.1920  0.0009 -5.2163 3  228.4420 79  71510 303391425      381424        syn-C2H3C(O)NH2, v=0
  291507.2331  0.0029 -6.4813 3  142.9368 59  71510 303291415      301120        syn-C2H3C(O)NH2, v=0
  291531.0144  0.0145 -4.3692 3  946.0687167  71510 303831865      831766        syn-C2H3C(O)NH2, v=0
  291545.6742  0.0030 -6.1713 3  401.2011103  71510 303511933      521636        syn-C2H3C(O)NH2, v=0
  291555.2738  0.0026 -6.4227 3  495.4994 81  71510 3034036 4      3936 3        syn-C2H3C(O)NH2, v=0
  291555.2738  0.0026 -6.4227 3  495.4994 81  71510 3034036 5      3936 4        syn-C2H3C(O)NH2, v=0
  291579.3529  0.0200 -3.3239 3   83.1581 49 -71510 30324 916      23 815        syn-C2H3C(O)NH2, v=0
  291594.1220  0.0114 -4.9040 3  857.7957155  71510 303772355      762452        syn-C2H3C(O)NH2, v=0
  291595.2220  0.0239 -4.5827 3 1072.4483177  71510 303882168      882069        syn-C2H3C(O)NH2, v=0
  291647.4643  0.0040 -4.1715 3  848.0649153  71510 303762453      762354        syn-C2H3C(O)NH2, v=0
  291652.3984  0.0024 -6.2964 3  478.7772 81  71510 3034035 5      3935 4        syn-C2H3C(O)NH2, v=0
  291652.3984  0.0024 -6.2964 3  478.7772 81  71510 3034035 6      3935 5        syn-C2H3C(O)NH2, v=0
  291755.1913  0.0022 -6.1889 3  462.5273 81  71510 3034034 6      3934 5        syn-C2H3C(O)NH2, v=0
  291755.1913  0.0022 -6.1889 3  462.5273 81  71510 3034034 7      3934 6        syn-C2H3C(O)NH2, v=0
  291772.7554  0.0200 -3.7617 3  336.6992109 -71510 30354 450      54 351        syn-C2H3C(O)NH2, v=0
  291772.7554  0.0200 -3.7617 3  336.6992109 -71510 30354 550      54 451        syn-C2H3C(O)NH2, v=0
  291857.7341  0.0200 -3.7314 3  466.2083123 -71510 30361 853      61 754        syn-C2H3C(O)NH2, v=0
  291857.7341  0.0200 -3.7314 3  466.2083123 -71510 30361 953      61 854        syn-C2H3C(O)NH2, v=0
  291864.4506  0.0020 -6.0947 3  446.7499 81  71510 3034033 7      3933 6        syn-C2H3C(O)NH2, v=0
  291864.4506  0.0020 -6.0947 3  446.7499 81  71510 3034033 8      3933 7        syn-C2H3C(O)NH2, v=0
  291974.1030  0.0015 -3.8887 3  675.6237135  71510 303672344      672245        syn-C2H3C(O)NH2, v=0
  291981.1037  0.0019 -6.0105 3  431.4455 81  71510 3034032 8      3932 7        syn-C2H3C(O)NH2, v=0
  291981.1037  0.0019 -6.0105 3  431.4455 81  71510 3034032 9      3932 8        syn-C2H3C(O)NH2, v=0
  291999.6424  0.0015 -3.8886 3  675.6228135  71510 303672345      672246        syn-C2H3C(O)NH2, v=0
  292019.5045  0.0200 -3.3211 3  213.0145 81 -71510 30340 832      39 931        syn-C2H3C(O)NH2, v=0
  292032.1249  0.0069 -4.1742 3  827.0124157  71510 303781662      781563        syn-C2H3C(O)NH2, v=0
  292063.4959  0.0010 -5.1304 3  203.0959 79  71510 30339 831      38 830        syn-C2H3C(O)NH2, v=0
  292106.2333  0.0018 -5.9342 3  416.6145 81  71510 3034031 9      3931 8        syn-C2H3C(O)NH2, v=0
  292106.2333  0.0018 -5.9342 3  416.6145 81  71510 303403110      3931 9        syn-C2H3C(O)NH2, v=0
  292137.0999  0.0353 -5.2910 3 1468.6188205  71510 303A22776      A22677        syn-C2H3C(O)NH2, v=0
  292165.8331  0.0060 -5.8994 3   52.8248 43  71510 30321 417      21 120        syn-C2H3C(O)NH2, v=0
  292167.4404  0.0029 -5.6792 3   22.0932 29  71510 30314 5 9      13 212        syn-C2H3C(O)NH2, v=0
  292241.1110  0.0017 -5.8643 3  402.2575 81  71510 303403010      3930 9        syn-C2H3C(O)NH2, v=0
  292241.1110  0.0017 -5.8643 3  402.2575 81  71510 303403011      393010        syn-C2H3C(O)NH2, v=0
  292271.8806  0.0071 -6.3869 3  506.0657133  71510 30366 561      67 464        syn-C2H3C(O)NH2, v=0
  292271.8806  0.0071 -6.3869 3  506.0657133  71510 30366 661      67 364        syn-C2H3C(O)NH2, v=0
  292281.5397  0.0137 -6.4952 3  753.4353159  71510 30379 871      80 774        syn-C2H3C(O)NH2, v=0
  292281.5397  0.0137 -6.4952 3  753.4353159  71510 30379 971      80 674        syn-C2H3C(O)NH2, v=0
  292315.4074  0.0068 -4.1734 3  827.0137157  71510 303781762      781663        syn-C2H3C(O)NH2, v=0
  292364.2097  0.0200 -3.5932 3  468.4085109 -71510 303542232      542133        syn-C2H3C(O)NH2, v=0
  292364.2097  0.0200 -3.5932 3  468.4085109 -71510 303542233      542134        syn-C2H3C(O)NH2, v=0
  292387.2385  0.0016 -5.7998 3  388.3751 81  71510 303402911      392910        syn-C2H3C(O)NH2, v=0
  292387.2385  0.0016 -5.7998 3  388.3751 81  71510 303402912      392911        syn-C2H3C(O)NH2, v=0
  292392.7478  0.0056 -6.4865 3   40.3060 39  71510 30319 316      19 019        syn-C2H3C(O)NH2, v=0
  292415.5912  0.0020 -3.8873 3  627.4003139  71510 303691257      691158        syn-C2H3C(O)NH2, v=0
  292420.5267  0.0200 -3.8873 3  627.4003139 -71510 303691357      691258        syn-C2H3C(O)NH2, v=0
  292512.9721  0.0028 -5.4704 3   60.8046 41  71510 30320 911      20 614        syn-C2H3C(O)NH2, v=0
  292546.4007  0.0015 -5.7399 3  374.9678 81  71510 303402812      392811        syn-C2H3C(O)NH2, v=0
  292546.4007  0.0015 -5.7399 3  374.9678 81  71510 303402813      392812        syn-C2H3C(O)NH2, v=0
  292587.4713  0.0200 -3.7579 3  504.6470127 -71510 30363 954      63 855        syn-C2H3C(O)NH2, v=0
  292587.4713  0.0200 -3.7579 3  504.6470127 -71510 303631054      63 955        syn-C2H3C(O)NH2, v=0
  292600.8432  0.0010 -5.1489 3  202.9678 77  71510 303381127      371126        syn-C2H3C(O)NH2, v=0
  292616.4295  0.0024 -6.2242 3  232.2662 77  71510 303381623      391326        syn-C2H3C(O)NH2, v=0
  292643.4345  0.0117 -4.9008 3  857.7932155  71510 303772354      762453        syn-C2H3C(O)NH2, v=0
  292658.0488  0.0031 -4.6889 3   35.8400 37  71510 30318 415      17 116        syn-C2H3C(O)NH2, v=0
  292678.7984  0.0044 -6.4154 3  264.2768 87  71510 303431331      44 836        syn-C2H3C(O)NH2, v=0
  292720.7339  0.0014 -5.6842 3  362.0365 81  71510 303402713      392712        syn-C2H3C(O)NH2, v=0
  292720.7339  0.0014 -5.6842 3  362.0365 81  71510 303402714      392713        syn-C2H3C(O)NH2, v=0
  292728.7191  0.0149 -4.7248 3 1163.5126181  71510 303902665      902566        syn-C2H3C(O)NH2, v=0
  292732.0470  0.0447 -4.9619 3 1287.6771193  71510 303962473      962374        syn-C2H3C(O)NH2, v=0
  292804.6249  0.0136 -4.3655 3  946.0756167  71510 303831965      831866        syn-C2H3C(O)NH2, v=0
  292902.3122  0.0200 -3.8367 3  585.2524135 -71510 303671156      671057        syn-C2H3C(O)NH2, v=0
  292903.6805  0.0018 -3.8367 3  585.2524135  71510 303671256      671157        syn-C2H3C(O)NH2, v=0
  292912.8148  0.0013 -5.6320 3  349.5821 81  71510 303402614      392613        syn-C2H3C(O)NH2, v=0
  292912.8148  0.0013 -5.6320 3  349.5821 81  71510 303402615      392614        syn-C2H3C(O)NH2, v=0
  292946.3022  0.0017 -3.7933 3  544.3314131  71510 303651055      65 956        syn-C2H3C(O)NH2, v=0
  292946.6512  0.0017 -3.7933 3  544.3314131  71510 303651155      651056        syn-C2H3C(O)NH2, v=0
  292962.7644  0.0009 -5.1908 3  222.4781 79  71510 303391327      381326        syn-C2H3C(O)NH2, v=0
  292964.1647  0.0083 -4.4303 3  999.2194167  71510 303832559      832460        syn-C2H3C(O)NH2, v=0
  292980.9349  0.0042 -4.3430 3  544.7686125  71510 303621745      611844        syn-C2H3C(O)NH2, v=0
  293000.0543  0.0034 -3.9458 3  283.2260103  71510 30351 249      51 150        syn-C2H3C(O)NH2, v=0
  293000.0543  0.0034 -3.9458 3  283.2260103  71510 30351 349      51 250        syn-C2H3C(O)NH2, v=0
  293050.3953  0.0061 -4.6146 3  701.0542141  71510 303702050      692149        syn-C2H3C(O)NH2, v=0
  293094.0040  0.0024 -6.2229 3  232.2503 77  71510 303381622      391327        syn-C2H3C(O)NH2, v=0
  293125.7777  0.0013 -5.5831 3  337.6056 81  71510 303402515      392514        syn-C2H3C(O)NH2, v=0
  293125.7777  0.0013 -5.5831 3  337.6056 81  71510 303402516      392515        syn-C2H3C(O)NH2, v=0
  293132.0624  0.0029 -6.1670 3  401.1482103  71510 303511932      521637        syn-C2H3C(O)NH2, v=0
  293185.0170  0.0009 -5.1901 3  222.4866 79  71510 303391326      381325        syn-C2H3C(O)NH2, v=0
  293235.9157  0.0200 -3.3202 3   83.1116 49 -71510 30324 915      23 816        syn-C2H3C(O)NH2, v=0
  293251.4562  0.0092 -4.8106 3  809.9949151  71510 303752254      742351        syn-C2H3C(O)NH2, v=0
  293274.4833  0.0200 -3.5757 3  455.0196107 -71510 303532231      532132        syn-C2H3C(O)NH2, v=0
  293274.4833  0.0200 -3.5757 3  455.0196107 -71510 303532232      532133        syn-C2H3C(O)NH2, v=0
  293318.7251  0.0210 -5.0487 3 1340.9137195  71510 303972771      972672        syn-C2H3C(O)NH2, v=0
  293333.5731  0.0200 -3.0589 3   62.0764 29 -71510 3031414 0      1313 1        syn-C2H3C(O)NH2, v=0
  293333.5731  0.0200 -3.0589 3   62.0764 29 -71510 3031414 1      1313 0        syn-C2H3C(O)NH2, v=0
  293363.4717  0.0012 -5.5372 3  326.1083 81  71510 303402416      392415        syn-C2H3C(O)NH2, v=0
  293363.4717  0.0012 -5.5372 3  326.1083 81  71510 303402417      392416        syn-C2H3C(O)NH2, v=0
  293398.9264  0.2561 -5.7877 3 1723.1419223  71510 303B12784      B12685        syn-C2H3C(O)NH2, v=0
  293630.6747  0.0012 -5.4939 3  315.0918 81  71510 303402317      392316        syn-C2H3C(O)NH2, v=0
  293630.6747  0.0012 -5.4939 3  315.0918 81  71510 303402318      392317        syn-C2H3C(O)NH2, v=0
  293669.3928  0.0076 -6.4521 3  438.4485125  71510 30362 458      63 361        syn-C2H3C(O)NH2, v=0
  293669.3928  0.0076 -6.4521 3  438.4485125  71510 30362 558      63 261        syn-C2H3C(O)NH2, v=0
  293746.3823  0.0014 -3.8590 3  658.8398133  71510 303662343      662244        syn-C2H3C(O)NH2, v=0
  293758.1770  0.0200 -3.0972 3   63.2439 33 -71510 3031613 3      1512 4        syn-C2H3C(O)NH2, v=0
  293758.1770  0.0200 -3.0972 3   63.2439 33 -71510 3031613 4      1512 3        syn-C2H3C(O)NH2, v=0
  293760.2277  0.0014 -3.8590 3  658.8393133  71510 303662344      662245        syn-C2H3C(O)NH2, v=0
  293782.1666  0.1107 -5.2185 3 1422.3181203  71510 303A12477      A12378        syn-C2H3C(O)NH2, v=0
  293785.8635  0.0200 -3.7303 3  370.6755113 -71510 30356 551      56 452        syn-C2H3C(O)NH2, v=0
  293785.8635  0.0200 -3.7303 3  370.6755113 -71510 30356 651      56 552        syn-C2H3C(O)NH2, v=0
  293813.2256  0.0011 -5.0825 3  232.2048 95  71510 30347 146      46 145        syn-C2H3C(O)NH2, v=0
  293813.2256  0.0011 -2.9058 3  232.2048 95  71510 30347 146      46 245        syn-C2H3C(O)NH2, v=0
  293813.2256  0.0011 -2.9058 3  232.2048 95  71510 30347 246      46 145        syn-C2H3C(O)NH2, v=0
  293813.2256  0.0011 -5.0825 3  232.2048 95  71510 30347 246      46 245        syn-C2H3C(O)NH2, v=0
  293813.4322  0.0009 -5.0932 3  231.1688 93  71510 30346 244      45 243        syn-C2H3C(O)NH2, v=0
  293813.4322  0.0009 -2.9415 3  231.1688 93  71510 30346 244      45 343        syn-C2H3C(O)NH2, v=0
  293813.4322  0.0009 -2.9415 3  231.1688 93  71510 30346 344      45 243        syn-C2H3C(O)NH2, v=0
  293813.4322  0.0009 -5.0932 3  231.1688 93  71510 30346 344      45 343        syn-C2H3C(O)NH2, v=0
  293822.2646  0.0012 -5.0708 3  232.7281 97  71510 30348 048      47 047        syn-C2H3C(O)NH2, v=0
  293822.2692  0.0200 -2.8723 3  232.7281 97 -71510 30348 048      47 147        syn-C2H3C(O)NH2, v=0
  293822.2692  0.0200 -2.8723 3  232.7281 97 -71510 30348 148      47 047        syn-C2H3C(O)NH2, v=0
  293822.2646  0.0012 -5.0708 3  232.7281 97  71510 30348 148      47 147        syn-C2H3C(O)NH2, v=0
  293835.4503  0.0200 -2.9802 3  229.6079 91 -71510 30345 342      44 441        syn-C2H3C(O)NH2, v=0
  293835.4589  0.0009 -5.1030 3  229.6079 91  71510 30345 442      44 441        syn-C2H3C(O)NH2, v=0
  293835.4590  0.0009 -5.1030 3  229.6079 91  71510 30345 342      44 341        syn-C2H3C(O)NH2, v=0
  293835.4503  0.0200 -2.9802 3  229.6079 91 -71510 30345 442      44 341        syn-C2H3C(O)NH2, v=0
  293848.5531  0.0008 -5.1384 3  207.8290 79  71510 303391030      381029        syn-C2H3C(O)NH2, v=0
  293897.7698  0.0517 -5.2233 3 1432.7979203  71510 303A12676      A12577        syn-C2H3C(O)NH2, v=0
  293900.3871  0.0200 -3.0230 3  227.5053 89 -71510 30344 440      43 539        syn-C2H3C(O)NH2, v=0
  293900.3636  0.0008 -5.1117 3  227.5053 89  71510 30344 540      43 539        syn-C2H3C(O)NH2, v=0
  293900.3710  0.0008 -5.1117 3  227.5053 89  71510 30344 440      43 439        syn-C2H3C(O)NH2, v=0
  293900.3871  0.0200 -3.0230 3  227.5053 89 -71510 30344 540      43 439        syn-C2H3C(O)NH2, v=0
  293912.1093  0.0200 -4.1345 3  828.8988151 -71510 303752451      752352        syn-C2H3C(O)NH2, v=0
  293933.3909  0.0011 -5.4532 3  304.5579 81  71510 303402218      392217        syn-C2H3C(O)NH2, v=0
  293933.3909  0.0011 -5.4532 3  304.5579 81  71510 303402219      392218        syn-C2H3C(O)NH2, v=0
  293973.7930  0.0044 -4.5851 3  650.6830137  71510 303681851      671948        syn-C2H3C(O)NH2, v=0
  294033.3237  0.0772 -6.2840 3 1568.9571205  71510 303A23568      A13665        syn-C2H3C(O)NH2, v=0
  294033.3347  0.0772 -6.2840 3 1568.9571205  71510 303A23567      A13666        syn-C2H3C(O)NH2, v=0
  294038.1698  0.0200 -3.2381 3   75.7548 45 -71510 303221013      21 912        syn-C2H3C(O)NH2, v=0
  294044.8886  0.0200 -3.0717 3  224.8370 87 -71510 30343 538      42 637        syn-C2H3C(O)NH2, v=0
  294045.2395  0.0008 -5.1191 3  224.8370 87  71510 30343 638      42 637        syn-C2H3C(O)NH2, v=0
  294045.5422  0.0008 -5.1191 3  224.8370 87  71510 30343 538      42 537        syn-C2H3C(O)NH2, v=0
  294045.9169  0.0200 -3.0717 3  224.8370 87 -71510 30343 638      42 537        syn-C2H3C(O)NH2, v=0
  294051.3681  0.0683 -6.1533 3 1503.4221201  71510 303A03467      993564        syn-C2H3C(O)NH2, v=0
  294051.4003  0.0683 -6.1533 3 1503.4221201  71510 303A03466      993565        syn-C2H3C(O)NH2, v=0
  294066.0350  0.0010 -3.2380 3   75.7540 45  71510 303221012      21 913        syn-C2H3C(O)NH2, v=0
  294071.6238  0.0033 -6.2071 3  463.0734111  71510 303552036      561739        syn-C2H3C(O)NH2, v=0
  294081.7035  0.0869 -6.4177 3 1635.9181209  71510 303A43669      A33766        syn-C2H3C(O)NH2, v=0
  294081.7072  0.0869 -6.4177 3 1635.9181209  71510 303A43668      A33767        syn-C2H3C(O)NH2, v=0
  294089.1244  0.0200 -3.4509 3  227.6586 83 -71510 30341 932      401031        syn-C2H3C(O)NH2, v=0
  294127.2076  0.0200 -3.1368 3   65.8904 37 -71510 3031812 7      1711 6        syn-C2H3C(O)NH2, v=0
  294127.2076  0.0200 -3.1368 3   65.8904 37 -71510 3031812 6      1711 7        syn-C2H3C(O)NH2, v=0
  294127.2892  0.0010 -3.5592 3  441.8901105  71510 303522230      522131        syn-C2H3C(O)NH2, v=0
  294127.2974  0.0010 -3.5592 3  441.8901105  71510 303522231      522132        syn-C2H3C(O)NH2, v=0
  294144.5374  0.0602 -6.0254 3 1439.3146197  71510 303983366      973463        syn-C2H3C(O)NH2, v=0
  294144.6311  0.0602 -6.0254 3 1439.3146197  71510 303983365      973464        syn-C2H3C(O)NH2, v=0
  294156.6432  0.0210 -4.4884 3 1018.9863173  71510 303861967      861868        syn-C2H3C(O)NH2, v=0
  294169.9561  0.0044 -4.5810 3  675.3986139  71510 303691951      682048        syn-C2H3C(O)NH2, v=0
  294209.5953  0.0035 -4.1336 3  828.8874151  71510 303752452      752353        syn-C2H3C(O)NH2, v=0
  294237.7478  0.0200 -3.3760 3  184.1164 75 -71510 30337 929      36 828        syn-C2H3C(O)NH2, v=0
  294279.2732  0.0011 -5.4149 3  294.5089 81  71510 303402119      392118        syn-C2H3C(O)NH2, v=0
  294279.2732  0.0011 -5.4149 3  294.5089 81  71510 303402120      392119        syn-C2H3C(O)NH2, v=0
  294323.2611  0.0528 -5.9005 3 1376.6363193  71510 303963265      953362        syn-C2H3C(O)NH2, v=0
  294323.5302  0.0528 -5.9005 3 1376.6363193  71510 303963264      953363        syn-C2H3C(O)NH2, v=0
  294323.9615  0.0200 -3.1816 3   70.0433 41 -71510 303201110      1910 9        syn-C2H3C(O)NH2, v=0
  294323.9615  0.0200 -3.1816 3   70.0433 41 -71510 3032011 9      191010        syn-C2H3C(O)NH2, v=0
  294327.4604  0.0200 -3.1293 3  221.5676 85 -71510 30342 636      41 735        syn-C2H3C(O)NH2, v=0
  294337.9631  0.0008 -5.1249 3  221.5676 85  71510 30342 736      41 735        syn-C2H3C(O)NH2, v=0
  294346.5964  0.0008 -5.1248 3  221.5669 85  71510 30342 636      41 635        syn-C2H3C(O)NH2, v=0
  294357.0957  0.0200 -3.1292 3  221.5669 85 -71510 30342 736      41 635        syn-C2H3C(O)NH2, v=0
  294463.9034  0.0314 -4.7126 3 1149.7317183  71510 303912270      912171        syn-C2H3C(O)NH2, v=0
  294515.1772  0.0084 -4.3909 3  978.2329165  71510 303822557      822458        syn-C2H3C(O)NH2, v=0
  294600.1337  0.0462 -5.7784 3 1315.3888189  71510 303943164      933261        syn-C2H3C(O)NH2, v=0
  294600.8974  0.0462 -5.7784 3 1315.3888189  71510 303943163      933262        syn-C2H3C(O)NH2, v=0
  294607.3292  0.0098 -6.4317 3  671.2892151  71510 30375 768      76 671        syn-C2H3C(O)NH2, v=0
  294607.3292  0.0098 -6.4317 3  671.2892151  71510 30375 868      76 571        syn-C2H3C(O)NH2, v=0
  294616.8547  0.0009 -5.1668 3  217.1010 79  71510 303391228      381227        syn-C2H3C(O)NH2, v=0
  294638.7861  0.0200 -3.2030 3  217.6430 83 -71510 30341 734      40 833        syn-C2H3C(O)NH2, v=0
  294678.2406  0.0010 -5.3787 3  284.9478 81  71510 303402020      392019        syn-C2H3C(O)NH2, v=0
  294678.2406  0.0010 -5.3787 3  284.9478 81  71510 303402021      392020        syn-C2H3C(O)NH2, v=0
  294713.5075  0.0200 -3.4027 3  174.8782 73 -71510 30336 928      35 827        syn-C2H3C(O)NH2, v=0
  294742.4786  0.0073 -4.7228 3  763.6537147  71510 303732153      722250        syn-C2H3C(O)NH2, v=0
  294766.7905  0.0049 -4.0968 3  779.4422153  71510 303761561      761462        syn-C2H3C(O)NH2, v=0
  294864.5673  0.0049 -4.0965 3  779.4426153  71510 303761661      761562        syn-C2H3C(O)NH2, v=0
  294869.2504  0.0009 -5.1285 3  217.6430 83  71510 30341 834      40 833        syn-C2H3C(O)NH2, v=0
  294890.6517  0.0449 -5.3348 3 1494.8563207  71510 303A32777      A32678        syn-C2H3C(O)NH2, v=0
  294926.0760  0.0200 -3.5437 3  429.0194103 -71510 303512229      512130        syn-C2H3C(O)NH2, v=0
  294926.0760  0.0200 -3.5437 3  429.0194103 -71510 303512230      512131        syn-C2H3C(O)NH2, v=0
  294944.0892  0.1527 -5.6582 3 1661.6150217  71510 303A83078      A82979        syn-C2H3C(O)NH2, v=0
  294946.3996  0.4109 -6.2178 3 1949.2947237  71510 303B82989      B82890        syn-C2H3C(O)NH2, v=0
  294984.4510  0.0053 -6.4817 3   40.3060 39  71510 30319 416      19 119        syn-C2H3C(O)NH2, v=0
  294990.4551  0.0402 -5.6592 3 1255.5741185  71510 303923063      913160        syn-C2H3C(O)NH2, v=0
  294992.5943  0.0402 -5.6592 3 1255.5741185  71510 303923062      913161        syn-C2H3C(O)NH2, v=0
  295027.8759  0.0177 -4.6401 3 1118.1191177  71510 303882662      882563        syn-C2H3C(O)NH2, v=0
  295035.2085  0.0009 -5.1280 3  217.6297 83  71510 30341 734      40 733        syn-C2H3C(O)NH2, v=0
  295078.0402  0.0041 -3.9355 3   68.1826 47  71510 30323 617      22 518        syn-C2H3C(O)NH2, v=0
  295143.0514  0.0200 -3.3478 3  193.5230 77 -71510 30338 930      37 829        syn-C2H3C(O)NH2, v=0
  295143.4101  0.0010 -5.3446 3  275.8785 81  71510 303401921      391920        syn-C2H3C(O)NH2, v=0
  295143.4101  0.0010 -5.3446 3  275.8785 81  71510 303401922      391921        syn-C2H3C(O)NH2, v=0
  295265.6964  0.0200 -3.2010 3  217.6297 83 -71510 30341 834      40 733        syn-C2H3C(O)NH2, v=0
  295369.5138  0.0009 -5.1306 3  213.0145 81  71510 30340 932      39 931        syn-C2H3C(O)NH2, v=0
  295387.5341  0.0036 -4.9349 3  106.7200 55  71510 303271017      27 720        syn-C2H3C(O)NH2, v=0
  295403.3072  0.0013 -3.8304 3  642.3259131  71510 303652342      652243        syn-C2H3C(O)NH2, v=0
  295410.7007  0.0013 -3.8304 3  642.3256131  71510 303652343      652244        syn-C2H3C(O)NH2, v=0
  295443.3338  0.0057 -4.6439 3  718.7824143  71510 303712052      702149        syn-C2H3C(O)NH2, v=0
  295479.3339  0.0008 -5.1476 3  212.2827 79  71510 303391129      381128        syn-C2H3C(O)NH2, v=0
  295512.8439  0.0348 -5.5429 3 1197.1938181  71510 303902962      893059        syn-C2H3C(O)NH2, v=0
  295518.1047  0.0200 -3.7199 3  405.9318117 -71510 30358 652      58 553        syn-C2H3C(O)NH2, v=0
  295518.1047  0.0200 -3.7199 3  405.9318117 -71510 30358 752      58 653        syn-C2H3C(O)NH2, v=0
  295518.7497  0.0348 -5.5429 3 1197.1938181  71510 303902961      893060        syn-C2H3C(O)NH2, v=0
  295548.6875  0.0200 -3.8300 3  315.2239107 -71510 30353 350      53 251        syn-C2H3C(O)NH2, v=0
  295548.6875  0.0200 -3.8300 3  315.2239107 -71510 30353 450      53 351        syn-C2H3C(O)NH2, v=0
  295561.1401  0.3002 -6.1992 3 1943.7414235  71510 303B73285      B73186        syn-C2H3C(O)NH2, v=0
  295578.0471  0.0069 -4.7185 3  685.9921141  71510 303701853      691950        syn-C2H3C(O)NH2, v=0
  295674.0212  0.0200 -3.5293 3  416.4066101 -71510 303502228      502129        syn-C2H3C(O)NH2, v=0
  295674.0212  0.0200 -3.5293 3  416.4066101 -71510 303502229      502130        syn-C2H3C(O)NH2, v=0
  295692.5599  0.0010 -5.3123 3  267.3059 81  71510 303401823      391822        syn-C2H3C(O)NH2, v=0
  295692.5609  0.0010 -5.3123 3  267.3059 81  71510 303401822      391821        syn-C2H3C(O)NH2, v=0
  295769.5738  0.0099 -4.8028 3  809.9883151  71510 303752253      742352        syn-C2H3C(O)NH2, v=0
  295830.1547  0.0042 -5.2259 3   75.9452 49  71510 30324 718      24 421        syn-C2H3C(O)NH2, v=0
  295845.4328  0.0213 -4.9971 3 1316.1318193  71510 303962770      962671        syn-C2H3C(O)NH2, v=0
  295925.1234  0.0531 -5.1085 3 1371.8681199  71510 303992575      992476        syn-C2H3C(O)NH2, v=0
  295949.4468  0.0033 -6.2019 3  463.0108111  71510 303552035      561740        syn-C2H3C(O)NH2, v=0
  295960.6644  0.0038 -6.3953 3  280.9151 89  71510 303441431      45 936        syn-C2H3C(O)NH2, v=0
  295993.5379  0.0104 -4.2778 3  895.5416163  71510 303811764      811665        syn-C2H3C(O)NH2, v=0
  296037.3291  0.0141 -4.6759 3 1140.5872179  71510 303892664      892565        syn-C2H3C(O)NH2, v=0
  296074.9066  0.0075 -4.3864 3  978.1720165  71510 303822558      822459        syn-C2H3C(O)NH2, v=0
  296091.0209  0.0037 -6.2617 3  529.3987119  71510 303592139      601842        syn-C2H3C(O)NH2, v=0
  296097.4822  0.0298 -4.6161 3 1094.4984179  71510 303892069      891970        syn-C2H3C(O)NH2, v=0
  296099.4358  0.0048 -6.4819 3  237.5095 83  71510 303411230      42 735        syn-C2H3C(O)NH2, v=0
  296176.0798  0.0009 -5.1623 3  217.1739 79  71510 303391227      381226        syn-C2H3C(O)NH2, v=0
  296189.7752  0.0300 -5.4294 3 1140.2501177  71510 303882861      872958        syn-C2H3C(O)NH2, v=0
  296205.8240  0.0301 -5.4293 3 1140.2501177  71510 303882860      872959        syn-C2H3C(O)NH2, v=0
  296208.1150  0.0190 -4.4826 3 1018.9982173  71510 303862067      861968        syn-C2H3C(O)NH2, v=0
  296250.3951  0.0041 -4.1933 3  262.7363101  71510 30350 149      50 050        syn-C2H3C(O)NH2, v=0
  296250.3951  0.0041 -4.1933 3  262.7363101  71510 30350 249      50 150        syn-C2H3C(O)NH2, v=0
  296266.6502  0.0806 -5.0534 3 1336.5173197  71510 303982375      982276        syn-C2H3C(O)NH2, v=0
  296350.5441  0.0009 -5.2819 3  259.2367 81  71510 303401724      391723        syn-C2H3C(O)NH2, v=0
  296350.5633  0.0009 -5.2819 3  259.2367 81  71510 303401723      391722        syn-C2H3C(O)NH2, v=0
  296374.0083  0.0200 -3.5159 3  404.0511 99 -71510 303492227      492128        syn-C2H3C(O)NH2, v=0
  296374.0083  0.0200 -3.5159 3  404.0511 99 -71510 303492228      492129        syn-C2H3C(O)NH2, v=0
  296392.7217  0.0055 -4.6412 3  668.1655139  71510 303691852      681949        syn-C2H3C(O)NH2, v=0
  296449.6104  0.0200 -4.0974 3  809.9949149 -71510 303742450      742351        syn-C2H3C(O)NH2, v=0
  296451.9613  0.0025 -3.4253 3  165.8181 71  71510 30335 927      34 826        syn-C2H3C(O)NH2, v=0
  296476.2909  0.0102 -4.2764 3  895.5439163  71510 303811864      811765        syn-C2H3C(O)NH2, v=0
  296543.3380  0.0019 -3.5851 3  253.2002 87  71510 303431033      421132        syn-C2H3C(O)NH2, v=0
  296577.4419  0.0031 -5.0496 3   85.4868 51  71510 30325 818      25 521        syn-C2H3C(O)NH2, v=0
  296622.6802  0.0200 -4.0969 3  809.9883149 -71510 303742451      742352        syn-C2H3C(O)NH2, v=0
  296634.0846  0.0079 -6.3994 3  593.6435143  71510 30371 665      72 568        syn-C2H3C(O)NH2, v=0
  296634.0846  0.0079 -6.3994 3  593.6435143  71510 30371 765      72 468        syn-C2H3C(O)NH2, v=0
  296754.5974  0.0200 -4.0258 3  733.0566149 -71510 303741460      741361        syn-C2H3C(O)NH2, v=0
  296786.4268  0.0200 -4.0257 3  733.0567149 -71510 303741560      741461        syn-C2H3C(O)NH2, v=0
  296812.0810  0.0041 -6.3867 3  292.2228 91  71510 303451432      46 937        syn-C2H3C(O)NH2, v=0
  296954.8155  0.0012 -3.8028 3  626.0806129  71510 303642341      642242        syn-C2H3C(O)NH2, v=0
  296954.8652  0.0015 -3.7251 3  442.4600121  71510 30360 753      60 654        syn-C2H3C(O)NH2, v=0
  296954.8671  0.0015 -3.7251 3  442.4600121  71510 30360 853      60 754        syn-C2H3C(O)NH2, v=0
  296958.7238  0.0200 -3.8028 3  626.0805129 -71510 303642342      642243        syn-C2H3C(O)NH2, v=0
  297028.8106  0.0200 -3.5036 3  391.9522 97 -71510 303482226      482127        syn-C2H3C(O)NH2, v=0
  297028.8106  0.0200 -3.5036 3  391.9522 97 -71510 303482227      482128        syn-C2H3C(O)NH2, v=0
  297047.5876  0.0257 -5.3187 3 1084.7450173  71510 303862760      852857        syn-C2H3C(O)NH2, v=0
  297090.4445  0.0258 -5.3186 3 1084.7449173  71510 303862759      852858        syn-C2H3C(O)NH2, v=0
  297153.4610  0.0009 -5.2530 3  251.6801 81  71510 303401625      391624        syn-C2H3C(O)NH2, v=0
  297153.7699  0.0009 -5.2530 3  251.6801 81  71510 303401624      391623        syn-C2H3C(O)NH2, v=0
  297215.9076  0.0418 -4.7527 3 1172.5969185  71510 303922171      922072        syn-C2H3C(O)NH2, v=0
  297216.8605  0.0401 -4.8492 3 1229.5995189  71510 303942372      942273        syn-C2H3C(O)NH2, v=0
  297232.5833  0.0046 -4.4265 3  600.0899131  71510 303651847      641946        syn-C2H3C(O)NH2, v=0
  297259.4897  0.0200 -3.3271 3   89.2012 51 -71510 30325 917      24 816        syn-C2H3C(O)NH2, v=0
  297266.8285  0.0009 -5.1103 3  196.7240 77  71510 30338 929      37 928        syn-C2H3C(O)NH2, v=0
  297308.1876  0.0009 -5.1243 3  212.8381 81  71510 30340 832      39 831        syn-C2H3C(O)NH2, v=0
  297339.7670  0.0582 -4.8983 3 1253.2732191  71510 303952273      952174        syn-C2H3C(O)NH2, v=0
  297352.1711  0.0200 -3.3200 3  203.0959 79 -71510 30339 931      38 830        syn-C2H3C(O)NH2, v=0
  297365.3760  0.0031 -3.8437 3  320.1207 97  71510 303481236      471335        syn-C2H3C(O)NH2, v=0
  297441.7976  0.0024 -6.1791 3  279.7434 85  71510 303421726      431429        syn-C2H3C(O)NH2, v=0
  297632.4487  0.0044 -6.3338 3  600.1747127  71510 303632242      641945        syn-C2H3C(O)NH2, v=0
  297640.9357  0.0200 -3.4925 3  380.1092 95 -71510 303472225      472126        syn-C2H3C(O)NH2, v=0
  297640.9357  0.0200 -3.4925 3  380.1092 95 -71510 303472226      472127        syn-C2H3C(O)NH2, v=0
  297730.0763  0.0028 -4.4220 3   42.8547 39  71510 30319 515      18 216        syn-C2H3C(O)NH2, v=0
  297742.6879  0.0036 -6.4150 3  269.7915 87  71510 303431430      44 935        syn-C2H3C(O)NH2, v=0
  297831.8113  0.0016 -4.3697 3   45.4621 39  71510 30319 614      18 315        syn-C2H3C(O)NH2, v=0
  297846.0180  0.0200 -3.7686 3  348.5178111 -71510 30355 451      55 352        syn-C2H3C(O)NH2, v=0
  297846.0180  0.0200 -3.7686 3  348.5178111 -71510 30355 551      55 452        syn-C2H3C(O)NH2, v=0
  297941.2751  0.0651 -5.6229 3 1028.1603173  71510 303862166      852263        syn-C2H3C(O)NH2, v=0
  297985.5685  0.0068 -5.2387 3   87.6806 53  71510 30326 620      26 323        syn-C2H3C(O)NH2, v=0
  298010.8183  0.0056 -4.6292 3  158.4131 69  71510 30334 925      34 628        syn-C2H3C(O)NH2, v=0
  298048.6860  0.0023 -6.1775 3  279.7231 85  71510 303421725      431430        syn-C2H3C(O)NH2, v=0
  298078.7997  0.0200 -3.7426 3  480.2521125 -71510 30362 854      62 755        syn-C2H3C(O)NH2, v=0
  298078.7997  0.0200 -3.7426 3  480.2521125 -71510 30362 954      62 855        syn-C2H3C(O)NH2, v=0
  298105.3622  0.0072 -4.3464 3  957.4449163  71510 303812556      812457        syn-C2H3C(O)NH2, v=0
  298109.7710  0.0026 -6.3467 3  180.4868 67  71510 303331519      341222        syn-C2H3C(O)NH2, v=0
  298111.2406  0.0314 -4.8629 3 1243.7314187  71510 303932766      932667        syn-C2H3C(O)NH2, v=0
  298114.7717  0.0219 -5.2109 3 1030.6809169  71510 303842659      832756        syn-C2H3C(O)NH2, v=0
  298128.0693  0.0200 -3.9611 3  687.8680145 -71510 303721359      721260        syn-C2H3C(O)NH2, v=0
  298137.8428  0.0200 -3.9611 3  687.8681145 -71510 303721459      721360        syn-C2H3C(O)NH2, v=0
  298155.5532  0.0009 -5.2256 3  244.6494 81  71510 303401526      391525        syn-C2H3C(O)NH2, v=0
  298159.6932  0.0009 -5.2255 3  244.6495 81  71510 303401525      391524        syn-C2H3C(O)NH2, v=0
  298212.8073  0.0200 -3.4825 3  368.5215 93 -71510 303462224      462125        syn-C2H3C(O)NH2, v=0
  298212.8073  0.0200 -3.4825 3  368.5215 93 -71510 303462225      462126        syn-C2H3C(O)NH2, v=0
  298227.0141  0.0220 -5.2106 3 1030.6807169  71510 303842658      832757        syn-C2H3C(O)NH2, v=0
  298287.7527  0.0036 -6.2557 3  529.3255119  71510 303592138      601843        syn-C2H3C(O)NH2, v=0
  298299.7346  0.0026 -6.3462 3  180.4805 67  71510 303331518      341223        syn-C2H3C(O)NH2, v=0
  298345.9387  0.0076 -6.4071 3  520.5047135  71510 30367 562      68 465        syn-C2H3C(O)NH2, v=0
  298345.9387  0.0076 -6.4071 3  520.5047135  71510 30367 662      68 365        syn-C2H3C(O)NH2, v=0
  298400.8034  0.0935 -5.3715 3 1515.4599207  71510 303A32974      A32875        syn-C2H3C(O)NH2, v=0
  298409.3324  0.0200 -3.7762 3  610.1027127 -71510 303632340      632241        syn-C2H3C(O)NH2, v=0
  298411.3476  0.0200 -3.7762 3  610.1026127 -71510 303632341      632242        syn-C2H3C(O)NH2, v=0
  298693.9948  0.0558 -5.3770 3 1521.3057209  71510 303A42778      A42679        syn-C2H3C(O)NH2, v=0
  298721.5217  0.0062 -6.4223 3  675.3986135  71510 303672345      682048        syn-C2H3C(O)NH2, v=0
  298746.6427  0.0200 -3.4738 3  357.1886 91 -71510 303452223      452124        syn-C2H3C(O)NH2, v=0
  298746.6427  0.0200 -3.4738 3  357.1886 91 -71510 303452224      452125        syn-C2H3C(O)NH2, v=0
  298791.6055  0.0028 -4.0615 3  791.3698147  71510 303732449      732350        syn-C2H3C(O)NH2, v=0
  298800.9029  0.0029 -6.4571 3  522.4155 83  71510 3034137 4      4037 3        syn-C2H3C(O)NH2, v=0
  298800.9029  0.0029 -6.4571 3  522.4155 83  71510 3034137 5      4037 4        syn-C2H3C(O)NH2, v=0
  298802.6108  0.0211 -4.9453 3 1291.6210191  71510 303952769      952670        syn-C2H3C(O)NH2, v=0
  298848.0918  0.0026 -5.5904 3   55.6569 39  71510 30319 910      19 613        syn-C2H3C(O)NH2, v=0
  298869.5781  0.0200 -3.7703 3  519.2997129 -71510 30364 955      64 856        syn-C2H3C(O)NH2, v=0
  298869.5781  0.0200 -3.7703 3  519.2997129 -71510 303641055      64 956        syn-C2H3C(O)NH2, v=0
  298890.8119  0.0028 -4.0612 3  791.3661147  71510 303732450      732351        syn-C2H3C(O)NH2, v=0
  298898.7639  0.0026 -6.3297 3  505.2246 83  71510 3034136 5      4036 4        syn-C2H3C(O)NH2, v=0
  298898.7639  0.0026 -6.3297 3  505.2246 83  71510 3034136 6      4036 5        syn-C2H3C(O)NH2, v=0
  298921.1242  0.0293 -5.3921 3 1531.2690209  71510 303A42877      A42778        syn-C2H3C(O)NH2, v=0
  298972.8212  0.0022 -3.9028 3  643.8879141  71510 303701258      701159        syn-C2H3C(O)NH2, v=0
  298975.6234  0.0200 -3.9028 3  643.8879141 -71510 303701358      701259        syn-C2H3C(O)NH2, v=0
  298996.7437  0.0033 -4.3630 3  212.8381 79  71510 303391128      39 831        syn-C2H3C(O)NH2, v=0
  299002.0285  0.0024 -6.2211 3  488.5057 83  71510 3034135 6      4035 5        syn-C2H3C(O)NH2, v=0
  299002.0285  0.0024 -6.2211 3  488.5057 83  71510 3034135 7      4035 6        syn-C2H3C(O)NH2, v=0
  299045.8824  0.0035 -3.9507 3  294.0357105  71510 30352 250      52 151        syn-C2H3C(O)NH2, v=0
  299045.8824  0.0035 -3.9507 3  294.0357105  71510 30352 350      52 251        syn-C2H3C(O)NH2, v=0
  299062.4882  0.0067 -4.3436 3  957.4077163  71510 303812557      812458        syn-C2H3C(O)NH2, v=0
  299087.6000  0.0009 -5.1131 3  199.4560 77  71510 303381028      371027        syn-C2H3C(O)NH2, v=0
  299111.4411  0.0022 -6.1258 3  472.2592 83  71510 3034134 7      4034 6        syn-C2H3C(O)NH2, v=0
  299111.4411  0.0022 -6.1258 3  472.2592 83  71510 3034134 8      4034 7        syn-C2H3C(O)NH2, v=0
  299136.0695  0.0027 -3.4411 3  156.9529 69  71510 30334 926      33 825        syn-C2H3C(O)NH2, v=0
  299226.3167  0.0266 -5.3411 3 1504.6928207  71510 303A32876      A32777        syn-C2H3C(O)NH2, v=0
  299227.8629  0.0020 -6.0404 3  456.4854 83  71510 3034133 8      4033 7        syn-C2H3C(O)NH2, v=0
  299227.8629  0.0020 -6.0404 3  456.4854 83  71510 3034133 9      4033 8        syn-C2H3C(O)NH2, v=0
  299244.5535  0.0200 -3.4662 3  346.1097 89 -71510 303442222      442123        syn-C2H3C(O)NH2, v=0
  299244.5535  0.0200 -3.4662 3  346.1097 89 -71510 303442223      442124        syn-C2H3C(O)NH2, v=0
  299302.8577  0.0200 -3.8068 3  559.5942133 -71510 303661056      66 957        syn-C2H3C(O)NH2, v=0
  299302.8577  0.0200 -3.8068 3  559.5942133 -71510 303661156      661057        syn-C2H3C(O)NH2, v=0
  299306.7059  0.0075 -4.1936 3  846.1736159  71510 303791663      791564        syn-C2H3C(O)NH2, v=0
  299334.9895  0.0257 -4.6071 3 1094.5185179  71510 303892169      892070        syn-C2H3C(O)NH2, v=0
  299345.0221  0.0176 -5.0499 3  805.2613153  71510 303761958      752055        syn-C2H3C(O)NH2, v=0
  299349.2085  0.0020 -3.8512 3  601.1267137  71510 303681157      681058        syn-C2H3C(O)NH2, v=0
  299349.9914  0.0200 -3.8512 3  601.1267137 -71510 303681257      681158        syn-C2H3C(O)NH2, v=0
  299352.2949  0.0019 -5.9630 3  441.1849 83  71510 3034132 9      4032 8        syn-C2H3C(O)NH2, v=0
  299352.2949  0.0019 -5.9630 3  441.1849 83  71510 303413210      4032 9        syn-C2H3C(O)NH2, v=0
  299360.3425  0.0549 -5.1065 3 1376.1719197  71510 303982870      982771        syn-C2H3C(O)NH2, v=0
  299378.7413  0.0200 -3.2858 3  222.8669 83 -71510 30341 833      40 932        syn-C2H3C(O)NH2, v=0
  299391.6077  0.1947 -5.5943 3 1628.8800217  71510 303A82682      A82583        syn-C2H3C(O)NH2, v=0
  299392.0336  0.0131 -4.6276 3 1117.9446177  71510 303882663      882564        syn-C2H3C(O)NH2, v=0
  299415.7850  0.0185 -5.1061 3  978.0605165  71510 303822558      812655        syn-C2H3C(O)NH2, v=0
  299433.7870  0.0009 -5.1993 3  238.1639 81  71510 303401427      391426        syn-C2H3C(O)NH2, v=0
  299462.4129  0.0610 -5.2605 3 1458.6298205  71510 303A22677      A22578        syn-C2H3C(O)NH2, v=0
  299479.1770  0.0009 -5.1992 3  238.1654 81  71510 303401426      391425        syn-C2H3C(O)NH2, v=0
  299479.4514  0.0074 -4.1931 3  846.1743159  71510 303791763      791664        syn-C2H3C(O)NH2, v=0
  299485.9067  0.0017 -5.8919 3  426.3581 83  71510 303413110      4031 9        syn-C2H3C(O)NH2, v=0
  299485.9067  0.0017 -5.8919 3  426.3581 83  71510 303413111      403110        syn-C2H3C(O)NH2, v=0
  299515.2832  0.0153 -4.3897 3  966.6815169  71510 303841866      841767        syn-C2H3C(O)NH2, v=0
  299613.5117  0.0357 -5.4415 3 1558.0826211  71510 303A52878      A52779        syn-C2H3C(O)NH2, v=0
  299630.0718  0.0016 -5.8263 3  412.0056 83  71510 303413011      403010        syn-C2H3C(O)NH2, v=0
  299630.0718  0.0016 -5.8263 3  412.0056 83  71510 303413012      403011        syn-C2H3C(O)NH2, v=0
  299703.3912  0.0187 -5.1052 3  978.0599165  71510 303822557      812656        syn-C2H3C(O)NH2, v=0
  299708.4622  0.0200 -3.4600 3  335.2845 87 -71510 303432221      432122        syn-C2H3C(O)NH2, v=0
  299708.4622  0.0200 -3.4600 3  335.2845 87 -71510 303432222      432123        syn-C2H3C(O)NH2, v=0
  299725.0750  0.0081 -6.4705 3  451.8799127  71510 30363 459      64 362        syn-C2H3C(O)NH2, v=0
  299725.0750  0.0081 -6.4705 3  451.8799127  71510 30363 559      64 262        syn-C2H3C(O)NH2, v=0
  299774.0955  0.0011 -3.7506 3  594.3909125  71510 303622339      622240        syn-C2H3C(O)NH2, v=0
  299775.1224  0.0011 -3.7506 3  594.3909125  71510 303622340      622241        syn-C2H3C(O)NH2, v=0
  299786.4137  0.0015 -5.7653 3  398.1281 83  71510 303412912      402911        syn-C2H3C(O)NH2, v=0
  299786.4137  0.0015 -5.7653 3  398.1281 83  71510 303412913      402912        syn-C2H3C(O)NH2, v=0
  299864.1726  0.0010 -5.0866 3  240.9694 95  71510 30347 245      46 244        syn-C2H3C(O)NH2, v=0
  299864.1726  0.0010 -2.9335 3  240.9694 95  71510 30347 245      46 344        syn-C2H3C(O)NH2, v=0
  299864.1726  0.0010 -2.9335 3  240.9694 95  71510 30347 345      46 244        syn-C2H3C(O)NH2, v=0
  299864.1726  0.0010 -5.0866 3  240.9694 95  71510 30347 345      46 344        syn-C2H3C(O)NH2, v=0
  299864.7139  0.0011 -5.0761 3  242.0054 97  71510 30348 147      47 146        syn-C2H3C(O)NH2, v=0
  299864.7139  0.0011 -2.8987 3  242.0054 97  71510 30348 147      47 246        syn-C2H3C(O)NH2, v=0
  299864.7139  0.0011 -2.8987 3  242.0054 97  71510 30348 247      47 146        syn-C2H3C(O)NH2, v=0
  299864.7139  0.0011 -5.0761 3  242.0054 97  71510 30348 247      47 246        syn-C2H3C(O)NH2, v=0
  299873.9347  0.0013 -5.0648 3  242.5290 99  71510 30349 049      48 048        syn-C2H3C(O)NH2, v=0
  299873.9195  0.0200 -2.8660 3  242.5290 99 -71510 30349 049      48 148        syn-C2H3C(O)NH2, v=0
  299873.9195  0.0200 -2.8660 3  242.5290 99 -71510 30349 149      48 048        syn-C2H3C(O)NH2, v=0
  299873.9347  0.0013 -5.0648 3  242.5290 99  71510 30349 149      48 148        syn-C2H3C(O)NH2, v=0
  299881.7101  0.0200 -3.7385 3  383.0998115 -71510 30357 552      57 453        syn-C2H3C(O)NH2, v=0
  299881.7101  0.0200 -3.7385 3  383.0998115 -71510 30357 652      57 553        syn-C2H3C(O)NH2, v=0
  299884.1320  0.0200 -2.9711 3  239.4092 93 -71510 30346 343      45 442        syn-C2H3C(O)NH2, v=0
  299884.1206  0.0009 -5.0961 3  239.4092 93  71510 30346 443      45 442        syn-C2H3C(O)NH2, v=0
  299884.1207  0.0009 -5.0961 3  239.4092 93  71510 30346 343      45 342        syn-C2H3C(O)NH2, v=0
  299884.1320  0.0200 -2.9711 3  239.4092 93 -71510 30346 443      45 342        syn-C2H3C(O)NH2, v=0
  299929.9706  0.0147 -4.5882 3 1095.6965175  71510 303872661      872562        syn-C2H3C(O)NH2, v=0
  299944.0866  0.0200 -3.0125 3  237.3087 91 -71510 30345 441      44 540        syn-C2H3C(O)NH2, v=0
  299944.0728  0.0009 -5.1046 3  237.3087 91  71510 30345 541      44 540        syn-C2H3C(O)NH2, v=0
  299944.0765  0.0009 -5.1046 3  237.3087 91  71510 30345 441      44 440        syn-C2H3C(O)NH2, v=0
  299944.0866  0.0200 -3.0125 3  237.3087 91 -71510 30345 541      44 440        syn-C2H3C(O)NH2, v=0
  299945.1684  0.0498 -4.9924 3 1312.0462195  71510 303972474      972375        syn-C2H3C(O)NH2, v=0
  299956.8629  0.0014 -5.7084 3  384.7261 83  71510 303412813      402812        syn-C2H3C(O)NH2, v=0
  299956.8629  0.0014 -5.7084 3  384.7261 83  71510 303412814      402813        syn-C2H3C(O)NH2, v=0
  300033.6961  0.0052 -5.8889 3   52.8249 43  71510 30321 517      21 220        syn-C2H3C(O)NH2, v=0
  300077.6927  0.0008 -3.0593 3  234.6453 89  71510 30344 539      43 638        syn-C2H3C(O)NH2, v=0
  300077.8662  0.0008 -5.1117 3  234.6453 89  71510 30344 639      43 638        syn-C2H3C(O)NH2, v=0
  300078.0256  0.0008 -5.1117 3  234.6453 89  71510 30344 539      43 538        syn-C2H3C(O)NH2, v=0
  300078.1991  0.0008 -3.0593 3  234.6453 89  71510 30344 639      43 538        syn-C2H3C(O)NH2, v=0
  300140.3847  0.0200 -3.4551 3  324.7123 85 -71510 303422220      422121        syn-C2H3C(O)NH2, v=0
  300140.3847  0.0200 -3.4551 3  324.7123 85 -71510 303422221      422122        syn-C2H3C(O)NH2, v=0
  300143.7322  0.0014 -5.6551 3  371.8006 83  71510 303412714      402713        syn-C2H3C(O)NH2, v=0
  300143.7322  0.0014 -5.6551 3  371.8006 83  71510 303412715      402714        syn-C2H3C(O)NH2, v=0
  300176.1574  0.0043 -6.3269 3  600.0899127  71510 303632241      641946        syn-C2H3C(O)NH2, v=0
  300182.9392  0.0044 -6.3874 3  303.7188 93  71510 303461433      47 938        syn-C2H3C(O)NH2, v=0
  300320.3324  0.0146 -4.3874 3  966.6857169  71510 303841966      841867        syn-C2H3C(O)NH2, v=0
  300341.3643  0.0200 -3.1142 3  231.3856 87 -71510 30343 637      42 736        syn-C2H3C(O)NH2, v=0
  300347.0841  0.0008 -5.1173 3  231.3856 87  71510 30343 737      42 736        syn-C2H3C(O)NH2, v=0
  300349.8135  0.0013 -5.6051 3  359.3526 83  71510 303412615      402614        syn-C2H3C(O)NH2, v=0
  300349.8135  0.0013 -5.6051 3  359.3526 83  71510 303412616      402615        syn-C2H3C(O)NH2, v=0
  300351.8612  0.0008 -5.1173 3  231.3853 87  71510 30343 637      42 636        syn-C2H3C(O)NH2, v=0
  300357.5715  0.0008 -3.1141 3  231.3853 87  71510 30343 737      42 636        syn-C2H3C(O)NH2, v=0
  300366.4191  0.0200 -3.3206 3   89.1151 51 -71510 30325 916      24 817        syn-C2H3C(O)NH2, v=0
  300423.3982  0.0264 -5.2889 3 1478.3634205  71510 303A22875      A22776        syn-C2H3C(O)NH2, v=0
  300426.6483  0.0032 -4.6115 3  156.9529 67  71510 303331122      33 825        syn-C2H3C(O)NH2, v=0
  300531.4464  0.0046 -6.4269 3  275.1378 89  71510 303441332      45 837        syn-C2H3C(O)NH2, v=0
  300541.9404  0.0200 -3.4516 3  314.3926 83 -71510 303412219      412120        syn-C2H3C(O)NH2, v=0
  300541.9404  0.0200 -3.4516 3  314.3926 83 -71510 303412220      412121        syn-C2H3C(O)NH2, v=0
  300558.0568  0.0085 -4.7046 3  763.6371147  71510 303732152      722251        syn-C2H3C(O)NH2, v=0
  300578.5068  0.0012 -5.5580 3  347.3833 83  71510 303412516      402515        syn-C2H3C(O)NH2, v=0
  300578.5068  0.0012 -5.5580 3  347.3833 83  71510 303412517      402516        syn-C2H3C(O)NH2, v=0
  300625.1966  0.0200 -3.0468 3   65.4861 31 -71510 3031514 1      1413 2        syn-C2H3C(O)NH2, v=0
  300625.1966  0.0200 -3.0468 3   65.4861 31 -71510 3031514 2      1413 1        syn-C2H3C(O)NH2, v=0
  300627.4374  0.0009 -5.1274 3  217.6307 81  71510 303401031      391030        syn-C2H3C(O)NH2, v=0
  300658.2347  0.0200 -3.2936 3  212.8381 81 -71510 30340 932      39 831        syn-C2H3C(O)NH2, v=0
  300714.3169  0.0200 -3.1829 3  227.4787 85 -71510 30342 735      41 834        syn-C2H3C(O)NH2, v=0
  300722.8096  0.0110 -6.4560 3  687.9435153  71510 30376 769      77 672        syn-C2H3C(O)NH2, v=0
  300722.8096  0.0110 -6.4560 3  687.9435153  71510 30376 869      77 572        syn-C2H3C(O)NH2, v=0
  300833.9931  0.0012 -5.5136 3  335.8939 83  71510 303412417      402416        syn-C2H3C(O)NH2, v=0
  300833.9931  0.0012 -5.5136 3  335.8939 83  71510 303412418      402417        syn-C2H3C(O)NH2, v=0
  300846.8484  0.0009 -5.1209 3  227.4787 85  71510 30342 835      41 834        syn-C2H3C(O)NH2, v=0
  300914.8343  0.0200 -3.4497 3  304.3250 81 -71510 303402218      402119        syn-C2H3C(O)NH2, v=0
  300914.8343  0.0200 -3.4497 3  304.3250 81 -71510 303402219      402120        syn-C2H3C(O)NH2, v=0
  300944.7740  0.0009 -5.1206 3  227.4710 85  71510 30342 735      41 734        syn-C2H3C(O)NH2, v=0
  300954.6151  0.0155 -5.0043 3  926.8871161  71510 303802457      792554        syn-C2H3C(O)NH2, v=0
  300964.6903  0.0025 -4.0268 3  773.0212145  71510 303722448      722349        syn-C2H3C(O)NH2, v=0
  300992.4086  0.0200 -3.2308 3   81.2061 47 -71510 303231014      22 913        syn-C2H3C(O)NH2, v=0
  301020.7578  0.0200 -4.0267 3  773.0191145 -71510 303722449      722350        syn-C2H3C(O)NH2, v=0
  301036.0480  0.0009 -5.1741 3  232.2503 81  71510 303401328      391327        syn-C2H3C(O)NH2, v=0
  301039.9553  0.0200 -3.0844 3   67.1490 35 -71510 3031713 4      1612 5        syn-C2H3C(O)NH2, v=0
  301039.9553  0.0200 -3.0844 3   67.1490 35 -71510 3031713 5      1612 4        syn-C2H3C(O)NH2, v=0
  301055.5063  0.0011 -3.7260 3  578.9442123  71510 303612338      612239        syn-C2H3C(O)NH2, v=0
  301056.0216  0.0011 -3.7260 3  578.9442123  71510 303612339      612240        syn-C2H3C(O)NH2, v=0
  301057.1221  0.0010 -3.2306 3   81.2042 47  71510 303231013      22 914        syn-C2H3C(O)NH2, v=0
  301077.3360  0.0200 -3.1818 3  227.4710 85 -71510 30342 835      41 734        syn-C2H3C(O)NH2, v=0
  301121.4714  0.0012 -5.4718 3  324.8863 83  71510 303412318      402317        syn-C2H3C(O)NH2, v=0
  301121.4714  0.0012 -5.4718 3  324.8863 83  71510 303412319      402318        syn-C2H3C(O)NH2, v=0
  301260.7011  0.0200 -3.4494 3  294.5089 79 -71510 303392217      392118        syn-C2H3C(O)NH2, v=0
  301260.7011  0.0200 -3.4494 3  294.5089 79 -71510 303392218      392119        syn-C2H3C(O)NH2, v=0
  301329.4869  0.0063 -4.3036 3  936.9481161  71510 303802555      802456        syn-C2H3C(O)NH2, v=0
  301369.9942  0.0455 -5.4894 3 1585.1242213  71510 303A62879      A62780        syn-C2H3C(O)NH2, v=0
  301376.8404  0.0200 -3.1243 3   70.2973 39 -71510 3031912 8      1811 7        syn-C2H3C(O)NH2, v=0
  301376.8404  0.0200 -3.1243 3   70.2973 39 -71510 3031912 7      1811 8        syn-C2H3C(O)NH2, v=0
  301428.8748  0.0009 -5.1730 3  232.2662 81  71510 303401327      391326        syn-C2H3C(O)NH2, v=0
  301447.4890  0.0011 -5.4323 3  314.3624 83  71510 303412219      402218        syn-C2H3C(O)NH2, v=0
  301447.4890  0.0011 -5.4323 3  314.3624 83  71510 303412220      402219        syn-C2H3C(O)NH2, v=0
  301459.4282  0.0009 -5.1225 3  222.8669 83  71510 30341 933      40 932        syn-C2H3C(O)NH2, v=0
  301492.9153  0.0010 -3.1707 3   74.9627 43  71510 303211111      201010        syn-C2H3C(O)NH2, v=0
  301493.4127  0.0010 -3.1707 3   74.9627 43  71510 303211110      201011        syn-C2H3C(O)NH2, v=0
  301554.6697  0.0350 -5.3205 3  913.2658163  71510 303812062      802159        syn-C2H3C(O)NH2, v=0
  301581.0743  0.0200 -3.4508 3  284.9439 77 -71510 303382216      382117        syn-C2H3C(O)NH2, v=0
  301581.0743  0.0200 -3.4508 3  284.9439 77 -71510 303382217      382118        syn-C2H3C(O)NH2, v=0
  301604.2026  0.0200 -3.8363 3  326.6388109 -71510 30354 351      54 252        syn-C2H3C(O)NH2, v=0
  301604.2026  0.0200 -3.8363 3  326.6388109 -71510 30354 451      54 352        syn-C2H3C(O)NH2, v=0
  301640.8262  0.0059 -6.4143 3  675.3013135  71510 303672344      682049        syn-C2H3C(O)NH2, v=0
  301643.6950  0.0200 -3.7294 3  418.9623119 -71510 30359 653      59 554        syn-C2H3C(O)NH2, v=0
  301643.6950  0.0200 -3.7294 3  418.9623119 -71510 30359 753      59 654        syn-C2H3C(O)NH2, v=0
  301649.7051  0.0025 -6.1618 3  331.6769 93  71510 303461829      471532        syn-C2H3C(O)NH2, v=0
  301668.5216  0.0018 -5.4888 3   24.1961 29  71510 30314 6 8      13 311        syn-C2H3C(O)NH2, v=0
  301673.4325  0.0159 -5.0021 3  926.8854161  71510 303802456      792555        syn-C2H3C(O)NH2, v=0
  301771.2151  0.0054 -4.1157 3  797.9803155  71510 303771562      771463        syn-C2H3C(O)NH2, v=0
  301820.4137  0.0011 -5.3950 3  304.3250 83  71510 303412120      402119        syn-C2H3C(O)NH2, v=0
  301820.4137  0.0011 -5.3950 3  304.3250 83  71510 303412121      402120        syn-C2H3C(O)NH2, v=0
  301829.6196  0.0054 -4.1156 3  797.9805155  71510 303771662      771563        syn-C2H3C(O)NH2, v=0
  301877.3364  0.0200 -3.4541 3  275.6295 75 -71510 303372215      372116        syn-C2H3C(O)NH2, v=0
  301877.3364  0.0200 -3.4541 3  275.6295 75 -71510 303372216      372117        syn-C2H3C(O)NH2, v=0
  301908.0065  0.0060 -4.3020 3  936.9258161  71510 303802556      802457        syn-C2H3C(O)NH2, v=0
  302047.4462  0.0205 -4.8936 3 1267.3868189  71510 303942768      942669        syn-C2H3C(O)NH2, v=0
  302059.5216  0.3799 -6.4426 3 2077.2205243  71510 303C13388      C13289        syn-C2H3C(O)NH2, v=0
  302072.3542  0.1998 -5.8780 3 1785.2620225  71510 303B23181      B23082        syn-C2H3C(O)NH2, v=0
  302150.8895  0.0200 -3.4595 3  266.5653 73 -71510 303362214      362115        syn-C2H3C(O)NH2, v=0
  302150.8895  0.0200 -3.4595 3  266.5653 73 -71510 303362215      362116        syn-C2H3C(O)NH2, v=0
  302215.1914  0.0200 -3.3349 3   95.5317 53 -71510 30326 918      25 817        syn-C2H3C(O)NH2, v=0
  302222.2685  0.0339 -4.7388 3 1172.6304185  71510 303922271      922172        syn-C2H3C(O)NH2, v=0
  302251.1289  0.0010 -5.3598 3  294.7772 83  71510 303412021      402020        syn-C2H3C(O)NH2, v=0
  302251.1289  0.0010 -5.3598 3  294.7772 83  71510 303412022      402021        syn-C2H3C(O)NH2, v=0
  302259.3700  0.0200 -3.7023 3  563.7616121 -71510 303602337      602238        syn-C2H3C(O)NH2, v=0
  302259.3700  0.0200 -3.7023 3  563.7616121 -71510 303602338      602239        syn-C2H3C(O)NH2, v=0
  302291.1288  0.0043 -4.1977 3  273.1427103  71510 30351 150      51 051        syn-C2H3C(O)NH2, v=0
  302291.1288  0.0043 -4.1977 3  273.1427103  71510 30351 250      51 151        syn-C2H3C(O)NH2, v=0
  302292.0256  0.0034 -6.4483 3  258.8467 85  71510 303421429      43 934        syn-C2H3C(O)NH2, v=0
  302298.8507  0.0010 -5.1274 3  212.7279 79  71510 303391128      381127        syn-C2H3C(O)NH2, v=0
  302311.3388  0.0028 -3.4477 3  148.3047 67  71510 30333 925      32 824        syn-C2H3C(O)NH2, v=0
  302323.7848  0.0057 -4.5129 3  658.0811137  71510 303681949      672048        syn-C2H3C(O)NH2, v=0
  302377.9434  0.0273 -5.2357 3 1452.2898203  71510 303A12874      A12775        syn-C2H3C(O)NH2, v=0
  302403.0203  0.0200 -3.4672 3  257.7509 71 -71510 303352213      352114        syn-C2H3C(O)NH2, v=0
  302403.0203  0.0200 -3.4672 3  257.7509 71 -71510 303352214      352115        syn-C2H3C(O)NH2, v=0
  302403.5391  0.0025 -6.1598 3  331.6517 93  71510 303461828      471533        syn-C2H3C(O)NH2, v=0
  302501.5007  0.0050 -4.5991 3  692.9584141  71510 303701952      692049        syn-C2H3C(O)NH2, v=0
  302538.0645  0.0218 -4.5098 3 1040.4256175  71510 303871968      871869        syn-C2H3C(O)NH2, v=0
  302558.2669  0.0018 -3.4828 3   92.0671 53  71510 30326 818      25 719        syn-C2H3C(O)NH2, v=0
  302635.0097  0.0200 -3.4775 3  249.1858 69 -71510 303342212      342113        syn-C2H3C(O)NH2, v=0
  302635.0097  0.0200 -3.4775 3  249.1858 69 -71510 303342213      342114        syn-C2H3C(O)NH2, v=0
  302636.5271  0.0040 -4.4011 3   47.2159 41  71510 30320 416      19 317        syn-C2H3C(O)NH2, v=0
  302662.7261  0.0009 -5.1510 3  226.9284 81  71510 303401229      391228        syn-C2H3C(O)NH2, v=0
  302677.4139  0.0128 -4.9061 3  877.1646157  71510 303782356      772453        syn-C2H3C(O)NH2, v=0
  302716.6285  0.0120 -4.5803 3 1095.5861175  71510 303872662      872563        syn-C2H3C(O)NH2, v=0
  302725.6098  0.0088 -6.4220 3  609.2910145  71510 30372 666      73 569        syn-C2H3C(O)NH2, v=0
  302725.6098  0.0088 -6.4220 3  609.2910145  71510 30372 766      73 469        syn-C2H3C(O)NH2, v=0
  302728.7535  0.0009 -5.1184 3  222.7552 83  71510 30341 833      40 832        syn-C2H3C(O)NH2, v=0
  302754.0921  0.0010 -5.3264 3  285.7234 83  71510 303411923      401922        syn-C2H3C(O)NH2, v=0
  302754.0922  0.0010 -5.3264 3  285.7234 83  71510 303411922      401921        syn-C2H3C(O)NH2, v=0
  302758.2689  0.0600 -5.1417 3 1397.0667201  71510 303A02576      A02477        syn-C2H3C(O)NH2, v=0
  302783.9474  0.0037 -3.9353 3  362.8668103  71510 303511338      501437        syn-C2H3C(O)NH2, v=0
  302815.3096  0.3240 -6.0070 3 1849.1486231  71510 303B52887      B52788        syn-C2H3C(O)NH2, v=0
  302848.0416  0.0200 -3.4906 3  240.8697 67 -71510 303332211      332112        syn-C2H3C(O)NH2, v=0
  302848.0416  0.0200 -3.4906 3  240.8697 67 -71510 303332212      332113        syn-C2H3C(O)NH2, v=0
  302957.0799  0.0033 -3.7087 3   82.7294 51  71510 30325 718      24 619        syn-C2H3C(O)NH2, v=0
  302969.1289  0.0010 -5.1043 3  206.6398 79  71510 30339 930      38 929        syn-C2H3C(O)NH2, v=0
  302989.1583  0.0200 -3.9933 3  754.9471143 -71510 303712447      712348        syn-C2H3C(O)NH2, v=0
  303020.3641  0.0200 -3.9932 3  754.9459143 -71510 303712448      712349        syn-C2H3C(O)NH2, v=0
  303043.2159  0.0200 -3.5070 3  232.8023 65 -71510 303322210      322111        syn-C2H3C(O)NH2, v=0
  303043.2159  0.0200 -3.5070 3  232.8023 65 -71510 303322211      322112        syn-C2H3C(O)NH2, v=0
  303067.6939  0.0009 -5.1338 3  222.1388 81  71510 303401130      391129        syn-C2H3C(O)NH2, v=0
  303118.1884  0.0200 -3.7358 3  456.0973123 -71510 30361 754      61 655        syn-C2H3C(O)NH2, v=0
  303118.1884  0.0200 -3.7358 3  456.0973123 -71510 30361 854      61 755        syn-C2H3C(O)NH2, v=0
  303180.5954  0.0020 -5.2573 3   71.0912 45  71510 30322 914      22 617        syn-C2H3C(O)NH2, v=0
  303221.7394  0.0200 -3.5273 3  224.9830 63 -71510 3033122 9      312110        syn-C2H3C(O)NH2, v=0
  303221.7394  0.0200 -3.5273 3  224.9830 63 -71510 303312210      312111        syn-C2H3C(O)NH2, v=0
  303256.3957  0.1563 -6.1078 3 1253.3832191  71510 303952373      942470        syn-C2H3C(O)NH2, v=0
  303298.9576  0.0020 -5.1699 3   76.7969 47  71510 30323 915      23 618        syn-C2H3C(O)NH2, v=0
  303349.0172  0.0010 -5.2949 3  277.1691 83  71510 303411824      401823        syn-C2H3C(O)NH2, v=0
  303349.0197  0.0010 -5.2949 3  277.1691 83  71510 303411823      401822        syn-C2H3C(O)NH2, v=0
  303384.5241  0.0200 -3.5522 3  217.4117 61 -71510 3033022 8      3021 9        syn-C2H3C(O)NH2, v=0
  303384.5241  0.0200 -3.5522 3  217.4117 61 -71510 3033022 9      302110        syn-C2H3C(O)NH2, v=0
  303390.3040  0.0011 -3.6797 3  548.8421119  71510 303592336      592237        syn-C2H3C(O)NH2, v=0
  303390.4275  0.0011 -3.6797 3  548.8421119  71510 303592337      592238        syn-C2H3C(O)NH2, v=0
  303472.8007  0.0930 -6.4371 3 1661.7220211  71510 303A53670      A43767        syn-C2H3C(O)NH2, v=0
  303472.8079  0.0930 -6.4371 3 1661.7220211  71510 303A53669      A43768        syn-C2H3C(O)NH2, v=0
  303480.8354  0.0676 -5.4178 3 1547.9596211  71510 303A52779      A52680        syn-C2H3C(O)NH2, v=0
  303484.7193  0.0112 -4.2986 3  915.5238165  71510 303821765      821666        syn-C2H3C(O)NH2, v=0
  303497.0032  0.0827 -6.3022 3 1594.2844207  71510 303A33569      A23666        syn-C2H3C(O)NH2, v=0
  303497.0243  0.0827 -6.3022 3 1594.2844207  71510 303A33568      A23667        syn-C2H3C(O)NH2, v=0
  303532.6676  0.0200 -3.5828 3  210.0878 59 -71510 3032922 7      2921 8        syn-C2H3C(O)NH2, v=0
  303532.6676  0.0200 -3.5828 3  210.0878 59 -71510 3032922 8      2921 9        syn-C2H3C(O)NH2, v=0
  303559.2358  0.0200 -4.0440 3  750.9750151 -71510 303751461      751362        syn-C2H3C(O)NH2, v=0
  303577.9011  0.0200 -4.0440 3  750.9751151 -71510 303751561      751462        syn-C2H3C(O)NH2, v=0
  303594.9611  0.0734 -6.1702 3 1528.2727203  71510 303A13468      A03565        syn-C2H3C(O)NH2, v=0
  303595.0225  0.0734 -6.1702 3 1528.2727203  71510 303A13467      A03566        syn-C2H3C(O)NH2, v=0
  303667.0854  0.0200 -3.6203 3  203.0112 57 -71510 3032822 6      2821 7        syn-C2H3C(O)NH2, v=0
  303667.0854  0.0200 -3.6203 3  203.0112 57 -71510 3032822 7      2821 8        syn-C2H3C(O)NH2, v=0
  303677.7166  0.1453 -5.4110 3 1537.1419211  71510 303A52580      A52481        syn-C2H3C(O)NH2, v=0
  303776.5919  0.0649 -6.0411 3 1463.6888199  71510 303993367      983464        syn-C2H3C(O)NH2, v=0
  303776.7688  0.0649 -6.0411 3 1463.6888199  71510 303993366      983465        syn-C2H3C(O)NH2, v=0
  303782.9582  0.0110 -4.2978 3  915.5252165  71510 303821865      821766        syn-C2H3C(O)NH2, v=0
  303788.7393  0.0200 -3.6670 3  196.1815 55 -71510 3032722 5      2721 6        syn-C2H3C(O)NH2, v=0
  303788.7393  0.0200 -3.6670 3  196.1815 55 -71510 3032722 6      2721 7        syn-C2H3C(O)NH2, v=0
  303836.7670  0.0025 -5.7189 3   50.8090 37  71510 30318 9 9      18 612        syn-C2H3C(O)NH2, v=0
  303847.8105  0.0021 -5.3553 3   65.6187 43  71510 30321 913      21 616        syn-C2H3C(O)NH2, v=0
  303853.1750  0.0204 -4.5061 3 1040.4329175  71510 303872068      871969        syn-C2H3C(O)NH2, v=0
  303898.4413  0.0200 -3.7260 3  189.5984 53 -71510 3032622 4      2621 5        syn-C2H3C(O)NH2, v=0
  303898.4413  0.0200 -3.7260 3  189.5984 53 -71510 3032622 5      2621 6        syn-C2H3C(O)NH2, v=0
  303916.7843  0.0200 -3.7763 3  360.5380113 -71510 30356 452      56 353        syn-C2H3C(O)NH2, v=0
  303916.7843  0.0200 -3.7763 3  360.5380113 -71510 30356 552      56 453        syn-C2H3C(O)NH2, v=0
  303997.1210  0.0200 -3.8028 3  183.2616 51 -71510 3032522 3      2521 4        syn-C2H3C(O)NH2, v=0
  303997.1210  0.0200 -3.8028 3  183.2616 51 -71510 3032522 4      2521 5        syn-C2H3C(O)NH2, v=0
  304053.8207  0.0571 -5.9149 3 1400.5342195  71510 303973266      963363        syn-C2H3C(O)NH2, v=0
  304054.3238  0.0571 -5.9149 3 1400.5342195  71510 303973265      963364        syn-C2H3C(O)NH2, v=0
  304062.6664  0.5106 -6.4555 3 2083.0682245  71510 303C23092      C22993        syn-C2H3C(O)NH2, v=0
  304063.6844  0.0009 -5.2651 3  269.1219 83  71510 303411725      401724        syn-C2H3C(O)NH2, v=0
  304063.7287  0.0009 -5.2651 3  269.1219 83  71510 303411724      401723        syn-C2H3C(O)NH2, v=0
  304085.5294  0.0200 -3.9077 3  177.1707 49 -71510 3032422 2      2421 3        syn-C2H3C(O)NH2, v=0
  304085.5294  0.0200 -3.9077 3  177.1707 49 -71510 3032422 3      2421 4        syn-C2H3C(O)NH2, v=0
  304115.6535  0.0255 -4.8049 3 1219.9558185  71510 303922765      922666        syn-C2H3C(O)NH2, v=0
  304128.9338  0.0024 -6.2554 3  222.4866 75  71510 303371622      381325        syn-C2H3C(O)NH2, v=0
  304164.4452  0.0200 -4.0638 3  171.3257 47 -71510 3032322 1      2321 2        syn-C2H3C(O)NH2, v=0
  304164.4452  0.0200 -4.0638 3  171.3257 47 -71510 3032322 2      2321 3        syn-C2H3C(O)NH2, v=0
  304206.5621  0.0124 -4.5388 3 1073.5809173  71510 303862660      862561        syn-C2H3C(O)NH2, v=0
  304211.3652  0.0580 -5.5355 3 1612.3847215  71510 303A72880      A72781        syn-C2H3C(O)NH2, v=0
  304234.6206  0.0200 -4.3446 3  165.7261 45 -71510 3032222 0      2221 1        syn-C2H3C(O)NH2, v=0
  304234.6206  0.0200 -4.3446 3  165.7261 45 -71510 3032222 1      2221 2        syn-C2H3C(O)NH2, v=0
  304258.4271  0.0055 -4.2624 3  916.7381159  71510 303792554      792455        syn-C2H3C(O)NH2, v=0
  304288.9957  0.0200 -3.7545 3  494.4970127 -71510 30363 855      63 756        syn-C2H3C(O)NH2, v=0
  304288.9957  0.0200 -3.7545 3  494.4970127 -71510 30363 955      63 856        syn-C2H3C(O)NH2, v=0
  304364.7470  0.0018 -6.4745 3   14.8312 21  71510 30310 7 4       9 4 5        syn-C2H3C(O)NH2, v=0
  304384.1941  0.0024 -6.2548 3  222.4781 75  71510 303371621      381326        syn-C2H3C(O)NH2, v=0
  304397.6724  0.0104 -4.8126 3  828.8988153  71510 303762255      752352        syn-C2H3C(O)NH2, v=0
  304416.5111  0.0083 -6.4279 3  535.1452137  71510 30368 563      69 466        syn-C2H3C(O)NH2, v=0
  304416.5111  0.0083 -6.4279 3  535.1452137  71510 30368 663      69 366        syn-C2H3C(O)NH2, v=0
  304422.7088  0.0135 -4.9009 3  877.1602157  71510 303782355      772454        syn-C2H3C(O)NH2, v=0
  304433.2631  0.0020 -5.0936 3   82.7294 49  71510 30324 916      24 619        syn-C2H3C(O)NH2, v=0
  304441.0841  0.0501 -5.7916 3 1338.8109191  71510 303953165      943262        syn-C2H3C(O)NH2, v=0
  304442.4970  0.0501 -5.7916 3 1338.8109191  71510 303953164      943263        syn-C2H3C(O)NH2, v=0
  304453.4158  0.0200 -3.6579 3  534.1848117 -71510 303582335      582236        syn-C2H3C(O)NH2, v=0
  304453.4158  0.0200 -3.6579 3  534.1848117 -71510 303582336      582237        syn-C2H3C(O)NH2, v=0
  304603.0365  0.0054 -4.2614 3  916.7249159  71510 303792555      792456        syn-C2H3C(O)NH2, v=0
  304690.7254  0.0050 -5.5061 3   66.6335 47  71510 30323 618      23 321        syn-C2H3C(O)NH2, v=0
  304777.1725  0.0200 -3.9785 3  705.1696147 -71510 303731360      731261        syn-C2H3C(O)NH2, v=0
  304782.7567  0.0200 -3.9785 3  705.1696147 -71510 303731460      731361        syn-C2H3C(O)NH2, v=0
  304809.4441  0.0200 -3.2690 3  222.7552 83 -71510 30341 933      40 832        syn-C2H3C(O)NH2, v=0
  304837.4019  0.0200 -3.3910 3  237.9060 85 -71510 30342 933      411032        syn-C2H3C(O)NH2, v=0
  304880.7584  0.0020 -3.9608 3  737.1457141  71510 303702446      702347        syn-C2H3C(O)NH2, v=0
  304897.9160  0.0020 -3.9608 3  737.1451141  71510 303702447      702348        syn-C2H3C(O)NH2, v=0
  304923.0063  0.0436 -4.8776 3 1253.3276191  71510 303952373      952274        syn-C2H3C(O)NH2, v=0
  304938.8081  0.0009 -5.2368 3  261.5921 83  71510 303411626      401625        syn-C2H3C(O)NH2, v=0
  304939.4569  0.0280 -5.1818 3 1426.4801201  71510 303A02873      A02774        syn-C2H3C(O)NH2, v=0
  304939.4730  0.0009 -5.2368 3  261.5921 83  71510 303411625      401624        syn-C2H3C(O)NH2, v=0
  304955.9290  0.0438 -5.6711 3 1278.5206187  71510 303933064      923161        syn-C2H3C(O)NH2, v=0
  304959.8418  0.0438 -5.6711 3 1278.5206187  71510 303933063      923162        syn-C2H3C(O)NH2, v=0
  304981.9363  0.0305 -4.6381 3 1116.7667181  71510 303902070      901971        syn-C2H3C(O)NH2, v=0
  305072.8197  0.0021 -5.4637 3   60.3853 41  71510 30320 912      20 615        syn-C2H3C(O)NH2, v=0
  305090.7682  0.0036 -3.9565 3  305.0472107  71510 30353 251      53 152        syn-C2H3C(O)NH2, v=0
  305090.7682  0.0036 -3.9565 3  305.0472107  71510 30353 351      53 252        syn-C2H3C(O)NH2, v=0
  305137.1303  0.0200 -3.7834 3  534.1531131 -71510 30365 956      65 857        syn-C2H3C(O)NH2, v=0
  305137.1303  0.0200 -3.7834 3  534.1531131 -71510 303651056      65 957        syn-C2H3C(O)NH2, v=0
  305137.7710  0.0009 -5.1440 3  227.0533 81  71510 303401228      391227        syn-C2H3C(O)NH2, v=0
  305252.1804  0.0018 -6.4740 3   14.8016 21  71510 30310 7 3       9 4 6        syn-C2H3C(O)NH2, v=0
  305281.4641  0.0028 -6.1685 3  388.0657101  71510 303501932      511635        syn-C2H3C(O)NH2, v=0
  305297.4151  0.0048 -4.5022 3  189.2723 75  71510 303371027      37 730        syn-C2H3C(O)NH2, v=0
  305452.6051  0.0200 -3.6372 3  519.7888115 -71510 303572334      572235        syn-C2H3C(O)NH2, v=0
  305452.6051  0.0200 -3.6372 3  519.7888115 -71510 303572335      572236        syn-C2H3C(O)NH2, v=0
  305454.5858  0.0195 -4.8423 3 1243.4331187  71510 303932767      932668        syn-C2H3C(O)NH2, v=0
  305465.2004  0.0027 -3.4442 3  139.8973 65  71510 30332 924      31 823        syn-C2H3C(O)NH2, v=0
  305496.8355  0.0024 -3.9192 3  660.5748143  71510 303711259      711160        syn-C2H3C(O)NH2, v=0
  305498.4232  0.0024 -3.9192 3  660.5748143  71510 303711359      711260        syn-C2H3C(O)NH2, v=0
  305569.1461  0.0064 -4.6518 3  736.7766145  71510 303722053      712150        syn-C2H3C(O)NH2, v=0
  305619.6238  0.0381 -5.5535 3 1219.6654183  71510 303912963      903060        syn-C2H3C(O)NH2, v=0
  305630.2967  0.0381 -5.5535 3 1219.6654183  71510 303912962      903061        syn-C2H3C(O)NH2, v=0
  305640.1225  0.0200 -3.8211 3  575.0573135 -71510 303671057      67 958        syn-C2H3C(O)NH2, v=0
  305640.1225  0.0200 -3.8211 3  575.0573135 -71510 303671157      671058        syn-C2H3C(O)NH2, v=0
  305665.0657  0.0083 -4.7261 3  782.0981149  71510 303742154      732251        syn-C2H3C(O)NH2, v=0
  305770.8853  0.0021 -3.8666 3  617.2009139  71510 303691158      691059        syn-C2H3C(O)NH2, v=0
  305771.3060  0.0021 -3.8666 3  617.2009139  71510 303691258      691159        syn-C2H3C(O)NH2, v=0
  305781.0264  0.0702 -5.2968 3 1484.6566207  71510 303A32678      A32579        syn-C2H3C(O)NH2, v=0
  305914.5713  0.0010 -5.0810 3  250.9718 97  71510 30348 246      47 245        syn-C2H3C(O)NH2, v=0
  305914.5640  0.0200 -2.9266 3  250.9718 97 -71510 30348 246      47 345        syn-C2H3C(O)NH2, v=0
  305914.5640  0.0200 -2.9266 3  250.9718 97 -71510 30348 346      47 245        syn-C2H3C(O)NH2, v=0
  305914.5713  0.0010 -5.0810 3  250.9718 97  71510 30348 346      47 345        syn-C2H3C(O)NH2, v=0
  305915.8098  0.0012 -5.0708 3  252.0078 99  71510 30349 148      48 147        syn-C2H3C(O)NH2, v=0
  305915.8162  0.0200 -2.8927 3  252.0078 99 -71510 30349 148      48 247        syn-C2H3C(O)NH2, v=0
  305915.8162  0.0200 -2.8927 3  252.0078 99 -71510 30349 248      48 147        syn-C2H3C(O)NH2, v=0
  305915.8098  0.0012 -5.0708 3  252.0078 99  71510 30349 248      48 247        syn-C2H3C(O)NH2, v=0
  305925.2005  0.0014 -5.0596 3  252.5317101  71510 30350 050      49 049        syn-C2H3C(O)NH2, v=0
  305925.1977  0.0200 -2.8607 3  252.5317101 -71510 30350 050      49 149        syn-C2H3C(O)NH2, v=0
  305925.1977  0.0200 -2.8607 3  252.5317101 -71510 30350 150      49 049        syn-C2H3C(O)NH2, v=0
  305925.2005  0.0014 -5.0596 3  252.5317101  71510 30350 150      49 149        syn-C2H3C(O)NH2, v=0
  305932.5746  0.0200 -2.9631 3  249.4123 95 -71510 30347 344      46 443        syn-C2H3C(O)NH2, v=0
  305932.5978  0.0009 -5.0903 3  249.4123 95  71510 30347 344      46 343        syn-C2H3C(O)NH2, v=0
  305932.5746  0.0200 -2.9631 3  249.4123 95 -71510 30347 444      46 343        syn-C2H3C(O)NH2, v=0
  305932.5978  0.0009 -5.0903 3  249.4123 95  71510 30347 444      46 443        syn-C2H3C(O)NH2, v=0
  305956.6161  0.0109 -4.5339 3 1073.5121173  71510 303862661      862562        syn-C2H3C(O)NH2, v=0
  305969.6581  0.0047 -6.3958 3  315.4063 95  71510 303471434      48 939        syn-C2H3C(O)NH2, v=0
  305973.7338  0.0200 -3.7475 3  395.7256117 -71510 30358 553      58 454        syn-C2H3C(O)NH2, v=0
  305973.7338  0.0200 -3.7475 3  395.7256117 -71510 30358 653      58 554        syn-C2H3C(O)NH2, v=0
  305987.1632  0.0019 -4.3373 3  227.0250 81  71510 303401228      40 931        syn-C2H3C(O)NH2, v=0
  305988.0200  0.0200 -3.0032 3  247.3138 93 -71510 30346 442      45 541        syn-C2H3C(O)NH2, v=0
  305988.0205  0.0009 -5.0984 3  247.3138 93  71510 30346 542      45 541        syn-C2H3C(O)NH2, v=0
  305988.0224  0.0009 -5.0984 3  247.3138 93  71510 30346 442      45 441        syn-C2H3C(O)NH2, v=0
  305988.0200  0.0200 -3.0032 3  247.3138 93 -71510 30346 542      45 441        syn-C2H3C(O)NH2, v=0
  306035.5070  0.0009 -5.2097 3  254.5948 83  71510 303411527      401526        syn-C2H3C(O)NH2, v=0
  306043.8300  0.0009 -5.2097 3  254.5951 83  71510 303411526      401525        syn-C2H3C(O)NH2, v=0
  306076.1161  0.1251 -5.5778 3 1633.6585215  71510 303A73077      A72978        syn-C2H3C(O)NH2, v=0
  306111.8518  0.0200 -3.0482 3  244.6548 91 -71510 30345 540      44 639        syn-C2H3C(O)NH2, v=0
  306111.8014  0.0009 -5.1054 3  244.6548 91  71510 30345 640      44 639        syn-C2H3C(O)NH2, v=0
  306111.8850  0.0009 -5.1054 3  244.6548 91  71510 30345 540      44 539        syn-C2H3C(O)NH2, v=0
  306111.8518  0.0200 -3.0482 3  244.6548 91 -71510 30345 640      44 539        syn-C2H3C(O)NH2, v=0
  306142.4722  0.0028 -6.3651 3  532.3824 85  71510 3034237 5      4137 4        syn-C2H3C(O)NH2, v=0
  306142.4722  0.0028 -6.3651 3  532.3824 85  71510 3034237 6      4137 5        syn-C2H3C(O)NH2, v=0
  306169.5052  0.0200 -3.3481 3  102.1594 55 -71510 30327 919      26 818        syn-C2H3C(O)NH2, v=0
  306185.2325  0.0036 -5.0363 3   99.6353 53  71510 303261016      26 719        syn-C2H3C(O)NH2, v=0
  306200.4732  0.0028 -6.1661 3  388.0351101  71510 303501931      511636        syn-C2H3C(O)NH2, v=0
  306219.9805  0.0200 -3.2565 3  232.9225 85 -71510 30342 834      41 933        syn-C2H3C(O)NH2, v=0
  306246.3035  0.0026 -6.2553 3  515.1948 85  71510 3034236 6      4136 5        syn-C2H3C(O)NH2, v=0
  306246.3035  0.0026 -6.2553 3  515.1948 85  71510 3034236 7      4136 6        syn-C2H3C(O)NH2, v=0
  306355.1808  0.1073 -5.2377 3 1447.9425205  71510 303A22478      A22379        syn-C2H3C(O)NH2, v=0
  306355.9868  0.0023 -6.1589 3  498.4793 85  71510 3034235 7      4135 6        syn-C2H3C(O)NH2, v=0
  306355.9868  0.0023 -6.1589 3  498.4793 85  71510 3034235 8      4135 7        syn-C2H3C(O)NH2, v=0
  306356.6273  0.0200 -3.1006 3  241.4041 89 -71510 30344 638      43 737        syn-C2H3C(O)NH2, v=0
  306359.7074  0.0009 -5.1108 3  241.4041 89  71510 30344 738      43 737        syn-C2H3C(O)NH2, v=0
  306362.3296  0.0009 -5.1108 3  241.4039 89  71510 30344 638      43 637        syn-C2H3C(O)NH2, v=0
  306365.4244  0.0200 -3.1005 3  241.4039 89 -71510 30344 738      43 637        syn-C2H3C(O)NH2, v=0
  306391.7535  0.0200 -3.6174 3  505.6533113 -71510 303562333      562234        syn-C2H3C(O)NH2, v=0
  306391.7535  0.0200 -3.6174 3  505.6533113 -71510 303562334      562235        syn-C2H3C(O)NH2, v=0
  306457.4915  0.0330 -5.4387 3 1162.2474179  71510 303892862      882959        syn-C2H3C(O)NH2, v=0
  306470.8029  0.0082 -4.2141 3  865.5303161  71510 303801664      801565        syn-C2H3C(O)NH2, v=0
  306472.3240  0.0021 -6.0724 3  482.2365 85  71510 3034234 8      4134 7        syn-C2H3C(O)NH2, v=0
  306472.3240  0.0021 -6.0724 3  482.2365 85  71510 3034234 9      4134 8        syn-C2H3C(O)NH2, v=0
  306486.1229  0.0330 -5.4386 3 1162.2473179  71510 303892861      882960        syn-C2H3C(O)NH2, v=0
  306575.3009  0.0082 -4.2138 3  865.5307161  71510 303801764      801665        syn-C2H3C(O)NH2, v=0
  306582.5033  0.0041 -4.0287 3  408.2748109  71510 303541440      531539        syn-C2H3C(O)NH2, v=0
  306596.2428  0.0020 -5.9938 3  466.4666 85  71510 3034233 9      4133 8        syn-C2H3C(O)NH2, v=0
  306596.2428  0.0020 -5.9938 3  466.4666 85  71510 303423310      4133 9        syn-C2H3C(O)NH2, v=0
  306644.1387  0.0022 -5.5827 3   55.3967 39  71510 30319 911      19 614        syn-C2H3C(O)NH2, v=0
  306652.2949  0.0018 -3.9293 3  719.6155139  71510 303692445      692346        syn-C2H3C(O)NH2, v=0
  306661.5853  0.0018 -3.9293 3  719.6151139  71510 303692446      692347        syn-C2H3C(O)NH2, v=0
  306721.9452  0.0033 -5.1293 3   32.6236 37  71510 30318 216      17 117        syn-C2H3C(O)NH2, v=0
  306728.8223  0.0018 -5.9217 3  451.1702 85  71510 303423210      4132 9        syn-C2H3C(O)NH2, v=0
  306728.8223  0.0018 -5.9217 3  451.1702 85  71510 303423211      413210        syn-C2H3C(O)NH2, v=0
  306740.6186  0.0422 -4.7748 3 1195.6974187  71510 303932172      932073        syn-C2H3C(O)NH2, v=0
  306749.5782  0.0200 -3.1650 3  237.5139 87 -71510 30343 736      42 835        syn-C2H3C(O)NH2, v=0
  306776.4692  0.0441 -5.0417 3 1351.0243195  71510 303972869      972770        syn-C2H3C(O)NH2, v=0
  306801.7599  0.0020 -5.0290 3   88.8829 51  71510 30325 917      25 620        syn-C2H3C(O)NH2, v=0
  306825.0197  0.0009 -5.1143 3  237.5139 87  71510 30343 836      42 835        syn-C2H3C(O)NH2, v=0
  306871.3234  0.0017 -5.8549 3  436.3479 85  71510 303423111      413110        syn-C2H3C(O)NH2, v=0
  306871.3234  0.0017 -5.8549 3  436.3479 85  71510 303423112      413111        syn-C2H3C(O)NH2, v=0
  306882.0868  0.0009 -5.1141 3  237.5095 87  71510 30343 736      42 735        syn-C2H3C(O)NH2, v=0
  306939.6907  0.0035 -5.0345 3   91.6646 53  71510 30326 819      26 522        syn-C2H3C(O)NH2, v=0
  306944.0170  0.0200 -4.2226 3  896.8112157 -71510 303782553      782454        syn-C2H3C(O)NH2, v=0
  306957.5511  0.0200 -3.1644 3  237.5095 87 -71510 30343 836      42 735        syn-C2H3C(O)NH2, v=0
  307025.2280  0.0016 -5.7928 3  422.0002 85  71510 303423012      413011        syn-C2H3C(O)NH2, v=0
  307025.2280  0.0016 -5.7928 3  422.0002 85  71510 303423013      413012        syn-C2H3C(O)NH2, v=0
  307087.9228  0.0276 -4.6324 3 1116.7792181  71510 303902170      902071        syn-C2H3C(O)NH2, v=0
  307088.2989  0.0033 -5.1285 3   32.6235 37  71510 30318 316      17 017        syn-C2H3C(O)NH2, v=0
  307146.4113  0.0048 -4.2220 3  896.8035157  71510 303782554      782455        syn-C2H3C(O)NH2, v=0
  307192.2885  0.0015 -5.7347 3  408.1279 85  71510 303422913      412912        syn-C2H3C(O)NH2, v=0
  307192.2885  0.0015 -5.7347 3  408.1279 85  71510 303422914      412913        syn-C2H3C(O)NH2, v=0
  307211.2348  0.0009 -5.1183 3  227.6586 83  71510 303411032      401031        syn-C2H3C(O)NH2, v=0
  307268.1840  0.0162 -4.4118 3  987.4865171  71510 303851867      851768        syn-C2H3C(O)NH2, v=0
  307274.4264  0.0200 -3.5986 3  491.7776111 -71510 303552332      552233        syn-C2H3C(O)NH2, v=0
  307274.4264  0.0200 -3.5986 3  491.7776111 -71510 303552333      552234        syn-C2H3C(O)NH2, v=0
  307325.4215  0.0021 -4.3122 3  237.4683 83  71510 303411229      41 932        syn-C2H3C(O)NH2, v=0
  307374.5903  0.0014 -5.6803 3  394.7316 85  71510 303422814      412813        syn-C2H3C(O)NH2, v=0
  307374.5903  0.0014 -5.6803 3  394.7316 85  71510 303422815      412814        syn-C2H3C(O)NH2, v=0
  307434.2365  0.0009 -5.1838 3  248.1519 83  71510 303411428      401427        syn-C2H3C(O)NH2, v=0
  307490.7323  0.0009 -5.1155 3  232.9225 85  71510 30342 934      41 933        syn-C2H3C(O)NH2, v=0
  307498.1678  0.0284 -5.3268 3 1106.2689175  71510 303872761      862858        syn-C2H3C(O)NH2, v=0
  307508.3552  0.0068 -5.0211 3  111.4059 59  71510 30329 722      29 425        syn-C2H3C(O)NH2, v=0
  307508.4883  0.0546 -5.0230 3 1336.6044197  71510 303982475      982376        syn-C2H3C(O)NH2, v=0
  307519.0773  0.0009 -5.1836 3  248.1550 83  71510 303411427      401426        syn-C2H3C(O)NH2, v=0
  307553.9738  0.0752 -5.2991 3 1488.9188205  71510 303A22973      A22874        syn-C2H3C(O)NH2, v=0
  307573.5697  0.0285 -5.3266 3 1106.2688175  71510 303872760      862859        syn-C2H3C(O)NH2, v=0
  307574.6337  0.0014 -5.6291 3  381.8124 85  71510 303422715      412714        syn-C2H3C(O)NH2, v=0
  307574.6337  0.0014 -5.6291 3  381.8124 85  71510 303422716      412715        syn-C2H3C(O)NH2, v=0
  307615.5035  0.0789 -5.0743 3 1361.2947199  71510 303992376      992277        syn-C2H3C(O)NH2, v=0
  307641.3608  0.0009 -5.0966 3  209.4324 79  71510 303391029      381028        syn-C2H3C(O)NH2, v=0
  307643.7194  0.0024 -5.8595 3   46.2542 35  71510 30317 9 8      17 611        syn-C2H3C(O)NH2, v=0
  307658.1496  0.0030 -3.8434 3  338.2554111  71510 30355 352      55 253        syn-C2H3C(O)NH2, v=0
  307658.1496  0.0030 -3.8434 3  338.2554111  71510 30355 452      55 353        syn-C2H3C(O)NH2, v=0
  307676.0662  0.0578 -4.9201 3 1277.2097193  71510 303962274      962175        syn-C2H3C(O)NH2, v=0
  307763.8823  0.0200 -3.7397 3  432.1941121 -71510 30360 654      60 555        syn-C2H3C(O)NH2, v=0
  307763.8823  0.0200 -3.7397 3  432.1941121 -71510 30360 754      60 655        syn-C2H3C(O)NH2, v=0
  307772.0883  0.0157 -4.4104 3  987.4890171  71510 303851967      851868        syn-C2H3C(O)NH2, v=0
  307791.5137  0.0200 -3.3243 3   95.3796 53 -71510 30326 917      25 818        syn-C2H3C(O)NH2, v=0
  307795.4400  0.0013 -5.5809 3  369.3712 85  71510 303422616      412615        syn-C2H3C(O)NH2, v=0
  307795.4400  0.0013 -5.5809 3  369.3712 85  71510 303422617      412616        syn-C2H3C(O)NH2, v=0
  307850.1133  0.0200 -3.2254 3   86.9180 49 -71510 303241015      23 914        syn-C2H3C(O)NH2, v=0
  307914.8185  0.0200 -3.0350 3   69.1413 33 -71510 3031614 2      1513 3        syn-C2H3C(O)NH2, v=0
  307914.8185  0.0200 -3.0350 3   69.1413 33 -71510 3031614 3      1513 2        syn-C2H3C(O)NH2, v=0
  307954.3010  0.0281 -5.1277 3 1400.9414199  71510 303992872      992773        syn-C2H3C(O)NH2, v=0
  307954.8721  0.0368 -5.5968 3 1650.1334217  71510 303A82980      A82881        syn-C2H3C(O)NH2, v=0
  307993.4631  0.0010 -3.2251 3   86.9138 49  71510 303241014      23 915        syn-C2H3C(O)NH2, v=0
  307993.9645  0.0107 -4.4915 3 1051.7645171  71510 303852659      852560        syn-C2H3C(O)NH2, v=0
  308040.6932  0.0012 -5.5354 3  357.4095 85  71510 303422517      412516        syn-C2H3C(O)NH2, v=0
  308040.6932  0.0012 -5.5354 3  357.4095 85  71510 303422518      412517        syn-C2H3C(O)NH2, v=0
  308044.1185  0.0035 -4.6731 3   39.7839 39  71510 30319 316      18 217        syn-C2H3C(O)NH2, v=0
  308089.6243  0.0026 -3.4314 3  131.7542 63  71510 30331 923      30 822        syn-C2H3C(O)NH2, v=0
  308103.8433  0.0200 -3.5808 3  478.1607109 -71510 303542331      542232        syn-C2H3C(O)NH2, v=0
  308103.8433  0.0200 -3.5808 3  478.1607109 -71510 303542332      542233        syn-C2H3C(O)NH2, v=0
  308111.0912  0.0722 -5.5800 3 1639.8559217  71510 303A82881      A82782        syn-C2H3C(O)NH2, v=0
  308163.7512  0.0011 -5.1008 3  216.7457 81  71510 30340 931      39 930        syn-C2H3C(O)NH2, v=0
  308220.5140  0.0334 -5.5436 3 1622.5321215  71510 303A72979      A72880        syn-C2H3C(O)NH2, v=0
  308231.3067  0.0076 -4.6032 3  718.7415143  71510 303712051      702150        syn-C2H3C(O)NH2, v=0
  308300.6662  0.0009 -5.1130 3  232.8531 85  71510 30342 834      41 833        syn-C2H3C(O)NH2, v=0
  308314.2044  0.0016 -3.8989 3  702.3550137  71510 303682444      682345        syn-C2H3C(O)NH2, v=0
  308314.9301  0.0012 -5.4925 3  345.9286 85  71510 303422418      412417        syn-C2H3C(O)NH2, v=0
  308314.9301  0.0012 -5.4925 3  345.9286 85  71510 303422419      412418        syn-C2H3C(O)NH2, v=0
  308315.0585  0.0200 -3.0722 3   71.3013 37 -71510 3031813 5      1712 6        syn-C2H3C(O)NH2, v=0
  308315.0585  0.0200 -3.0722 3   71.3013 37 -71510 3031813 6      1712 5        syn-C2H3C(O)NH2, v=0
  308319.1630  0.0016 -3.8989 3  702.3548137  71510 303682445      682346        syn-C2H3C(O)NH2, v=0
  308328.2268  0.0042 -6.3839 3  333.4551 97  71510 303481534      491039        syn-C2H3C(O)NH2, v=0
  308331.2934  0.0045 -4.2028 3  283.7509105  71510 30352 151      52 052        syn-C2H3C(O)NH2, v=0
  308331.2934  0.0045 -4.2028 3  283.7509105  71510 30352 251      52 152        syn-C2H3C(O)NH2, v=0
  308373.5751  0.0032 -6.1967 3  448.9085109  71510 303542035      551738        syn-C2H3C(O)NH2, v=0
  308378.0484  0.0022 -5.7130 3   50.6575 37  71510 30318 910      18 613        syn-C2H3C(O)NH2, v=0
  308491.1627  0.0116 -4.8002 3  828.8874153  71510 303762254      752353        syn-C2H3C(O)NH2, v=0
  308522.6511  0.0065 -5.5311 3   71.9923 49  71510 30324 519      24 222        syn-C2H3C(O)NH2, v=0
  308611.0015  0.0200 -3.1129 3   74.9538 41 -71510 3032012 9      1911 8        syn-C2H3C(O)NH2, v=0
  308611.0015  0.0200 -3.1129 3   74.9538 41 -71510 3032012 8      1911 9        syn-C2H3C(O)NH2, v=0
  308623.8031  0.0011 -5.4518 3  334.9306 85  71510 303422319      412318        syn-C2H3C(O)NH2, v=0
  308623.8031  0.0011 -5.4518 3  334.9306 85  71510 303422320      412319        syn-C2H3C(O)NH2, v=0
  308628.2593  0.0200 -3.1612 3   80.1355 45 -71510 303221112      211011        syn-C2H3C(O)NH2, v=0
  308629.6584  0.0200 -3.1612 3   80.1354 45 -71510 303221111      211012        syn-C2H3C(O)NH2, v=0
  308691.8641  0.0027 -6.3977 3  171.9967 65  71510 303321518      331221        syn-C2H3C(O)NH2, v=0
  308701.0478  0.0060 -4.1357 3  816.7153157  71510 303781563      781464        syn-C2H3C(O)NH2, v=0
  308706.7926  0.0452 -5.6485 3 1677.9711219  71510 303A92981      A92882        syn-C2H3C(O)NH2, v=0
  308735.6855  0.0060 -4.1356 3  816.7154157  71510 303781663      781564        syn-C2H3C(O)NH2, v=0
  308768.8153  0.0024 -3.6619 3  291.4185 93  71510 303461135      451234        syn-C2H3C(O)NH2, v=0
  308769.8483  0.0244 -5.2177 3 1051.7326171  71510 303852660      842757        syn-C2H3C(O)NH2, v=0
  308787.8007  0.0027 -6.3975 3  171.9935 65  71510 303321517      331222        syn-C2H3C(O)NH2, v=0
  308812.7365  0.0098 -6.4452 3  625.1398147  71510 30373 667      74 570        syn-C2H3C(O)NH2, v=0
  308812.7365  0.0098 -6.4452 3  625.1398147  71510 30373 767      74 470        syn-C2H3C(O)NH2, v=0
  308843.1622  0.0200 -3.3666 3  109.0935 57 -71510 30328 920      27 819        syn-C2H3C(O)NH2, v=0
  308882.9804  0.0200 -3.5640 3  464.8022107 -71510 303532330      532231        syn-C2H3C(O)NH2, v=0
  308882.9804  0.0200 -3.5640 3  464.8022107 -71510 303532331      532232        syn-C2H3C(O)NH2, v=0
  308920.7441  0.0183 -4.7916 3 1219.7627185  71510 303922766      922667        syn-C2H3C(O)NH2, v=0
  308953.8639  0.0135 -4.9211 3  785.6662151  71510 303751957      742054        syn-C2H3C(O)NH2, v=0
  308964.3658  0.0245 -5.2172 3 1051.7322171  71510 303852659      842758        syn-C2H3C(O)NH2, v=0
  308974.4464  0.0011 -5.4134 3  324.4176 85  71510 303422220      412219        syn-C2H3C(O)NH2, v=0
  308974.4464  0.0011 -5.4134 3  324.4176 85  71510 303422221      412220        syn-C2H3C(O)NH2, v=0
  309013.1434  0.0021 -4.3865 3  216.7457 79  71510 303391227      39 930        syn-C2H3C(O)NH2, v=0
  309028.9839  0.2485 -5.8057 3 1751.5038225  71510 303B22785      B22686        syn-C2H3C(O)NH2, v=0
  309076.0762  0.0099 -4.4885 3 1051.7224171  71510 303852660      852561        syn-C2H3C(O)NH2, v=0
  309096.1476  0.2578 -6.1083 3 1913.3049233  71510 303B63284      B63185        syn-C2H3C(O)NH2, v=0
  309139.7357  0.0009 -5.1590 3  242.2917 83  71510 303411329      401328        syn-C2H3C(O)NH2, v=0
  309148.5256  0.0796 -5.4575 3 1574.8121213  71510 303A62780      A62681        syn-C2H3C(O)NH2, v=0
  309220.1255  0.0045 -6.3807 3  345.7870 99  71510 303491535      501040        syn-C2H3C(O)NH2, v=0
  309274.0423  0.0200 -3.7474 3  469.9358125 -71510 30362 755      62 656        syn-C2H3C(O)NH2, v=0
  309274.0423  0.0200 -3.7474 3  469.9358125 -71510 30362 855      62 756        syn-C2H3C(O)NH2, v=0
  309277.6282  0.0212 -4.7502 3 1196.5000183  71510 303912764      912665        syn-C2H3C(O)NH2, v=0
  309282.7399  0.0057 -4.6283 3  710.8293143  71510 303711953      702050        syn-C2H3C(O)NH2, v=0
  309322.1367  0.0045 -4.1221 3  456.3467115  71510 303571542      561641        syn-C2H3C(O)NH2, v=0
  309376.0051  0.0011 -5.3771 3  314.3926 85  71510 303422121      412120        syn-C2H3C(O)NH2, v=0
  309376.0051  0.0011 -5.3771 3  314.3926 85  71510 303422122      412121        syn-C2H3C(O)NH2, v=0
  309400.6826  0.0335 -5.4891 3 1595.1768213  71510 303A62978      A62879        syn-C2H3C(O)NH2, v=0
  309424.4433  0.0200 -4.1840 3  877.1646155 -71510 303772552      772453        syn-C2H3C(O)NH2, v=0
  309476.5748  0.0031 -6.1938 3  448.8717109  71510 303542034      551739        syn-C2H3C(O)NH2, v=0
  309481.8621  0.0023 -6.1993 3  268.9411 83  71510 303411725      421428        syn-C2H3C(O)NH2, v=0
  309541.6545  0.0043 -4.1837 3  877.1602155  71510 303772553      772454        syn-C2H3C(O)NH2, v=0
  309570.5736  0.0020 -4.2940 3   50.0592 41  71510 30320 615      19 316        syn-C2H3C(O)NH2, v=0
  309571.4583  0.0200 -3.2464 3  232.8531 85 -71510 30342 934      41 833        syn-C2H3C(O)NH2, v=0
  309614.6880  0.0200 -3.5482 3  451.7012105 -71510 303522329      522230        syn-C2H3C(O)NH2, v=0
  309614.6880  0.0200 -3.5482 3  451.7012105 -71510 303522330      522231        syn-C2H3C(O)NH2, v=0
  309729.7165  0.0023 -3.4117 3  123.8962 61  71510 30330 922      29 821        syn-C2H3C(O)NH2, v=0
  309813.7646  0.0023 -6.1984 3  268.9301 83  71510 303411724      421429        syn-C2H3C(O)NH2, v=0
  309814.8248  0.0009 -5.1572 3  242.3208 83  71510 303411328      401327        syn-C2H3C(O)NH2, v=0
  309840.4189  0.0010 -5.3427 3  304.8592 85  71510 303422023      412022        syn-C2H3C(O)NH2, v=0
  309840.4190  0.0010 -5.3427 3  304.8592 85  71510 303422022      412021        syn-C2H3C(O)NH2, v=0
  309875.3456  0.0200 -3.8694 3  685.3629135 -71510 303672443      672344        syn-C2H3C(O)NH2, v=0
  309877.9160  0.0015 -3.8694 3  685.3628135  71510 303672444      672345        syn-C2H3C(O)NH2, v=0
  309985.1167  0.0200 -3.7847 3  372.7598115 -71510 30357 453      57 354        syn-C2H3C(O)NH2, v=0
  309985.1167  0.0200 -3.7847 3  372.7598115 -71510 30357 553      57 454        syn-C2H3C(O)NH2, v=0
  310039.2636  0.0200 -3.3888 3  116.3395 59 -71510 30329 921      28 820        syn-C2H3C(O)NH2, v=0
  310047.1296  0.0018 -6.2160 3   17.3335 23  71510 30311 7 5      10 4 6        syn-C2H3C(O)NH2, v=0
  310047.8947  0.0364 -4.7659 3 1195.7184187  71510 303932272      932173        syn-C2H3C(O)NH2, v=0
  310069.2645  0.0665 -5.1748 3 1422.4551203  71510 303A12577      A12478        syn-C2H3C(O)NH2, v=0
  310126.6390  0.0023 -5.8558 3   46.1714 35  71510 30317 9 9      17 612        syn-C2H3C(O)NH2, v=0
  310166.1860  0.0040 -6.3973 3  321.3057 95  71510 303471533      481038        syn-C2H3C(O)NH2, v=0
  310289.2904  0.0207 -5.1117 3  998.6415167  71510 303832559      822656        syn-C2H3C(O)NH2, v=0
  310301.4532  0.0200 -3.5335 3  438.8571103 -71510 303512328      512229        syn-C2H3C(O)NH2, v=0
  310301.4532  0.0200 -3.5335 3  438.8571103 -71510 303512329      512230        syn-C2H3C(O)NH2, v=0
  310310.4996  0.0044 -4.0632 3  769.0914153  71510 303761462      761363        syn-C2H3C(O)NH2, v=0
  310321.3505  0.0044 -4.0632 3  769.0914153  71510 303761562      761463        syn-C2H3C(O)NH2, v=0
  310383.6271  0.0010 -5.3101 3  295.8222 85  71510 303421924      411923        syn-C2H3C(O)NH2, v=0
  310383.6274  0.0010 -5.3101 3  295.8222 85  71510 303421923      411922        syn-C2H3C(O)NH2, v=0
  310411.6394  0.0045 -5.2304 3   81.7129 51  71510 30325 719      25 422        syn-C2H3C(O)NH2, v=0
  310468.1923  0.0009 -5.1221 3  232.2481 83  71510 303411131      401130        syn-C2H3C(O)NH2, v=0
  310483.7307  0.0090 -6.4493 3  549.9870139  71510 30369 564      70 467        syn-C2H3C(O)NH2, v=0
  310483.7307  0.0090 -6.4493 3  549.9870139  71510 30369 664      70 367        syn-C2H3C(O)NH2, v=0
  310489.0907  0.0200 -3.7673 3  508.9429129 -71510 30364 856      64 757        syn-C2H3C(O)NH2, v=0
  310489.0907  0.0200 -3.7673 3  508.9429129 -71510 30364 956      64 857        syn-C2H3C(O)NH2, v=0
  310507.7692  0.0024 -6.0154 3   41.9832 33  71510 30316 9 7      16 610        syn-C2H3C(O)NH2, v=0
  310518.9149  0.0049 -6.4445 3  286.1950 91  71510 303451333      46 838        syn-C2H3C(O)NH2, v=0
  310539.1835  0.0580 -5.6985 3 1706.0357221  71510 303B02982      B02883        syn-C2H3C(O)NH2, v=0
  310596.2028  0.0022 -4.9764 3   95.2521 53  71510 30326 918      26 621        syn-C2H3C(O)NH2, v=0
  310612.8491  0.0228 -4.5330 3 1062.0551177  71510 303881969      881870        syn-C2H3C(O)NH2, v=0
  310650.8966  0.0009 -5.1369 3  237.0241 83  71510 303411230      401229        syn-C2H3C(O)NH2, v=0
  310652.0764  0.0032 -4.6688 3   39.7834 39  71510 30319 416      18 117        syn-C2H3C(O)NH2, v=0
  310779.5218  0.0210 -5.1103 3  998.6404167  71510 303832558      822657        syn-C2H3C(O)NH2, v=0
  310834.9184  0.0121 -4.3207 3  935.7004167  71510 303831766      831667        syn-C2H3C(O)NH2, v=0
  310945.7434  0.0200 -3.5198 3  426.2692101 -71510 303502327      502228        syn-C2H3C(O)NH2, v=0
  310945.7434  0.0200 -3.5198 3  426.2692101 -71510 303502328      502229        syn-C2H3C(O)NH2, v=0
  310958.4319  0.0035 -6.2444 3  514.2034117  71510 303582138      591841        syn-C2H3C(O)NH2, v=0
  311017.6114  0.0119 -4.3202 3  935.7012167  71510 303831866      831767        syn-C2H3C(O)NH2, v=0
  311027.5072  0.0010 -5.2792 3  287.2878 85  71510 303421825      411824        syn-C2H3C(O)NH2, v=0
  311027.5131  0.0010 -5.2792 3  287.2878 85  71510 303421824      411823        syn-C2H3C(O)NH2, v=0
  311134.7322  0.0038 -3.9630 3  316.2605109  71510 30354 252      54 153        syn-C2H3C(O)NH2, v=0
  311134.7322  0.0038 -3.9630 3  316.2605109  71510 30354 352      54 253        syn-C2H3C(O)NH2, v=0
  311267.6237  0.0200 -3.5039 3  264.0289 89 -71510 303441034      431133        syn-C2H3C(O)NH2, v=0
  311277.0630  0.0276 -5.0736 3 1375.6791197  71510 303982871      982772        syn-C2H3C(O)NH2, v=0
  311343.1939  0.0200 -3.8410 3  668.6381133 -71510 303662442      662343        syn-C2H3C(O)NH2, v=0
  311344.5487  0.0200 -3.8410 3  668.6381133 -71510 303662443      662344        syn-C2H3C(O)NH2, v=0
  311362.3555  0.0350 -5.4336 3 1568.0767211  71510 303A52977      A52878        syn-C2H3C(O)NH2, v=0
  311380.9615  0.0036 -4.7062 3  148.3047 65  71510 303321121      32 824        syn-C2H3C(O)NH2, v=0
  311386.4971  0.0034 -3.9968 3  722.6698149  71510 303741361      741262        syn-C2H3C(O)NH2, v=0
  311389.7034  0.0034 -3.9968 3  722.6698149  71510 303741461      741362        syn-C2H3C(O)NH2, v=0
  311391.2144  0.0200 -3.7974 3  549.2073133 -71510 30366 957      66 858        syn-C2H3C(O)NH2, v=0
  311391.2144  0.0200 -3.7974 3  549.2073133 -71510 303661057      66 958        syn-C2H3C(O)NH2, v=0
  311394.5894  0.0093 -4.4461 3 1030.2415169  71510 303842658      842559        syn-C2H3C(O)NH2, v=0
  311447.0330  0.0218 -4.5308 3 1062.0595177  71510 303882069      881970        syn-C2H3C(O)NH2, v=0
  311549.9983  0.0200 -3.5072 3  413.9371 99 -71510 303492326      492227        syn-C2H3C(O)NH2, v=0
  311549.9983  0.0200 -3.5072 3  413.9371 99 -71510 303492327      492228        syn-C2H3C(O)NH2, v=0
  311593.2884  0.0045 -4.1764 3   59.8544 45  71510 30322 517      21 418        syn-C2H3C(O)NH2, v=0
  311594.3460  0.0047 -4.2147 3  507.0844121  71510 303601644      591743        syn-C2H3C(O)NH2, v=0
  311728.1180  0.0200 -4.1466 3  857.7957153 -71510 303762551      762452        syn-C2H3C(O)NH2, v=0
  311781.5219  0.0023 -6.0133 3   41.9407 33  71510 30316 9 8      16 611        syn-C2H3C(O)NH2, v=0
  311795.0668  0.0038 -4.1464 3  857.7932153  71510 303762552      762453        syn-C2H3C(O)NH2, v=0
  311803.1530  0.0010 -5.2500 3  279.2643 85  71510 303421726      411725        syn-C2H3C(O)NH2, v=0
  311803.2522  0.0010 -5.2500 3  279.2643 85  71510 303421725      411724        syn-C2H3C(O)NH2, v=0
  311959.6428  0.0200 -3.8363 3  590.7208137 -71510 303681058      68 959        syn-C2H3C(O)NH2, v=0
  311959.6428  0.0200 -3.8363 3  590.7208137 -71510 303681158      681059        syn-C2H3C(O)NH2, v=0
  311964.6144  0.0011 -5.0763 3  261.1760 99  71510 30349 247      48 246        syn-C2H3C(O)NH2, v=0
  311964.6075  0.0200 -2.9207 3  261.1760 99 -71510 30349 247      48 346        syn-C2H3C(O)NH2, v=0
  311964.6075  0.0200 -2.9207 3  261.1760 99 -71510 30349 347      48 246        syn-C2H3C(O)NH2, v=0
  311964.6144  0.0011 -5.0763 3  261.1760 99  71510 30349 347      48 346        syn-C2H3C(O)NH2, v=0
  311966.5041  0.0012 -5.0663 3  262.2120101  71510 30350 149      49 148        syn-C2H3C(O)NH2, v=0
  311966.4996  0.0200 -2.8876 3  262.2120101 -71510 30350 149      49 248        syn-C2H3C(O)NH2, v=0
  311966.4996  0.0200 -2.8876 3  262.2120101 -71510 30350 249      49 148        syn-C2H3C(O)NH2, v=0
  311966.5041  0.0012 -5.0663 3  262.2120101  71510 30350 249      49 248        syn-C2H3C(O)NH2, v=0
  311976.0539  0.0014 -5.0555 3  262.7363103  71510 30351 051      50 050        syn-C2H3C(O)NH2, v=0
  311976.0250  0.0200 -2.8563 3  262.7363103 -71510 30351 051      50 150        syn-C2H3C(O)NH2, v=0
  311976.0250  0.0200 -2.8563 3  262.7363103 -71510 30351 151      50 050        syn-C2H3C(O)NH2, v=0
  311976.0539  0.0014 -5.0555 3  262.7363103  71510 30351 151      50 150        syn-C2H3C(O)NH2, v=0
  311980.8603  0.0010 -5.0853 3  259.6171 97  71510 30348 345      47 344        syn-C2H3C(O)NH2, v=0
  311980.8383  0.0200 -2.9562 3  259.6171 97 -71510 30348 345      47 444        syn-C2H3C(O)NH2, v=0
  311980.8383  0.0200 -2.9562 3  259.6171 97 -71510 30348 445      47 344        syn-C2H3C(O)NH2, v=0
  311980.8603  0.0010 -5.0853 3  259.6171 97  71510 30348 445      47 444        syn-C2H3C(O)NH2, v=0
  311990.6337  0.0027 -3.9365 3  677.4611145  71510 303721260      721161        syn-C2H3C(O)NH2, v=0
  311991.5247  0.0027 -3.9365 3  677.4611145  71510 303721360      721261        syn-C2H3C(O)NH2, v=0
  312007.1985  0.0018 -6.2156 3   17.2682 23  71510 30311 7 4      10 4 7        syn-C2H3C(O)NH2, v=0
  312032.1328  0.0200 -2.9950 3  257.5205 95 -71510 30347 443      46 542        syn-C2H3C(O)NH2, v=0
  312032.1287  0.0009 -5.0933 3  257.5205 95  71510 30347 543      46 542        syn-C2H3C(O)NH2, v=0
  312032.1296  0.0009 -5.0933 3  257.5205 95  71510 30347 443      46 442        syn-C2H3C(O)NH2, v=0
  312032.1328  0.0200 -2.9950 3  257.5205 95 -71510 30347 543      46 442        syn-C2H3C(O)NH2, v=0
  312035.2767  0.0174 -5.0089 3  946.9994163  71510 303812458      802555        syn-C2H3C(O)NH2, v=0
  312053.8907  0.0089 -4.4442 3 1030.2160169  71510 303842659      842560        syn-C2H3C(O)NH2, v=0
  312062.2629  0.0200 -3.7573 3  408.5530119 -71510 30359 554      59 455        syn-C2H3C(O)NH2, v=0
  312062.2629  0.0200 -3.7573 3  408.5530119 -71510 30359 654      59 555        syn-C2H3C(O)NH2, v=0
  312080.2424  0.0010 -5.1074 3  222.8115 81  71510 303401129      391128        syn-C2H3C(O)NH2, v=0
  312116.1792  0.0200 -3.4956 3  401.8600 97 -71510 303482325      482226        syn-C2H3C(O)NH2, v=0
  312116.1792  0.0200 -3.4956 3  401.8600 97 -71510 303482326      482227        syn-C2H3C(O)NH2, v=0
  312146.8594  0.0200 -3.0384 3  254.8656 93 -71510 30346 541      45 640        syn-C2H3C(O)NH2, v=0
  312146.8373  0.0009 -5.1000 3  254.8656 93  71510 30346 641      45 640        syn-C2H3C(O)NH2, v=0
  312146.8808  0.0009 -5.1000 3  254.8656 93  71510 30346 541      45 540        syn-C2H3C(O)NH2, v=0
  312146.8594  0.0200 -3.0384 3  254.8656 93 -71510 30346 641      45 540        syn-C2H3C(O)NH2, v=0
  312169.4183  0.0023 -3.8829 3  633.4751141  71510 303701159      701060        syn-C2H3C(O)NH2, v=0
  312169.6502  0.0023 -3.8829 3  633.4751141  71510 303701259      701160        syn-C2H3C(O)NH2, v=0
  312181.7402  0.4051 -6.2369 3 1979.5503239  71510 303B92990      B92891        syn-C2H3C(O)NH2, v=0
  312264.8060  0.0035 -6.2409 3  514.1599117  71510 303582137      591842        syn-C2H3C(O)NH2, v=0
  312365.9975  0.0169 -4.7417 3 1196.3772183  71510 303912765      912666        syn-C2H3C(O)NH2, v=0
  312373.8480  0.0200 -3.0884 3  251.6232 91 -71510 30345 639      44 738        syn-C2H3C(O)NH2, v=0
  312375.5003  0.0009 -5.1053 3  251.6232 91  71510 30345 739      44 738        syn-C2H3C(O)NH2, v=0
  312376.9290  0.0009 -5.1053 3  251.6231 91  71510 30345 639      44 638        syn-C2H3C(O)NH2, v=0
  312378.5833  0.0200 -3.0884 3  251.6231 91 -71510 30345 739      44 638        syn-C2H3C(O)NH2, v=0
  312488.8465  0.0036 -5.6984 3   25.2260 31  71510 30315 510      14 213        syn-C2H3C(O)NH2, v=0
  312489.2523  0.0030 -6.3813 3   38.6991 35  71510 30317 710      17 215        syn-C2H3C(O)NH2, v=0
  312646.3714  0.0200 -3.4853 3  390.0374 95 -71510 303472324      472225        syn-C2H3C(O)NH2, v=0
  312646.3714  0.0200 -3.4853 3  390.0374 95 -71510 303472325      472226        syn-C2H3C(O)NH2, v=0
  312661.1150  0.0024 -6.1896 3   37.9871 31  71510 30315 9 6      15 6 9        syn-C2H3C(O)NH2, v=0
  312714.4730  0.0790 -5.3326 3 1510.8746209  71510 303A42679      A42580        syn-C2H3C(O)NH2, v=0
  312716.0756  0.0048 -6.3859 3  358.3057101  71510 303501536      511041        syn-C2H3C(O)NH2, v=0
  312719.4989  0.0200 -3.2318 3  243.1793 87 -71510 30343 835      42 934        syn-C2H3C(O)NH2, v=0
  312724.4720  0.0013 -3.8134 3  652.1795131  71510 303652441      652342        syn-C2H3C(O)NH2, v=0
  312725.1626  0.0013 -3.8134 3  652.1795131  71510 303652442      652343        syn-C2H3C(O)NH2, v=0
  312756.5152  0.0009 -5.2221 3  271.7638 85  71510 303421627      411626        syn-C2H3C(O)NH2, v=0
  312757.9110  0.0009 -5.2221 3  271.7638 85  71510 303421626      411625        syn-C2H3C(O)NH2, v=0
  312763.6964  0.0200 -3.1492 3  247.7485 89 -71510 30344 737      43 836        syn-C2H3C(O)NH2, v=0
  312769.5742  0.0469 -4.9065 3 1277.2443193  71510 303962374      962275        syn-C2H3C(O)NH2, v=0
  312806.2687  0.0009 -5.1086 3  247.7485 89  71510 30344 837      43 836        syn-C2H3C(O)NH2, v=0
  312810.7035  0.0951 -5.7698 3 1126.1566181  71510 303902269      892366        syn-C2H3C(O)NH2, v=0
  312839.1542  0.0009 -5.1085 3  247.7460 89  71510 30344 737      43 736        syn-C2H3C(O)NH2, v=0
  312873.1995  0.0060 -5.9093 3   57.5759 45  71510 30322 418      22 121        syn-C2H3C(O)NH2, v=0
  312881.7419  0.0200 -3.1489 3  247.7460 89 -71510 30344 837      43 736        syn-C2H3C(O)NH2, v=0
  312940.3190  0.0994 -6.4579 3 1687.7879213  71510 303A63671      A53768        syn-C2H3C(O)NH2, v=0
  312940.3328  0.0994 -6.4579 3 1687.7879213  71510 303A63670      A53769        syn-C2H3C(O)NH2, v=0
  312998.8601  0.0872 -5.6232 3 1667.5306219  71510 303A92882      A92783        syn-C2H3C(O)NH2, v=0
  313042.7250  0.0887 -6.3218 3 1619.8743209  71510 303A43570      A33667        syn-C2H3C(O)NH2, v=0
  313042.7653  0.0887 -6.3218 3 1619.8743209  71510 303A43569      A33668        syn-C2H3C(O)NH2, v=0
  313064.9286  0.0040 -6.3099 3  583.9482125  71510 303622241      631944        syn-C2H3C(O)NH2, v=0
  313084.4602  0.0011 -5.0986 3  227.0250 83  71510 30341 932      40 931        syn-C2H3C(O)NH2, v=0
  313085.2722  0.0359 -4.9810 3 1326.2127193  71510 303962868      962769        syn-C2H3C(O)NH2, v=0
  313142.4114  0.0200 -3.4761 3  378.4688 93 -71510 303462323      462224        syn-C2H3C(O)NH2, v=0
  313142.4114  0.0200 -3.4761 3  378.4688 93 -71510 303462324      462225        syn-C2H3C(O)NH2, v=0
  313227.0079  0.0789 -6.1885 3 1553.3868205  71510 303A23469      A13566        syn-C2H3C(O)NH2, v=0
  313227.1240  0.0789 -6.1885 3 1553.3868205  71510 303A23468      A13567        syn-C2H3C(O)NH2, v=0
  313238.0928  0.0181 -5.0055 3  946.9964163  71510 303812457      802556        syn-C2H3C(O)NH2, v=0
  313272.9130  0.0023 -6.1886 3   37.9667 31  71510 30315 9 7      15 610        syn-C2H3C(O)NH2, v=0
  313383.4419  0.0031 -6.4024 3  560.2504 87  71510 3034338 5      4238 4        syn-C2H3C(O)NH2, v=0
  313383.4419  0.0031 -6.4024 3  560.2504 87  71510 3034338 6      4238 5        syn-C2H3C(O)NH2, v=0
  313397.5099  0.0027 -4.3132 3  248.0743 85  71510 303421230      42 933        syn-C2H3C(O)NH2, v=0
  313458.8672  0.0315 -4.6622 3 1139.2230183  71510 303912071      911972        syn-C2H3C(O)NH2, v=0
  313468.6900  0.0741 -5.7470 3 1734.3182223  71510 303B12983      B12884        syn-C2H3C(O)NH2, v=0
  313484.2758  0.0009 -5.1097 3  243.1793 87  71510 30343 935      42 934        syn-C2H3C(O)NH2, v=0
  313487.9299  0.0028 -6.2916 3  542.5943 87  71510 3034337 6      4237 5        syn-C2H3C(O)NH2, v=0
  313487.9299  0.0028 -6.2916 3  542.5943 87  71510 3034337 7      4237 6        syn-C2H3C(O)NH2, v=0
  313504.4693  0.0699 -6.0582 3 1488.3272201  71510 303A03368      993465        syn-C2H3C(O)NH2, v=0
  313504.8002  0.0699 -6.0582 3 1488.3272201  71510 303A03367      993466        syn-C2H3C(O)NH2, v=0
  313514.8472  0.1875 -5.6145 3 1656.3774219  71510 303A92683      A92584        syn-C2H3C(O)NH2, v=0
  313542.6163  0.0090 -4.2357 3  885.0829163  71510 303811665      811566        syn-C2H3C(O)NH2, v=0
  313597.9939  0.0025 -6.1940 3  525.4101 87  71510 3034336 7      4236 6        syn-C2H3C(O)NH2, v=0
  313597.9939  0.0025 -6.1940 3  525.4101 87  71510 3034336 8      4236 7        syn-C2H3C(O)NH2, v=0
  313605.3572  0.0089 -4.2355 3  885.0832163  71510 303811765      811666        syn-C2H3C(O)NH2, v=0
  313606.1361  0.0200 -3.4681 3  367.1537 91 -71510 303452322      452223        syn-C2H3C(O)NH2, v=0
  313606.1361  0.0200 -3.4681 3  367.1537 91 -71510 303452323      452224        syn-C2H3C(O)NH2, v=0
  313622.3426  0.0009 -5.1109 3  237.9060 85  71510 303421033      411032        syn-C2H3C(O)NH2, v=0
  313639.9374  0.1648 -5.7948 3 1756.2599223  71510 303B13180      B13081        syn-C2H3C(O)NH2, v=0
  313710.5852  0.0200 -3.8513 3  350.0737113 -71510 30356 353      56 254        syn-C2H3C(O)NH2, v=0
  313710.5852  0.0200 -3.8513 3  350.0737113 -71510 30356 453      56 354        syn-C2H3C(O)NH2, v=0
  313714.3823  0.0023 -6.1064 3  508.6983 87  71510 3034335 8      4235 7        syn-C2H3C(O)NH2, v=0
  313714.3823  0.0023 -6.1064 3  508.6983 87  71510 3034335 9      4235 8        syn-C2H3C(O)NH2, v=0
  313768.7985  0.0041 -4.4051 3  222.7552 81  71510 303401129      40 832        syn-C2H3C(O)NH2, v=0
  313779.7162  0.0179 -4.6981 3 1173.3540181  71510 303902763      902664        syn-C2H3C(O)NH2, v=0
  313837.9574  0.0021 -6.0267 3  492.4593 87  71510 3034334 9      4234 8        syn-C2H3C(O)NH2, v=0
  313837.9574  0.0021 -6.0267 3  492.4593 87  71510 303433410      4234 9        syn-C2H3C(O)NH2, v=0
  313876.6602  0.0034 -4.1103 3  838.7026151  71510 303752550      752451        syn-C2H3C(O)NH2, v=0
  313878.9701  0.0200 -3.7508 3  445.6274123 -71510 30361 655      61 556        syn-C2H3C(O)NH2, v=0
  313878.9701  0.0200 -3.7508 3  445.6274123 -71510 30361 755      61 656        syn-C2H3C(O)NH2, v=0
  313888.7377  0.0618 -5.9307 3 1424.6973197  71510 303983267      973364        syn-C2H3C(O)NH2, v=0
  313889.6691  0.0618 -5.9307 3 1424.6973197  71510 303983266      973365        syn-C2H3C(O)NH2, v=0
  313892.5273  0.0144 -4.9103 3  896.8112159  71510 303792357      782454        syn-C2H3C(O)NH2, v=0
  313914.3819  0.0034 -4.1102 3  838.7012151  71510 303752551      752452        syn-C2H3C(O)NH2, v=0
  313942.8533  0.0066 -4.6719 3  729.0230145  71510 303721954      712051        syn-C2H3C(O)NH2, v=0
  313950.0021  0.0049 -4.3069 3  560.4890127  71510 303631746      621845        syn-C2H3C(O)NH2, v=0
  313955.0516  0.0363 -5.3775 3 1541.2400209  71510 303A42976      A42877        syn-C2H3C(O)NH2, v=0
  313955.8829  0.0009 -5.1955 3  264.8030 85  71510 303421528      411527        syn-C2H3C(O)NH2, v=0
  313969.7173  0.0019 -5.9534 3  476.6936 87  71510 303433310      4233 9        syn-C2H3C(O)NH2, v=0
  313969.7173  0.0019 -5.9534 3  476.6936 87  71510 303433311      423310        syn-C2H3C(O)NH2, v=0
  313972.2103  0.0009 -5.1954 3  264.8036 85  71510 303421527      411526        syn-C2H3C(O)NH2, v=0
  313979.0356  0.0021 -5.3873 3   27.5139 31  71510 30315 6 9      14 312        syn-C2H3C(O)NH2, v=0
  313990.2232  0.0009 -5.1082 3  243.1369 87  71510 30343 835      42 834        syn-C2H3C(O)NH2, v=0
  314025.1919  0.0200 -3.7868 3  635.9860129 -71510 303642440      642341        syn-C2H3C(O)NH2, v=0
  314025.1919  0.0200 -3.7868 3  635.9860129 -71510 303642441      642342        syn-C2H3C(O)NH2, v=0
  314039.2786  0.0200 -3.4615 3  356.0915 89 -71510 303442321      442222        syn-C2H3C(O)NH2, v=0
  314039.2786  0.0200 -3.4615 3  356.0915 89 -71510 303442322      442223        syn-C2H3C(O)NH2, v=0
  314065.7188  0.0049 -6.4108 3  327.2874 97  71510 303481435      49 940        syn-C2H3C(O)NH2, v=0
  314110.8232  0.0018 -5.8856 3  461.4016 87  71510 303433211      423210        syn-C2H3C(O)NH2, v=0
  314110.8232  0.0018 -5.8856 3  461.4016 87  71510 303433212      423211        syn-C2H3C(O)NH2, v=0
  314162.2847  0.0200 -3.3434 3  248.3674 87 -71510 30343 934      421033        syn-C2H3C(O)NH2, v=0
  314215.2184  0.0024 -6.1723 3  319.8504 91  71510 303451828      461531        syn-C2H3C(O)NH2, v=0
  314262.6329  0.0017 -5.8223 3  446.5840 87  71510 303433112      423111        syn-C2H3C(O)NH2, v=0
  314262.6329  0.0017 -5.8223 3  446.5840 87  71510 303433113      423112        syn-C2H3C(O)NH2, v=0
  314290.8697  0.0024 -6.3867 3   34.2586 29  71510 30314 9 5      14 6 8        syn-C2H3C(O)NH2, v=0
  314358.6311  0.0103 -4.8156 3  766.4305149  71510 303741956      732053        syn-C2H3C(O)NH2, v=0
  314370.8893  0.0047 -4.2086 3  294.5609107  71510 30353 152      53 053        syn-C2H3C(O)NH2, v=0
  314370.8893  0.0047 -4.2086 3  294.5609107  71510 30353 252      53 153        syn-C2H3C(O)NH2, v=0
  314396.3383  0.0544 -5.8062 3 1362.4989193  71510 303963166      953263        syn-C2H3C(O)NH2, v=0
  314398.9254  0.0544 -5.8061 3 1362.4989193  71510 303963165      953264        syn-C2H3C(O)NH2, v=0
  314422.7185  0.0010 -5.1266 3  237.2316 83  71510 303411229      401228        syn-C2H3C(O)NH2, v=0
  314426.7430  0.0016 -5.7632 3  432.2415 87  71510 303433013      423012        syn-C2H3C(O)NH2, v=0
  314426.7430  0.0016 -5.7632 3  432.2415 87  71510 303433014      423013        syn-C2H3C(O)NH2, v=0
  314443.4430  0.0200 -3.4561 3  345.2817 87 -71510 303432320      432221        syn-C2H3C(O)NH2, v=0
  314443.4430  0.0200 -3.4561 3  345.2817 87 -71510 303432321      432222        syn-C2H3C(O)NH2, v=0
  314476.6462  0.0030 -4.3956 3   47.2092 41  71510 30320 516      19 217        syn-C2H3C(O)NH2, v=0
  314483.9679  0.0082 -4.4022 3 1009.0068167  71510 303832657      832558        syn-C2H3C(O)NH2, v=0
  314564.7037  0.0024 -6.3862 3   34.2495 29  71510 30314 9 6      14 6 9        syn-C2H3C(O)NH2, v=0
  314576.3001  0.0200 -3.2223 3   92.8929 51 -71510 303251016      24 915        syn-C2H3C(O)NH2, v=0
  314594.6053  0.0040 -6.3059 3  583.8972125  71510 303622240      631945        syn-C2H3C(O)NH2, v=0
  314605.0423  0.0015 -5.7076 3  418.3747 87  71510 303432914      422913        syn-C2H3C(O)NH2, v=0
  314605.0423  0.0015 -5.7076 3  418.3747 87  71510 303432915      422914        syn-C2H3C(O)NH2, v=0
  314635.6313  0.0024 -6.1713 3  319.8363 91  71510 303451827      461532        syn-C2H3C(O)NH2, v=0
  314718.9739  0.0054 -6.3922 3  658.1402133  71510 303662344      672047        syn-C2H3C(O)NH2, v=0
  314755.0265  0.0200 -3.2259 3  243.1369 87 -71510 30343 935      42 834        syn-C2H3C(O)NH2, v=0
  314775.1057  0.0200 -2.9876 3   71.8610 31 -71510 3031515 0      1414 1        syn-C2H3C(O)NH2, v=0
  314775.1057  0.0200 -2.9876 3   71.8610 31 -71510 3031515 1      1414 0        syn-C2H3C(O)NH2, v=0
  314779.0414  0.0265 -5.0199 3 1350.6978195  71510 303972870      972771        syn-C2H3C(O)NH2, v=0
  314799.7808  0.0014 -5.6553 3  404.9845 87  71510 303432815      422814        syn-C2H3C(O)NH2, v=0
  314799.7808  0.0014 -5.6553 3  404.9845 87  71510 303432816      422815        syn-C2H3C(O)NH2, v=0
  314813.0689  0.0294 -4.6586 3 1139.2307183  71510 303912171      912072        syn-C2H3C(O)NH2, v=0
  314820.0884  0.0200 -3.4522 3  334.7239 85 -71510 303422319      422220        syn-C2H3C(O)NH2, v=0
  314820.0884  0.0200 -3.4522 3  334.7239 85 -71510 303422320      422221        syn-C2H3C(O)NH2, v=0
  314838.8553  0.0172 -4.4353 3 1008.4844173  71510 303861868      861769        syn-C2H3C(O)NH2, v=0
  314860.6011  0.0103 -4.6981 3  782.0699149  71510 303742153      732252        syn-C2H3C(O)NH2, v=0
  314879.9847  0.0010 -3.2216 3   92.8842 51  71510 303251015      24 916        syn-C2H3C(O)NH2, v=0
  314880.0022  0.0080 -4.4011 3 1008.9916167  71510 303832658      832559        syn-C2H3C(O)NH2, v=0
  314880.1175  0.0038 -6.4231 3  309.3331 93  71510 303461532      471037        syn-C2H3C(O)NH2, v=0
  314908.1233  0.0018 -5.9906 3   20.1128 25  71510 30312 7 6      11 4 7        syn-C2H3C(O)NH2, v=0
  314930.8152  0.0071 -4.6663 3  755.0673147  71510 303732054      722151        syn-C2H3C(O)NH2, v=0
  315005.0844  0.0066 -4.8416 3  137.7972 65  71510 30332 824      32 527        syn-C2H3C(O)NH2, v=0
  315013.6581  0.0013 -5.6059 3  392.0719 87  71510 303432716      422715        syn-C2H3C(O)NH2, v=0
  315013.6581  0.0013 -5.6059 3  392.0719 87  71510 303432717      422716        syn-C2H3C(O)NH2, v=0
  315047.3268  0.0477 -5.6844 3 1301.7342189  71510 303943065      933162        syn-C2H3C(O)NH2, v=0
  315054.4091  0.0477 -5.6844 3 1301.7342189  71510 303943064      933163        syn-C2H3C(O)NH2, v=0
  315151.4376  0.0169 -4.4344 3 1008.4859173  71510 303861968      861869        syn-C2H3C(O)NH2, v=0
  315170.6970  0.0200 -3.4499 3  324.4176 83 -71510 303412318      412219        syn-C2H3C(O)NH2, v=0
  315170.6970  0.0200 -3.4499 3  324.4176 83 -71510 303412319      412220        syn-C2H3C(O)NH2, v=0
  315201.4258  0.0200 -3.0236 3   73.0427 35 -71510 3031714 3      1613 4        syn-C2H3C(O)NH2, v=0
  315201.4258  0.0200 -3.0236 3   73.0427 35 -71510 3031714 4      1613 3        syn-C2H3C(O)NH2, v=0
  315206.3382  0.0024 -6.2922 3  212.9783 73  71510 303361621      371324        syn-C2H3C(O)NH2, v=0
  315249.9402  0.0013 -5.5593 3  379.6382 87  71510 303432617      422616        syn-C2H3C(O)NH2, v=0
  315249.9402  0.0013 -5.5593 3  379.6382 87  71510 303432618      422617        syn-C2H3C(O)NH2, v=0
  315250.1941  0.0200 -3.7612 3  620.0565127 -71510 303632439      632340        syn-C2H3C(O)NH2, v=0
  315250.1941  0.0200 -3.7612 3  620.0565127 -71510 303632440      632341        syn-C2H3C(O)NH2, v=0
  315305.4348  0.0590 -5.0539 3 1361.3506199  71510 303992476      992377        syn-C2H3C(O)NH2, v=0
  315324.8462  0.0606 -5.2316 3 1462.7321203  71510 303A12972      A12873        syn-C2H3C(O)NH2, v=0
  315339.2333  0.0024 -6.2919 3  212.9739 73  71510 303361620      371325        syn-C2H3C(O)NH2, v=0
  315422.7974  0.0200 -3.7597 3  483.9756127 -71510 30363 756      63 657        syn-C2H3C(O)NH2, v=0
  315422.7974  0.0200 -3.7597 3  483.9756127 -71510 30363 856      63 757        syn-C2H3C(O)NH2, v=0
  315467.2498  0.0009 -5.0845 3  219.6943 81  71510 303401030      391029        syn-C2H3C(O)NH2, v=0
  315479.8230  0.0009 -5.1699 3  258.4068 85  71510 303421429      411428        syn-C2H3C(O)NH2, v=0
  315496.7499  0.0200 -3.4491 3  314.3624 81 -71510 303402317      402218        syn-C2H3C(O)NH2, v=0
  315496.7499  0.0200 -3.4491 3  314.3624 81 -71510 303402318      402219        syn-C2H3C(O)NH2, v=0
  315512.6145  0.0012 -5.5152 3  367.6846 87  71510 303432518      422517        syn-C2H3C(O)NH2, v=0
  315512.6145  0.0012 -5.5152 3  367.6846 87  71510 303432519      422518        syn-C2H3C(O)NH2, v=0
  315547.2446  0.0117 -4.8173 3  848.0842155  71510 303772256      762353        syn-C2H3C(O)NH2, v=0
  315566.2667  0.0066 -4.1566 3  835.6474159  71510 303791564      791465        syn-C2H3C(O)NH2, v=0
  315569.0428  0.0913 -5.4962 3 1601.8584215  71510 303A72781      A72682        syn-C2H3C(O)NH2, v=0
  315581.6681  0.0200 -3.0609 3   75.7014 39 -71510 3031913 6      1812 7        syn-C2H3C(O)NH2, v=0
  315581.6681  0.0200 -3.0609 3   75.7014 39 -71510 3031913 7      1812 6        syn-C2H3C(O)NH2, v=0
  315586.6712  0.0066 -4.1565 3  835.6475159  71510 303791664      791565        syn-C2H3C(O)NH2, v=0
  315632.5275  0.1012 -5.5027 3 1606.0749213  71510 303A63076      A62977        syn-C2H3C(O)NH2, v=0
  315634.4696  0.0009 -5.1695 3  258.4127 85  71510 303421428      411427        syn-C2H3C(O)NH2, v=0
  315723.6169  0.0200 -3.1531 3   85.5630 47 -71510 303231113      221012        syn-C2H3C(O)NH2, v=0
  315725.8227  0.0429 -4.7995 3 1218.9831189  71510 303942173      942074        syn-C2H3C(O)NH2, v=0
  315727.2239  0.0200 -3.1531 3   85.5628 47 -71510 303231112      221013        syn-C2H3C(O)NH2, v=0
  315732.4815  0.0154 -4.6928 3 1173.2770181  71510 303902764      902665        syn-C2H3C(O)NH2, v=0
  315740.6019  0.0200 -3.3322 3  101.9030 55 -71510 30327 918      26 819        syn-C2H3C(O)NH2, v=0
  315758.5799  0.0023 -3.5141 3   98.5609 55  71510 30327 819      26 720        syn-C2H3C(O)NH2, v=0
  315799.4600  0.0200 -3.4501 3  304.5579 79 -71510 303392316      392217        syn-C2H3C(O)NH2, v=0
  315799.4600  0.0200 -3.4501 3  304.5579 79 -71510 303392317      392218        syn-C2H3C(O)NH2, v=0
  315806.1925  0.0026 -4.4545 3  206.6398 77  71510 303381226      38 929        syn-C2H3C(O)NH2, v=0
  315806.5997  0.0012 -5.4735 3  356.2129 87  71510 303432419      422418        syn-C2H3C(O)NH2, v=0
  315806.5997  0.0012 -5.4735 3  356.2129 87  71510 303432420      422419        syn-C2H3C(O)NH2, v=0
  315826.3800  0.0200 -3.1025 3   79.8609 43 -71510 303211210      2011 9        syn-C2H3C(O)NH2, v=0
  315826.3800  0.0200 -3.1025 3   79.8609 43 -71510 3032112 9      201110        syn-C2H3C(O)NH2, v=0
  315846.3569  0.0081 -4.7332 3  747.5525147  71510 303731955      722052        syn-C2H3C(O)NH2, v=0
  315865.8094  0.0417 -5.5655 3 1242.4051185  71510 303922964      913061        syn-C2H3C(O)NH2, v=0
  315884.8901  0.0417 -5.5655 3 1242.4051185  71510 303922963      913062        syn-C2H3C(O)NH2, v=0
  315886.9200  0.0200 -4.0751 3  819.8834149 -71510 303742549      742450        syn-C2H3C(O)NH2, v=0
  315907.8756  0.0031 -4.0750 3  819.8826149  71510 303742550      742451        syn-C2H3C(O)NH2, v=0
  315969.0853  0.0025 -4.9359 3  101.8325 55  71510 30327 919      27 622        syn-C2H3C(O)NH2, v=0
  316019.9302  0.3286 -6.3491 3 2045.7371241  71510 303C03387      C03288        syn-C2H3C(O)NH2, v=0
  316051.1193  0.0025 -3.7939 3  385.1833117  71510 30358 454      58 355        syn-C2H3C(O)NH2, v=0
  316051.1193  0.0025 -3.7939 3  385.1833117  71510 30358 554      58 455        syn-C2H3C(O)NH2, v=0
  316080.1418  0.0200 -3.4530 3  295.0035 77 -71510 303382315      382216        syn-C2H3C(O)NH2, v=0
  316080.1418  0.0200 -3.4530 3  295.0035 77 -71510 303382316      382217        syn-C2H3C(O)NH2, v=0
  316138.0361  0.0011 -5.4340 3  345.2252 87  71510 303432320      422319        syn-C2H3C(O)NH2, v=0
  316138.0361  0.0011 -5.4340 3  345.2252 87  71510 303432321      422320        syn-C2H3C(O)NH2, v=0
  316318.5313  0.0092 -4.7337 3  800.8299151  71510 303752155      742252        syn-C2H3C(O)NH2, v=0
  316326.0268  0.0272 -5.1683 3  892.2608161  71510 303802061      792158        syn-C2H3C(O)NH2, v=0
  316339.9872  0.0200 -3.4579 3  285.6990 75 -71510 303372314      372215        syn-C2H3C(O)NH2, v=0
  316339.9872  0.0200 -3.4579 3  285.6990 75 -71510 303372315      372216        syn-C2H3C(O)NH2, v=0
  316356.1679  0.0034 -5.1323 3   92.8349 51  71510 303251015      25 718        syn-C2H3C(O)NH2, v=0
  316380.6515  0.1403 -5.4332 3 1563.7845213  71510 303A62581      A62482        syn-C2H3C(O)NH2, v=0
  316404.5182  0.0200 -3.7365 3  604.3903125 -71510 303622438      622339        syn-C2H3C(O)NH2, v=0
  316404.5182  0.0200 -3.7365 3  604.3903125 -71510 303622439      622340        syn-C2H3C(O)NH2, v=0
  316492.3958  0.0052 -6.3876 3  658.0811133  71510 303662343      672048        syn-C2H3C(O)NH2, v=0
  316514.6933  0.0011 -5.3965 3  334.7239 87  71510 303432221      422220        syn-C2H3C(O)NH2, v=0
  316514.6933  0.0011 -5.3965 3  334.7239 87  71510 303432222      422221        syn-C2H3C(O)NH2, v=0
  316580.1254  0.0200 -3.4652 3  276.6439 73 -71510 303362313      362214        syn-C2H3C(O)NH2, v=0
  316580.1254  0.0200 -3.4652 3  276.6439 73 -71510 303362314      362215        syn-C2H3C(O)NH2, v=0
  316679.6288  0.0200 -3.7809 3  523.5898131 -71510 30365 857      65 758        syn-C2H3C(O)NH2, v=0
  316679.6288  0.0200 -3.7809 3  523.5898131 -71510 30365 957      65 858        syn-C2H3C(O)NH2, v=0
  316752.0911  0.0157 -4.9020 3  896.8035159  71510 303792356      782455        syn-C2H3C(O)NH2, v=0
  316801.7650  0.0200 -3.4749 3  267.8379 71 -71510 303352312      352213        syn-C2H3C(O)NH2, v=0
  316801.7650  0.0200 -3.4749 3  267.8379 71 -71510 303352313      352214        syn-C2H3C(O)NH2, v=0
  316826.9445  0.0056 -4.3996 3  616.5613133  71510 303661848      651947        syn-C2H3C(O)NH2, v=0
  316879.8235  0.0363 -5.4495 3 1184.5141181  71510 303902863      892960        syn-C2H3C(O)NH2, v=0
  316923.8500  0.0458 -5.8122 3 1773.3998225  71510 303B23083      B22984        syn-C2H3C(O)NH2, v=0
  316930.3335  0.0363 -5.4493 3 1184.5140181  71510 303902862      892961        syn-C2H3C(O)NH2, v=0
  316946.5630  0.0011 -5.3610 3  324.7123 87  71510 303432122      422121        syn-C2H3C(O)NH2, v=0
  316946.5630  0.0011 -5.3610 3  324.7123 87  71510 303432123      422122        syn-C2H3C(O)NH2, v=0
  317005.8972  0.0200 -3.4876 3  259.2806 69 -71510 303342311      342212        syn-C2H3C(O)NH2, v=0
  317005.8972  0.0200 -3.4876 3  259.2806 69 -71510 303342312      342213        syn-C2H3C(O)NH2, v=0
  317014.2371  0.0050 -4.0833 3  787.4059155  71510 303771463      771364        syn-C2H3C(O)NH2, v=0
  317020.5132  0.0050 -4.0833 3  787.4059155  71510 303771563      771464        syn-C2H3C(O)NH2, v=0
  317020.7677  0.0045 -3.9658 3   73.7436 49  71510 30324 618      23 519        syn-C2H3C(O)NH2, v=0
  317023.8099  0.0368 -5.3210 3 1514.6739207  71510 303A32975      A32876        syn-C2H3C(O)NH2, v=0
  317124.7897  0.2147 -6.2786 3 1361.2900199  71510 303992476      982573        syn-C2H3C(O)NH2, v=0
  317147.9170  0.0414 -5.7568 3 1744.7744223  71510 303B13082      B12983        syn-C2H3C(O)NH2, v=0
  317177.7925  0.0039 -3.9702 3  327.6755111  71510 30355 253      55 154        syn-C2H3C(O)NH2, v=0
  317177.7925  0.0039 -3.9702 3  327.6755111  71510 30355 353      55 254        syn-C2H3C(O)NH2, v=0
  317193.5282  0.0200 -3.5037 3  250.9717 67 -71510 303332310      332211        syn-C2H3C(O)NH2, v=0
  317193.5282  0.0200 -3.5037 3  250.9717 67 -71510 303332311      332212        syn-C2H3C(O)NH2, v=0
  317259.4768  0.0009 -5.1455 3  252.6035 85  71510 303421330      411329        syn-C2H3C(O)NH2, v=0
  317307.0445  0.0579 -4.9450 3 1301.3278195  71510 303972275      972176        syn-C2H3C(O)NH2, v=0
  317317.4806  0.0073 -4.3597 3  988.0569165  71510 303822656      822557        syn-C2H3C(O)NH2, v=0
  317365.6405  0.0200 -3.5236 3  242.9107 65 -71510 3033223 9      322210        syn-C2H3C(O)NH2, v=0
  317365.6405  0.0200 -3.5236 3  242.9107 65 -71510 303322310      322211        syn-C2H3C(O)NH2, v=0
  317446.7438  0.0010 -5.3274 3  315.1944 87  71510 303432023      422022        syn-C2H3C(O)NH2, v=0
  317446.7438  0.0010 -5.3274 3  315.1944 87  71510 303432024      422023        syn-C2H3C(O)NH2, v=0
  317464.5388  0.0920 -5.7939 3 1762.8103225  71510 303B22984      B22885        syn-C2H3C(O)NH2, v=0
  317479.8663  0.0530 -5.4539 3 1005.7671171  71510 303852165      842262        syn-C2H3C(O)NH2, v=0
  317492.4282  0.0200 -3.7127 3  588.9864123 -71510 303612437      612338        syn-C2H3C(O)NH2, v=0
  317492.4282  0.0200 -3.7127 3  588.9864123 -71510 303612438      612339        syn-C2H3C(O)NH2, v=0
  317523.1735  0.0200 -3.5481 3  235.0974 63 -71510 3033123 8      3122 9        syn-C2H3C(O)NH2, v=0
  317523.1735  0.0200 -3.5481 3  235.0974 63 -71510 3033123 9      312210        syn-C2H3C(O)NH2, v=0
  317552.1181  0.0072 -4.3590 3  988.0480165  71510 303822657      822558        syn-C2H3C(O)NH2, v=0
  317632.7809  0.0200 -3.8122 3  564.4622135 -71510 30367 958      67 859        syn-C2H3C(O)NH2, v=0
  317632.7809  0.0200 -3.8122 3  564.4622135 -71510 303671058      67 959        syn-C2H3C(O)NH2, v=0
  317660.7759  0.0009 -5.1124 3  242.6042 85  71510 303421132      411131        syn-C2H3C(O)NH2, v=0
  317667.0676  0.0200 -3.5782 3  227.5315 61 -71510 3033023 7      3022 8        syn-C2H3C(O)NH2, v=0
  317667.0676  0.0200 -3.5782 3  227.5315 61 -71510 3033023 8      3022 9        syn-C2H3C(O)NH2, v=0
  317726.1855  0.0726 -5.2079 3 1448.0316205  71510 303A22578      A22479        syn-C2H3C(O)NH2, v=0
  317736.6814  0.0567 -5.8661 3 1802.2606227  71510 303B33084      B32985        syn-C2H3C(O)NH2, v=0
  317765.3831  0.0154 -4.6482 3 1150.5095179  71510 303892762      892663        syn-C2H3C(O)NH2, v=0
  317772.3130  0.0028 -4.0409 3  801.3364147  71510 303732548      732449        syn-C2H3C(O)NH2, v=0
  317783.8097  0.0028 -4.0408 3  801.3360147  71510 303732549      732450        syn-C2H3C(O)NH2, v=0
  317798.1472  0.0200 -3.6154 3  220.2126 59 -71510 3032923 6      2922 7        syn-C2H3C(O)NH2, v=0
  317798.1472  0.0200 -3.6154 3  220.2126 59 -71510 3032923 7      2922 8        syn-C2H3C(O)NH2, v=0
  317823.6529  0.1046 -5.2614 3 1473.7379207  71510 303A32479      A32380        syn-C2H3C(O)NH2, v=0
  317882.9053  0.0388 -4.7938 3 1218.9961189  71510 303942273      942174        syn-C2H3C(O)NH2, v=0
  317917.2134  0.0015 -3.6617 3  213.1405 57  71510 3032823 5      2822 6        syn-C2H3C(O)NH2, v=0
  317917.2134  0.0015 -3.6617 3  213.1405 57  71510 3032823 6      2822 7        syn-C2H3C(O)NH2, v=0
  317959.5799  0.0011 -5.0970 3  237.4683 85  71510 30342 933      41 932        syn-C2H3C(O)NH2, v=0
  317959.8564  0.0038 -4.0159 3  740.3690151  71510 303751362      751263        syn-C2H3C(O)NH2, v=0
  317961.6781  0.0038 -4.0159 3  740.3690151  71510 303751462      751363        syn-C2H3C(O)NH2, v=0
  317978.8320  0.0055 -5.9013 3   57.5759 45  71510 30322 518      22 221        syn-C2H3C(O)NH2, v=0
  318014.2885  0.0011 -5.0726 3  271.5820101  71510 30350 248      49 247        syn-C2H3C(O)NH2, v=0
  318014.2669  0.0200 -2.9158 3  271.5820101 -71510 30350 248      49 347        syn-C2H3C(O)NH2, v=0
  318014.2669  0.0200 -2.9158 3  271.5820101 -71510 30350 348      49 247        syn-C2H3C(O)NH2, v=0
  318014.2885  0.0011 -5.0726 3  271.5820101  71510 30350 348      49 347        syn-C2H3C(O)NH2, v=0
  318016.7876  0.0013 -5.0628 3  272.6181103  71510 30351 150      50 149        syn-C2H3C(O)NH2, v=0
  318016.7959  0.0200 -2.8835 3  272.6181103 -71510 30351 150      50 249        syn-C2H3C(O)NH2, v=0
  318016.7959  0.0200 -2.8835 3  272.6181103 -71510 30351 250      50 149        syn-C2H3C(O)NH2, v=0
  318016.7876  0.0013 -5.0628 3  272.6181103  71510 30351 250      50 249        syn-C2H3C(O)NH2, v=0
  318025.1006  0.0200 -3.7204 3  206.3148 55 -71510 3032723 4      2722 5        syn-C2H3C(O)NH2, v=0
  318025.1006  0.0200 -3.7204 3  206.3148 55 -71510 3032723 5      2722 6        syn-C2H3C(O)NH2, v=0
  318026.4866  0.0015 -5.0522 3  273.1427105  71510 30352 052      51 051        syn-C2H3C(O)NH2, v=0
  318026.5200  0.0200 -2.8529 3  273.1427105 -71510 30352 052      51 151        syn-C2H3C(O)NH2, v=0
  318026.5200  0.0200 -2.8529 3  273.1427105 -71510 30352 152      51 051        syn-C2H3C(O)NH2, v=0
  318026.4866  0.0015 -5.0522 3  273.1427105  71510 30352 152      51 151        syn-C2H3C(O)NH2, v=0
  318028.8809  0.0010 -5.0814 3  270.0237 99  71510 30349 346      48 345        syn-C2H3C(O)NH2, v=0
  318028.9157  0.0200 -2.9503 3  270.0237 99 -71510 30349 346      48 445        syn-C2H3C(O)NH2, v=0
  318028.9157  0.0200 -2.9503 3  270.0237 99 -71510 30349 446      48 345        syn-C2H3C(O)NH2, v=0
  318028.8809  0.0010 -5.0814 3  270.0237 99  71510 30349 446      48 445        syn-C2H3C(O)NH2, v=0
  318032.8167  0.0010 -5.2955 3  306.1755 87  71510 303431925      421924        syn-C2H3C(O)NH2, v=0
  318032.8175  0.0010 -5.2955 3  306.1755 87  71510 303431924      421923        syn-C2H3C(O)NH2, v=0
  318064.1077  0.0779 -5.0988 3 1386.2490201  71510 303A02377      A02278        syn-C2H3C(O)NH2, v=0
  318069.6167  0.0130 -4.3439 3  956.0718169  71510 303841767      841668        syn-C2H3C(O)NH2, v=0
  318076.3573  0.0200 -2.9879 3  267.9287 97 -71510 30348 444      47 543        syn-C2H3C(O)NH2, v=0
  318076.3285  0.0009 -5.0891 3  267.9287 97  71510 30348 544      47 543        syn-C2H3C(O)NH2, v=0
  318076.3290  0.0009 -5.0891 3  267.9287 97  71510 30348 444      47 443        syn-C2H3C(O)NH2, v=0
  318076.3573  0.0200 -2.9879 3  267.9287 97 -71510 30348 544      47 443        syn-C2H3C(O)NH2, v=0
  318119.2474  0.0314 -5.3363 3 1128.0636177  71510 303882762      872859        syn-C2H3C(O)NH2, v=0
  318122.5456  0.0200 -3.7970 3  199.7353 53 -71510 3032623 3      2622 4        syn-C2H3C(O)NH2, v=0
  318122.5456  0.0200 -3.7970 3  199.7353 53 -71510 3032623 4      2622 5        syn-C2H3C(O)NH2, v=0
  318147.3988  0.0200 -3.7678 3  421.5819121 -71510 30360 555      60 456        syn-C2H3C(O)NH2, v=0
  318147.3988  0.0200 -3.7678 3  421.5819121 -71510 30360 655      60 556        syn-C2H3C(O)NH2, v=0
  318180.6500  0.0129 -4.3436 3  956.0723169  71510 303841867      841768        syn-C2H3C(O)NH2, v=0
  318182.7899  0.0200 -3.0298 3  265.2777 95 -71510 30347 542      46 641        syn-C2H3C(O)NH2, v=0
  318182.7913  0.0009 -5.0956 3  265.2777 95  71510 30347 642      46 641        syn-C2H3C(O)NH2, v=0
  318182.8139  0.0009 -5.0956 3  265.2777 95  71510 30347 542      46 541        syn-C2H3C(O)NH2, v=0
  318182.7899  0.0200 -3.0298 3  265.2777 95 -71510 30347 642      46 541        syn-C2H3C(O)NH2, v=0
  318210.3237  0.0200 -3.9016 3  193.4018 51 -71510 3032523 2      2522 3        syn-C2H3C(O)NH2, v=0
  318210.3237  0.0200 -3.9016 3  193.4018 51 -71510 3032523 3      2522 4        syn-C2H3C(O)NH2, v=0
  318250.3675  0.0315 -5.3359 3 1128.0634177  71510 303882761      872860        syn-C2H3C(O)NH2, v=0
  318262.7799  0.0023 -3.8522 3  606.5848139  71510 303691059      69 960        syn-C2H3C(O)NH2, v=0
  318262.8103  0.0023 -3.8522 3  606.5848139  71510 303691159      691060        syn-C2H3C(O)NH2, v=0
  318289.0980  0.0017 -4.0574 3  187.3139 49  71510 3032423 1      2422 2        syn-C2H3C(O)NH2, v=0
  318289.0980  0.0017 -4.0574 3  187.3139 49  71510 3032423 2      2422 3        syn-C2H3C(O)NH2, v=0
  318294.8654  0.0030 -3.7516 3  332.2877 99  71510 303491237      481336        syn-C2H3C(O)NH2, v=0
  318308.5679  0.0418 -5.7000 3 1716.3942221  71510 303B03081      B02982        syn-C2H3C(O)NH2, v=0
  318353.2572  0.0249 -4.9668 3 1326.0002193  71510 303962869      962770        syn-C2H3C(O)NH2, v=0
  318359.4872  0.0200 -4.3381 3  181.4715 47 -71510 3032323 0      2322 1        syn-C2H3C(O)NH2, v=0
  318359.4872  0.0200 -4.3381 3  181.4715 47 -71510 3032323 1      2322 2        syn-C2H3C(O)NH2, v=0
  318370.3286  0.0027 -6.1707 3  375.2136 99  71510 303491931      501634        syn-C2H3C(O)NH2, v=0
  318386.0901  0.0009 -5.1426 3  252.6551 85  71510 303421329      411328        syn-C2H3C(O)NH2, v=0
  318393.2173  0.0200 -3.0777 3  262.0429 93 -71510 30346 640      45 739        syn-C2H3C(O)NH2, v=0
  318394.1002  0.0009 -5.1007 3  262.0429 93  71510 30346 740      45 739        syn-C2H3C(O)NH2, v=0
  318394.8732  0.0009 -5.1007 3  262.0428 93  71510 30346 640      45 639        syn-C2H3C(O)NH2, v=0
  318395.7757  0.0200 -3.0777 3  262.0428 93 -71510 30346 740      45 639        syn-C2H3C(O)NH2, v=0
  318449.3786  0.0240 -4.5578 3 1083.8760179  71510 303891970      891871        syn-C2H3C(O)NH2, v=0
  318456.7917  0.0030 -3.9547 3  694.5470147  71510 303731261      731162        syn-C2H3C(O)NH2, v=0
  318457.2892  0.0030 -3.9547 3  694.5470147  71510 303731361      731262        syn-C2H3C(O)NH2, v=0
  318509.2824  0.0298 -4.9236 3 1301.7241191  71510 303952867      952768        syn-C2H3C(O)NH2, v=0
  318517.7798  0.0012 -3.6898 3  573.8439121  71510 303602436      602337        syn-C2H3C(O)NH2, v=0
  318517.7988  0.0012 -3.6898 3  573.8439121  71510 303602437      602338        syn-C2H3C(O)NH2, v=0
  318544.7278  0.0009 -5.1247 3  247.3863 85  71510 303421231      411230        syn-C2H3C(O)NH2, v=0
  318546.6225  0.0026 -3.9000 3  649.9492143  71510 303711160      711061        syn-C2H3C(O)NH2, v=0
  318546.7498  0.0026 -3.9000 3  649.9492143  71510 303711260      711161        syn-C2H3C(O)NH2, v=0
  318611.3753  0.3132 -6.0279 3 1878.5280233  71510 303B62888      B62789        syn-C2H3C(O)NH2, v=0
  318700.7517  0.0051 -6.3981 3  371.0146103  71510 303511537      521042        syn-C2H3C(O)NH2, v=0
  318729.0863  0.0010 -5.2652 3  297.6625 87  71510 303431826      421825        syn-C2H3C(O)NH2, v=0
  318729.1001  0.0010 -5.2652 3  297.6625 87  71510 303431825      421824        syn-C2H3C(O)NH2, v=0
  318745.6922  0.0019 -5.7872 3   23.1770 27  71510 30313 7 7      12 4 8        syn-C2H3C(O)NH2, v=0
  318767.9853  0.0200 -3.1352 3  258.1826 91 -71510 30345 738      44 837        syn-C2H3C(O)NH2, v=0
  318768.6298  0.1023 -5.6653 3 1695.4028221  71510 303B02883      B02784        syn-C2H3C(O)NH2, v=0
  318791.8122  0.0009 -5.1040 3  258.1826 91  71510 30345 838      44 837        syn-C2H3C(O)NH2, v=0
  318794.5701  0.0018 -5.9917 3   19.9832 25  71510 30312 7 5      11 4 8        syn-C2H3C(O)NH2, v=0
  318810.5705  0.0009 -5.1039 3  258.1812 91  71510 30345 738      44 737        syn-C2H3C(O)NH2, v=0
  318834.4227  0.0200 -3.1350 3  258.1812 91 -71510 30345 838      44 737        syn-C2H3C(O)NH2, v=0
  318891.6320  0.0027 -6.1693 3  375.1962 99  71510 303491930      501635        syn-C2H3C(O)NH2, v=0
  318906.7168  0.0039 -5.0292 3   98.0449 55  71510 30327 820      27 523        syn-C2H3C(O)NH2, v=0
  318973.4400  0.0233 -4.5564 3 1083.8787179  71510 303892070      891971        syn-C2H3C(O)NH2, v=0
  318981.4327  0.0141 -4.6449 3 1150.4619179  71510 303892763      892664        syn-C2H3C(O)NH2, v=0
  319001.5494  0.0200 -3.2109 3  253.6360 89 -71510 30344 836      43 935        syn-C2H3C(O)NH2, v=0
  319455.8983  0.0009 -5.1050 3  253.6360 89  71510 30344 936      43 935        syn-C2H3C(O)NH2, v=0
  319484.2910  0.0200 -3.6679 3  558.9622119 -71510 303592435      592336        syn-C2H3C(O)NH2, v=0
  319484.2910  0.0200 -3.6679 3  558.9622119 -71510 303592436      592337        syn-C2H3C(O)NH2, v=0
  319543.9271  0.0200 -4.0077 3  783.0603145 -71510 303722547      722448        syn-C2H3C(O)NH2, v=0
  319550.1117  0.0025 -4.0076 3  783.0601145  71510 303722548      722449        syn-C2H3C(O)NH2, v=0
  319570.4072  0.0010 -5.2364 3  289.6650 87  71510 303431727      421726        syn-C2H3C(O)NH2, v=0
  319570.6240  0.0010 -5.2364 3  289.6650 87  71510 303431726      421725        syn-C2H3C(O)NH2, v=0
  319608.6914  0.0270 -5.2261 3 1073.0567173  71510 303862661      852758        syn-C2H3C(O)NH2, v=0
  319645.6989  0.0732 -5.9184 3 1831.3474229  71510 303B43085      B42986        syn-C2H3C(O)NH2, v=0
  319761.6266  0.0032 -3.8599 3  362.0937115  71510 30357 354      57 255        syn-C2H3C(O)NH2, v=0
  319761.6266  0.0032 -3.8599 3  362.0937115  71510 30357 454      57 355        syn-C2H3C(O)NH2, v=0
  319766.3386  0.0009 -5.1040 3  253.6105 89  71510 30344 836      43 835        syn-C2H3C(O)NH2, v=0
  319888.9516  0.0009 -5.1050 3  248.3674 87  71510 303431034      421033        syn-C2H3C(O)NH2, v=0
  319935.8935  0.0065 -4.3184 3  967.3886163  71510 303812655      812556        syn-C2H3C(O)NH2, v=0
  319941.6799  0.0273 -5.2251 3 1073.0560173  71510 303862660      852759        syn-C2H3C(O)NH2, v=0
  319989.2418  0.0200 -3.7626 3  459.2621125 -71510 30362 656      62 557        syn-C2H3C(O)NH2, v=0
  319989.2418  0.0200 -3.7626 3  459.2621125 -71510 30362 756      62 657        syn-C2H3C(O)NH2, v=0
  320073.0469  0.0065 -4.3181 3  967.3834163  71510 303812656      812557        syn-C2H3C(O)NH2, v=0
  320121.8919  0.0873 -5.3682 3 1537.2815211  71510 303A52680      A52581        syn-C2H3C(O)NH2, v=0
  320124.4765  0.0046 -6.3935 3  390.4700105  71510 303521637      531142        syn-C2H3C(O)NH2, v=0
  320220.7029  0.0200 -3.2074 3  253.6105 89 -71510 30344 936      43 835        syn-C2H3C(O)NH2, v=0
  320274.2961  0.0441 -5.6423 3 1688.2684219  71510 303A93080      A92981        syn-C2H3C(O)NH2, v=0
  320395.2629  0.0012 -3.6469 3  544.3403117  71510 303582434      582335        syn-C2H3C(O)NH2, v=0
  320395.2669  0.0012 -3.6469 3  544.3403117  71510 303582435      582336        syn-C2H3C(O)NH2, v=0
  320409.9160  0.0049 -4.2152 3  305.5727109  71510 30354 153      54 054        syn-C2H3C(O)NH2, v=0
  320409.9160  0.0049 -4.2152 3  305.5727109  71510 30354 253      54 154        syn-C2H3C(O)NH2, v=0
  320420.7779  0.0364 -5.2646 3 1488.3845205  71510 303A22974      A22875        syn-C2H3C(O)NH2, v=0
  320502.2504  0.0072 -4.4938 3  675.3013139  71510 303691950      682049        syn-C2H3C(O)NH2, v=0
  320535.7641  0.0098 -4.2583 3  904.8319165  71510 303821666      821567        syn-C2H3C(O)NH2, v=0
  320573.1695  0.0098 -4.2582 3  904.8320165  71510 303821766      821667        syn-C2H3C(O)NH2, v=0
  320608.6219  0.0009 -5.2090 3  282.1962 87  71510 303431628      421627        syn-C2H3C(O)NH2, v=0
  320611.4822  0.0009 -5.2090 3  282.1963 87  71510 303431627      421626        syn-C2H3C(O)NH2, v=0
  320621.5919  0.0034 -6.4418 3  588.8283 89  71510 3034439 5      4339 4        syn-C2H3C(O)NH2, v=0
  320621.5919  0.0034 -6.4418 3  588.8283 89  71510 3034439 6      4339 5        syn-C2H3C(O)NH2, v=0
  320679.4171  0.0500 -4.9362 3 1301.3495195  71510 303972375      972276        syn-C2H3C(O)NH2, v=0
  320726.8222  0.0030 -6.3298 3  570.7038 89  71510 3034438 6      4338 5        syn-C2H3C(O)NH2, v=0
  320726.8222  0.0030 -6.3298 3  570.7038 89  71510 3034438 7      4338 6        syn-C2H3C(O)NH2, v=0
  320837.3706  0.0027 -6.2311 3  553.0511 89  71510 3034437 7      4337 6        syn-C2H3C(O)NH2, v=0
  320837.3706  0.0027 -6.2311 3  553.0511 89  71510 3034437 8      4337 7        syn-C2H3C(O)NH2, v=0
  320953.9369  0.0025 -6.1424 3  535.8706 89  71510 3034436 8      4336 7        syn-C2H3C(O)NH2, v=0
  320953.9369  0.0025 -6.1424 3  535.8706 89  71510 3034436 9      4336 8        syn-C2H3C(O)NH2, v=0
  321052.6474  0.0023 -6.2244 3  258.4127 81  71510 303401724      411427        syn-C2H3C(O)NH2, v=0
  321077.3244  0.0023 -6.0616 3  519.1627 89  71510 3034435 9      4335 8        syn-C2H3C(O)NH2, v=0
  321077.3244  0.0023 -6.0616 3  519.1627 89  71510 303443510      4335 9        syn-C2H3C(O)NH2, v=0
  321082.0007  0.0049 -6.3951 3  403.8261107  71510 303531638      541143        syn-C2H3C(O)NH2, v=0
  321096.3607  0.2139 -6.0224 3 1883.2579231  71510 303B53283      B53184        syn-C2H3C(O)NH2, v=0
  321116.3155  0.0200 -3.2216 3   99.1343 53 -71510 303261017      25 916        syn-C2H3C(O)NH2, v=0
  321157.1870  0.0061 -4.6908 3  166.8433 71  71510 30335 926      35 629        syn-C2H3C(O)NH2, v=0
  321208.4593  0.0021 -5.9872 3  502.9278 89  71510 303443410      4334 9        syn-C2H3C(O)NH2, v=0
  321208.4593  0.0021 -5.9872 3  502.9278 89  71510 303443411      433410        syn-C2H3C(O)NH2, v=0
  321210.9235  0.0200 -3.9754 3  765.0537143 -71510 303712546      712447        syn-C2H3C(O)NH2, v=0
  321214.2106  0.0022 -3.9754 3  765.0536143  71510 303712547      712448        syn-C2H3C(O)NH2, v=0
  321229.8590  0.0023 -6.2240 3  258.4068 81  71510 303401723      411428        syn-C2H3C(O)NH2, v=0
  321253.7825  0.0200 -3.6269 3  529.9776115 -71510 303572433      572334        syn-C2H3C(O)NH2, v=0
  321253.7825  0.0200 -3.6269 3  529.9776115 -71510 303572434      572335        syn-C2H3C(O)NH2, v=0
  321343.0536  0.0135 -4.6001 3 1127.9602177  71510 303882761      882662        syn-C2H3C(O)NH2, v=0
  321348.4139  0.0019 -5.9182 3  487.1665 89  71510 303443311      433310        syn-C2H3C(O)NH2, v=0
  321348.4139  0.0019 -5.9182 3  487.1665 89  71510 303443312      433311        syn-C2H3C(O)NH2, v=0
  321349.1096  0.0231 -5.1189 3 1019.4969169  71510 303842560      832657        syn-C2H3C(O)NH2, v=0
  321483.9372  0.0019 -5.5966 3   26.5301 29  71510 30314 7 8      13 4 9        syn-C2H3C(O)NH2, v=0
  321498.4363  0.0017 -5.8539 3  471.8792 89  71510 303443212      433211        syn-C2H3C(O)NH2, v=0
  321498.4363  0.0017 -5.8539 3  471.8792 89  71510 303443213      433212        syn-C2H3C(O)NH2, v=0
  321565.0672  0.0200 -3.7728 3  498.2166129 -71510 30364 757      64 658        syn-C2H3C(O)NH2, v=0
  321565.0672  0.0200 -3.7728 3  498.2166129 -71510 30364 857      64 758        syn-C2H3C(O)NH2, v=0
  321621.6890  0.0327 -4.6881 3 1161.8688185  71510 303922072      921973        syn-C2H3C(O)NH2, v=0
  321659.9864  0.0016 -5.7936 3  457.0667 89  71510 303443113      433112        syn-C2H3C(O)NH2, v=0
  321659.9864  0.0016 -5.7936 3  457.0667 89  71510 303443114      433113        syn-C2H3C(O)NH2, v=0
  321693.7452  0.0010 -5.0898 3  233.2214 83  71510 303411130      401129        syn-C2H3C(O)NH2, v=0
  321733.4826  0.0010 -3.2202 3   99.1167 53  71510 303261016      25 917        syn-C2H3C(O)NH2, v=0
  321834.7820  0.0015 -5.7369 3  442.7296 89  71510 303443014      433013        syn-C2H3C(O)NH2, v=0
  321834.7820  0.0015 -5.7369 3  442.7296 89  71510 303443015      433014        syn-C2H3C(O)NH2, v=0
  321854.3686  0.0068 -5.2639 3   93.8521 55  71510 30327 621      27 324        syn-C2H3C(O)NH2, v=0
  321881.8396  0.0053 -5.5186 3   71.9926 49  71510 30324 619      24 322        syn-C2H3C(O)NH2, v=0
  321916.1200  0.0232 -4.9145 3 1301.5880191  71510 303952868      952769        syn-C2H3C(O)NH2, v=0
  321918.8884  0.0009 -5.1827 3  275.2755 87  71510 303431529      421528        syn-C2H3C(O)NH2, v=0
  321940.4035  0.0495 -5.1681 3 1436.8848201  71510 303A02971      A02872        syn-C2H3C(O)NH2, v=0
  321950.1620  0.0009 -5.1826 3  275.2766 87  71510 303431528      421527        syn-C2H3C(O)NH2, v=0
  321983.8524  0.0030 -6.1913 3  435.0296107  71510 303532034      541737        syn-C2H3C(O)NH2, v=0
  321988.3575  0.0044 -6.4012 3  377.2947103  71510 303511636      521141        syn-C2H3C(O)NH2, v=0
  322024.8569  0.0014 -5.6835 3  428.8688 89  71510 303442915      432914        syn-C2H3C(O)NH2, v=0
  322024.8569  0.0014 -5.6835 3  428.8688 89  71510 303442916      432915        syn-C2H3C(O)NH2, v=0
  322062.5329  0.0200 -3.6078 3  515.8735113 -71510 303562432      562333        syn-C2H3C(O)NH2, v=0
  322062.5329  0.0200 -3.6078 3  515.8735113 -71510 303562433      562334        syn-C2H3C(O)NH2, v=0
  322065.7930  0.0200 -2.9774 3   75.5138 33 -71510 3031615 1      1514 2        syn-C2H3C(O)NH2, v=0
  322065.7930  0.0200 -2.9774 3   75.5138 33 -71510 3031615 2      1514 1        syn-C2H3C(O)NH2, v=0
  322089.1136  0.0139 -4.7982 3  848.0649155  71510 303772255      762354        syn-C2H3C(O)NH2, v=0
  322089.4800  0.0127 -4.5981 3 1127.9312177  71510 303882762      882663        syn-C2H3C(O)NH2, v=0
  322114.9618  0.0200 -3.8039 3  397.8084119 -71510 30359 455      59 356        syn-C2H3C(O)NH2, v=0
  322114.9618  0.0200 -3.8039 3  397.8084119 -71510 30359 555      59 456        syn-C2H3C(O)NH2, v=0
  322118.9248  0.0034 -6.3018 3   42.8547 37  71510 30318 711      18 216        syn-C2H3C(O)NH2, v=0
  322173.8884  0.0237 -5.1166 3 1019.4949169  71510 303842559      832658        syn-C2H3C(O)NH2, v=0
  322232.6354  0.0014 -5.6330 3  415.4851 89  71510 303442816      432815        syn-C2H3C(O)NH2, v=0
  322232.6354  0.0014 -5.6330 3  415.4851 89  71510 303442817      432816        syn-C2H3C(O)NH2, v=0
  322263.0600  0.0184 -4.4600 3 1029.6760175  71510 303871869      871770        syn-C2H3C(O)NH2, v=0
  322350.0101  0.0039 -3.7529 3   88.8829 53  71510 30326 719      25 620        syn-C2H3C(O)NH2, v=0
  322369.5728  0.0058 -4.2784 3  946.9994161  71510 303802654      802555        syn-C2H3C(O)NH2, v=0
  322374.6567  0.0074 -4.1785 3  854.7770161  71510 303801565      801466        syn-C2H3C(O)NH2, v=0
  322386.6004  0.0073 -4.1785 3  854.7771161  71510 303801665      801566        syn-C2H3C(O)NH2, v=0
  322390.9809  0.0200 -3.3057 3  259.0377 89 -71510 30344 935      431034        syn-C2H3C(O)NH2, v=0
  322448.6863  0.0058 -4.2782 3  946.9964161  71510 303802655      802556        syn-C2H3C(O)NH2, v=0
  322452.5005  0.1109 -5.8394 3 1791.5048227  71510 303B32985      B32886        syn-C2H3C(O)NH2, v=0
  322455.3529  0.0181 -4.4595 3 1029.6769175  71510 303871969      871870        syn-C2H3C(O)NH2, v=0
  322461.0292  0.0013 -5.5853 3  402.5797 89  71510 303442717      432716        syn-C2H3C(O)NH2, v=0
  322461.0292  0.0013 -5.5853 3  402.5797 89  71510 303442718      432717        syn-C2H3C(O)NH2, v=0
  322483.4840  0.0313 -4.6859 3 1161.8735185  71510 303922172      922073        syn-C2H3C(O)NH2, v=0
  322483.7117  0.0200 -3.0128 3   77.1906 37 -71510 3031814 4      1713 5        syn-C2H3C(O)NH2, v=0
  322483.7117  0.0200 -3.0128 3   77.1906 37 -71510 3031814 5      1713 4        syn-C2H3C(O)NH2, v=0
  322501.1162  0.0010 -5.0767 3  230.2171 83  71510 303411031      401030        syn-C2H3C(O)NH2, v=0
  322601.4233  0.1024 -5.5345 3 1629.0951217  71510 303A82782      A82683        syn-C2H3C(O)NH2, v=0
  322618.9274  0.0030 -6.1897 3  435.0084107  71510 303532033      541738        syn-C2H3C(O)NH2, v=0
  322663.4362  0.0935 -5.9691 3 1860.6508231  71510 303B53086      B52987        syn-C2H3C(O)NH2, v=0
  322674.3977  0.0950 -6.3426 3 1645.7276211  71510 303A53571      A43668        syn-C2H3C(O)NH2, v=0
  322674.4738  0.0950 -6.3426 3 1645.7276211  71510 303A53570      A43669        syn-C2H3C(O)NH2, v=0
  322713.5652  0.0013 -5.5401 3  390.1538 89  71510 303442618      432617        syn-C2H3C(O)NH2, v=0
  322713.5652  0.0013 -5.5401 3  390.1538 89  71510 303442619      432618        syn-C2H3C(O)NH2, v=0
  322771.3498  0.0200 -3.1465 3   91.2464 49 -71510 303241114      231013        syn-C2H3C(O)NH2, v=0
  322780.3440  0.0200 -3.1465 3   91.2462 49 -71510 303241113      231014        syn-C2H3C(O)NH2, v=0
  322781.2260  0.0020 -3.9441 3  747.3154141  71510 303702545      702446        syn-C2H3C(O)NH2, v=0
  322782.9714  0.0020 -3.9441 3  747.3154141  71510 303702546      702447        syn-C2H3C(O)NH2, v=0
  322824.4631  0.0200 -3.5897 3  502.0271111 -71510 303552431      552332        syn-C2H3C(O)NH2, v=0
  322824.4631  0.0200 -3.5897 3  502.0271111 -71510 303552432      552333        syn-C2H3C(O)NH2, v=0
  322837.7840  0.0200 -3.0504 3   80.3501 41 -71510 3032013 8      1912 7        syn-C2H3C(O)NH2, v=0
  322837.7840  0.0200 -3.0504 3   80.3501 41 -71510 3032013 7      1912 8        syn-C2H3C(O)NH2, v=0
  322861.4144  0.0200 -3.7953 3  538.4378133 -71510 30366 858      66 759        syn-C2H3C(O)NH2, v=0
  322861.4144  0.0200 -3.7953 3  538.4378133 -71510 30366 958      66 859        syn-C2H3C(O)NH2, v=0
  322894.7818  0.0463 -5.5839 3 1660.4056217  71510 303A83079      A82980        syn-C2H3C(O)NH2, v=0
  322947.2150  0.0010 -5.0956 3  248.0743 87  71510 30343 934      42 933        syn-C2H3C(O)NH2, v=0
  322951.9755  0.0847 -6.2082 3 1578.7650207  71510 303A33470      A23567        syn-C2H3C(O)NH2, v=0
  322952.1928  0.0847 -6.2082 3 1578.7650207  71510 303A33469      A23568        syn-C2H3C(O)NH2, v=0
  322975.3262  0.0023 -4.2400 3   54.8454 43  71510 30321 616      20 317        syn-C2H3C(O)NH2, v=0
  322994.5553  0.0012 -5.4972 3  378.2090 89  71510 303442519      432518        syn-C2H3C(O)NH2, v=0
  322994.5553  0.0012 -5.4972 3  378.2090 89  71510 303442520      432519        syn-C2H3C(O)NH2, v=0
  323019.5785  0.0200 -3.0933 3   85.0194 45 -71510 303221211      211110        syn-C2H3C(O)NH2, v=0
  323019.5785  0.0200 -3.0933 3   85.0194 45 -71510 303221210      211111        syn-C2H3C(O)NH2, v=0
  323023.5932  0.0028 -4.9070 3  108.6205 57  71510 30328 920      28 623        syn-C2H3C(O)NH2, v=0
  323127.4971  0.0078 -4.6896 3  773.6626149  71510 303742055      732152        syn-C2H3C(O)NH2, v=0
  323219.9651  0.0041 -3.9782 3  339.2922113  71510 30356 254      56 155        syn-C2H3C(O)NH2, v=0
  323219.9651  0.0041 -3.9782 3  339.2922113  71510 30356 354      56 255        syn-C2H3C(O)NH2, v=0
  323238.4810  0.0253 -4.8688 3 1277.5478189  71510 303942866      942767        syn-C2H3C(O)NH2, v=0
  323238.5870  0.0631 -5.0855 3 1386.2847201  71510 303A02477      A02378        syn-C2H3C(O)NH2, v=0
  323240.8774  0.0020 -5.4107 3   30.1697 31  71510 30315 7 9      14 410        syn-C2H3C(O)NH2, v=0
  323276.7720  0.0194 -5.0155 3  967.3886165  71510 303822459      812556        syn-C2H3C(O)NH2, v=0
  323292.5676  0.2385 -5.8288 3 1780.0187227  71510 303B32786      B32687        syn-C2H3C(O)NH2, v=0
  323306.0052  0.0038 -4.7987 3  139.8973 63  71510 303311120      31 823        syn-C2H3C(O)NH2, v=0
  323309.3280  0.0012 -5.4566 3  366.7471 89  71510 303442420      432419        syn-C2H3C(O)NH2, v=0
  323309.3280  0.0012 -5.4566 3  366.7471 89  71510 303442421      432420        syn-C2H3C(O)NH2, v=0
  323333.3126  0.0753 -6.0766 3 1513.2306203  71510 303A13369      A03466        syn-C2H3C(O)NH2, v=0
  323333.9255  0.0753 -6.0766 3 1513.2306203  71510 303A13368      A03467        syn-C2H3C(O)NH2, v=0
  323541.8294  0.0200 -3.5725 3  488.4380109 -71510 303542430      542331        syn-C2H3C(O)NH2, v=0
  323541.8294  0.0200 -3.5725 3  488.4380109 -71510 303542431      542332        syn-C2H3C(O)NH2, v=0
  323568.3308  0.0009 -5.1574 3  268.9301 87  71510 303431430      421429        syn-C2H3C(O)NH2, v=0
  323599.7937  0.1338 -5.7169 3 1727.6343221  71510 303B03179      B03080        syn-C2H3C(O)NH2, v=0
  323664.5494  0.0011 -5.4180 3  355.7704 89  71510 303442321      432320        syn-C2H3C(O)NH2, v=0
  323664.5494  0.0011 -5.4180 3  355.7704 89  71510 303442322      432321        syn-C2H3C(O)NH2, v=0
  323675.2873  0.0055 -4.1043 3  805.9186157  71510 303781464      781365        syn-C2H3C(O)NH2, v=0
  323678.8964  0.0055 -4.1043 3  805.9187157  71510 303781564      781465        syn-C2H3C(O)NH2, v=0
  323760.0152  0.0818 -5.4324 3 1578.8494211  71510 303A53075      A52976        syn-C2H3C(O)NH2, v=0
  323833.9721  0.0667 -5.9479 3 1449.1262199  71510 303993268      983365        syn-C2H3C(O)NH2, v=0
  323835.6795  0.0667 -5.9479 3 1449.1262199  71510 303993267      983366        syn-C2H3C(O)NH2, v=0
  323843.2175  0.0009 -5.1566 3  268.9411 87  71510 303431429      421428        syn-C2H3C(O)NH2, v=0
  323862.6451  0.0200 -3.8278 3  579.9179137 -71510 30368 959      68 860        syn-C2H3C(O)NH2, v=0
  323862.6451  0.0200 -3.8278 3  579.9179137 -71510 303681059      68 960        syn-C2H3C(O)NH2, v=0
  323869.7081  0.0040 -4.3824 3   51.7673 43  71510 30321 417      20 318        syn-C2H3C(O)NH2, v=0
  324014.0407  0.0352 -5.2085 3 1462.3761203  71510 303A12973      A12874        syn-C2H3C(O)NH2, v=0
  324025.1092  0.0200 -3.4369 3  275.0832 91 -71510 303451035      441134        syn-C2H3C(O)NH2, v=0
  324031.6684  0.0010 -5.1099 3  247.7196 85  71510 303421230      411229        syn-C2H3C(O)NH2, v=0
  324063.5809  0.0012 -5.0698 3  282.1898103  71510 30351 249      50 248        syn-C2H3C(O)NH2, v=0
  324063.5706  0.0200 -2.9118 3  282.1898103 -71510 30351 249      50 348        syn-C2H3C(O)NH2, v=0
  324063.5706  0.0200 -2.9118 3  282.1898103 -71510 30351 349      50 248        syn-C2H3C(O)NH2, v=0
  324063.5809  0.0012 -5.0698 3  282.1898103  71510 30351 349      50 348        syn-C2H3C(O)NH2, v=0
  324066.6512  0.0013 -5.0603 3  283.2260105  71510 30352 151      51 150        syn-C2H3C(O)NH2, v=0
  324066.6522  0.0200 -2.8803 3  283.2260105 -71510 30352 151      51 250        syn-C2H3C(O)NH2, v=0
  324066.6522  0.0200 -2.8803 3  283.2260105 -71510 30352 251      51 150        syn-C2H3C(O)NH2, v=0
  324066.6512  0.0013 -5.0603 3  283.2260105  71510 30352 251      51 250        syn-C2H3C(O)NH2, v=0
  324068.6777  0.0011 -5.3814 3  345.2817 89  71510 303442222      432221        syn-C2H3C(O)NH2, v=0
  324068.6777  0.0011 -5.3814 3  345.2817 89  71510 303442223      432222        syn-C2H3C(O)NH2, v=0
  324076.4902  0.0016 -5.0498 3  283.7509107  71510 30353 053      52 052        syn-C2H3C(O)NH2, v=0
  324076.4902  0.0016 -2.8503 3  283.7509107  71510 30353 053      52 152        syn-C2H3C(O)NH2, v=0
  324076.4902  0.0016 -2.8503 3  283.7509107  71510 30353 153      52 052        syn-C2H3C(O)NH2, v=0
  324076.4902  0.0016 -5.0498 3  283.7509107  71510 30353 153      52 152        syn-C2H3C(O)NH2, v=0
  324076.6344  0.0011 -5.0783 3  280.6320101  71510 30350 347      49 346        syn-C2H3C(O)NH2, v=0
  324076.6344  0.0011 -2.9455 3  280.6320101  71510 30350 347      49 446        syn-C2H3C(O)NH2, v=0
  324076.6344  0.0011 -2.9455 3  280.6320101  71510 30350 447      49 346        syn-C2H3C(O)NH2, v=0
  324076.6344  0.0011 -5.0783 3  280.6320101  71510 30350 447      49 446        syn-C2H3C(O)NH2, v=0
  324120.5482  0.0200 -2.9819 3  278.5386 99 -71510 30349 445      48 544        syn-C2H3C(O)NH2, v=0
  324120.5589  0.0010 -5.0858 3  278.5386 99  71510 30349 545      48 544        syn-C2H3C(O)NH2, v=0
  324120.5591  0.0010 -5.0858 3  278.5386 99  71510 30349 445      48 444        syn-C2H3C(O)NH2, v=0
  324120.5482  0.0200 -2.9819 3  278.5386 99 -71510 30349 545      48 444        syn-C2H3C(O)NH2, v=0
  324217.0708  0.0200 -3.5564 3  475.1054107 -71510 303532429      532330        syn-C2H3C(O)NH2, v=0
  324217.0708  0.0200 -3.5564 3  475.1054107 -71510 303532430      532331        syn-C2H3C(O)NH2, v=0
  324219.5224  0.0200 -3.0223 3  275.8912 97 -71510 30348 543      47 642        syn-C2H3C(O)NH2, v=0
  324219.5045  0.0009 -5.0921 3  275.8912 97  71510 30348 643      47 642        syn-C2H3C(O)NH2, v=0
  324219.5161  0.0009 -5.0921 3  275.8912 97  71510 30348 543      47 542        syn-C2H3C(O)NH2, v=0
  324219.5224  0.0200 -3.0223 3  275.8912 97 -71510 30348 643      47 542        syn-C2H3C(O)NH2, v=0
  324229.2787  0.0200 -3.7791 3  434.8123123 -71510 30361 556      61 457        syn-C2H3C(O)NH2, v=0
  324229.2787  0.0200 -3.7791 3  434.8123123 -71510 30361 656      61 557        syn-C2H3C(O)NH2, v=0
  324261.7828  0.0018 -3.9138 3  729.8443139  71510 303692544      692445        syn-C2H3C(O)NH2, v=0
  324262.6883  0.0018 -3.9138 3  729.8442139  71510 303692545      692446        syn-C2H3C(O)NH2, v=0
  324295.4469  0.0440 -4.8263 3 1242.4558191  71510 303952174      952075        syn-C2H3C(O)NH2, v=0
  324321.4247  0.0020 -5.2242 3   34.0870 33  71510 30316 710      15 411        syn-C2H3C(O)NH2, v=0
  324331.4107  0.0035 -4.3389 3  258.8467 87  71510 303431231      43 934        syn-C2H3C(O)NH2, v=0
  324349.2380  0.0052 -6.4312 3  339.3637 99  71510 303491436      50 941        syn-C2H3C(O)NH2, v=0
  324414.6332  0.0200 -3.0683 3  272.6634 95 -71510 30347 641      46 740        syn-C2H3C(O)NH2, v=0
  324415.1518  0.0009 -5.0970 3  272.6634 95  71510 30347 741      46 740        syn-C2H3C(O)NH2, v=0
  324415.5673  0.0009 -5.0970 3  272.6634 95  71510 30347 641      46 640        syn-C2H3C(O)NH2, v=0
  324416.0363  0.0200 -3.0683 3  272.6634 95 -71510 30347 741      46 640        syn-C2H3C(O)NH2, v=0
  324472.8296  0.0590 -5.8221 3 1386.4538195  71510 303973167      963264        syn-C2H3C(O)NH2, v=0
  324477.5194  0.0590 -5.8221 3 1386.4538195  71510 303973166      963265        syn-C2H3C(O)NH2, v=0
  324500.4461  0.0043 -4.0360 3  758.2672153  71510 303761363      761264        syn-C2H3C(O)NH2, v=0
  324501.4757  0.0043 -4.0360 3  758.2672153  71510 303761463      761364        syn-C2H3C(O)NH2, v=0
  324531.7175  0.0200 -3.3453 3  108.6824 57 -71510 30328 919      27 820        syn-C2H3C(O)NH2, v=0
  324532.6278  0.0011 -5.3467 3  335.2845 89  71510 303442123      432122        syn-C2H3C(O)NH2, v=0
  324532.6278  0.0011 -5.3467 3  335.2845 89  71510 303442124      432123        syn-C2H3C(O)NH2, v=0
  324550.6899  0.0200 -3.8690 3  622.6492141 -71510 303701060      70 961        syn-C2H3C(O)NH2, v=0
  324550.6899  0.0200 -3.8690 3  622.6492141 -71510 303701160      701061        syn-C2H3C(O)NH2, v=0
  324593.0133  0.0119 -4.5536 3 1105.7011175  71510 303872760      872661        syn-C2H3C(O)NH2, v=0
  324636.8720  0.0009 -5.1047 3  253.2002 87  71510 303431133      421132        syn-C2H3C(O)NH2, v=0
  324641.5524  0.0052 -4.2394 3  926.8871159  71510 303792653      792554        syn-C2H3C(O)NH2, v=0
  324686.5915  0.0052 -4.2393 3  926.8854159  71510 303792654      792555        syn-C2H3C(O)NH2, v=0
  324723.8493  0.0052 -6.4043 3  417.3678109  71510 303541639      551144        syn-C2H3C(O)NH2, v=0
  324768.8172  0.0200 -3.1229 3  268.8163 93 -71510 30346 739      45 838        syn-C2H3C(O)NH2, v=0
  324782.0688  0.0009 -5.1002 3  268.8163 93  71510 30346 839      45 838        syn-C2H3C(O)NH2, v=0
  324792.6693  0.0009 -5.1002 3  268.8155 93  71510 30346 739      45 738        syn-C2H3C(O)NH2, v=0
  324805.8879  0.0200 -3.1228 3  268.8155 93 -71510 30346 839      45 738        syn-C2H3C(O)NH2, v=0
  324852.2450  0.0200 -3.5413 3  462.0288105 -71510 303522428      522329        syn-C2H3C(O)NH2, v=0
  324852.2450  0.0200 -3.5413 3  462.0288105 -71510 303522429      522330        syn-C2H3C(O)NH2, v=0
  324897.5488  0.0034 -3.9737 3  711.8324149  71510 303741262      741163        syn-C2H3C(O)NH2, v=0
  324897.8252  0.0034 -3.9737 3  711.8324149  71510 303741362      741263        syn-C2H3C(O)NH2, v=0
  324904.1017  0.0029 -3.9178 3  666.6235145  71510 303721161      721062        syn-C2H3C(O)NH2, v=0
  324904.1712  0.0029 -3.9178 3  666.6235145  71510 303721261      721162        syn-C2H3C(O)NH2, v=0
  325044.8864  0.0115 -4.5524 3 1105.6836175  71510 303872761      872662        syn-C2H3C(O)NH2, v=0
  325070.7729  0.0010 -5.3137 3  325.7833 89  71510 303442025      432024        syn-C2H3C(O)NH2, v=0
  325070.7730  0.0010 -5.3137 3  325.7833 89  71510 303442024      432023        syn-C2H3C(O)NH2, v=0
  325087.8980  0.0095 -4.5907 3  736.7087145  71510 303722052      712151        syn-C2H3C(O)NH2, v=0
  325088.4157  0.0034 -6.2320 3  499.2967115  71510 303572137      581840        syn-C2H3C(O)NH2, v=0
  325138.8121  0.0034 -5.1114 3   36.3637 39  71510 30319 217      18 118        syn-C2H3C(O)NH2, v=0
  325150.0831  0.0200 -3.1929 3  264.2919 91 -71510 30345 837      44 936        syn-C2H3C(O)NH2, v=0
  325162.4349  0.0020 -5.0357 3   38.2692 35  71510 30317 711      16 412        syn-C2H3C(O)NH2, v=0
  325182.4380  0.0161 -4.9168 3  916.7381161  71510 303802358      792455        syn-C2H3C(O)NH2, v=0
  325207.6158  0.0140 -4.3682 3  976.6387171  71510 303851768      851669        syn-C2H3C(O)NH2, v=0
  325261.2609  0.0207 -5.0099 3  967.3834165  71510 303822458      812557        syn-C2H3C(O)NH2, v=0
  325272.6874  0.0519 -5.6991 3 1325.2157191  71510 303953066      943163        syn-C2H3C(O)NH2, v=0
  325274.6008  0.0140 -4.3680 3  976.6390171  71510 303851868      851769        syn-C2H3C(O)NH2, v=0
  325285.3736  0.0519 -5.6991 3 1325.2156191  71510 303953065      943164        syn-C2H3C(O)NH2, v=0
  325289.7975  0.1169 -5.7065 3 1723.4677223  71510 303B12884      B12785        syn-C2H3C(O)NH2, v=0
  325304.4297  0.0036 -3.8498 3  375.8102105  71510 303521339      511438        syn-C2H3C(O)NH2, v=0
  325340.0158  0.0034 -5.1110 3   36.3637 39  71510 30319 317      18 018        syn-C2H3C(O)NH2, v=0
  325374.4378  0.0009 -5.1336 3  263.1862 87  71510 303431331      421330        syn-C2H3C(O)NH2, v=0
  325399.7830  0.0031 -5.2253 3   86.3332 49  71510 303241014      24 717        syn-C2H3C(O)NH2, v=0
  325406.4128  0.0214 -4.8631 3 1277.4620189  71510 303942867      942768        syn-C2H3C(O)NH2, v=0
  325416.8511  0.0009 -5.1012 3  264.2919 91  71510 30345 937      44 936        syn-C2H3C(O)NH2, v=0
  325449.5409  0.0200 -3.5272 3  449.2076103 -71510 303512427      512328        syn-C2H3C(O)NH2, v=0
  325449.5409  0.0200 -3.5272 3  449.2076103 -71510 303512428      512329        syn-C2H3C(O)NH2, v=0
  325580.0471  0.0031 -4.5341 3  196.7240 75  71510 303371225      37 928        syn-C2H3C(O)NH2, v=0
  325604.4070  0.0009 -5.1006 3  264.2768 91  71510 30345 837      44 836        syn-C2H3C(O)NH2, v=0
  325612.3454  0.0782 -5.2415 3 1473.7953207  71510 303A32579      A32480        syn-C2H3C(O)NH2, v=0
  325658.6474  0.0017 -3.8843 3  712.6392137  71510 303682543      682444        syn-C2H3C(O)NH2, v=0
  325659.1105  0.0017 -3.8843 3  712.6392137  71510 303682544      682445        syn-C2H3C(O)NH2, v=0
  325686.5121  0.0411 -4.8227 3 1242.4639191  71510 303952274      952175        syn-C2H3C(O)NH2, v=0
  325702.5185  0.0010 -5.2824 3  316.7839 89  71510 303441926      431925        syn-C2H3C(O)NH2, v=0
  325702.5204  0.0010 -5.2824 3  316.7839 89  71510 303441925      431924        syn-C2H3C(O)NH2, v=0
  325738.5295  0.0018 -5.7943 3   22.9439 27  71510 30313 7 6      12 4 9        syn-C2H3C(O)NH2, v=0
  325811.2590  0.0200 -3.8692 3  374.3154117 -71510 30358 355      58 256        syn-C2H3C(O)NH2, v=0
  325811.2590  0.0200 -3.8692 3  374.3154117 -71510 30358 455      58 356        syn-C2H3C(O)NH2, v=0
  325829.3793  0.0565 -6.0382 3 1901.0621233  71510 303B63186      B63087        syn-C2H3C(O)NH2, v=0
  325850.6299  0.0033 -6.2301 3  499.2713115  71510 303572136      581841        syn-C2H3C(O)NH2, v=0
  325871.1978  0.0200 -3.1909 3  264.2768 91 -71510 30345 937      44 836        syn-C2H3C(O)NH2, v=0
  325909.7256  0.0025 -6.3346 3  203.7384 71  71510 303351620      361323        syn-C2H3C(O)NH2, v=0
  325913.9085  0.0021 -3.5758 3  303.0426 95  71510 303471136      461235        syn-C2H3C(O)NH2, v=0
  325977.0846  0.0025 -6.3344 3  203.7362 71  71510 303351619      361324        syn-C2H3C(O)NH2, v=0
  326010.1104  0.0508 -5.9806 3 1871.4137231  71510 303B53185      B53086        syn-C2H3C(O)NH2, v=0
  326010.7838  0.0200 -3.5142 3  436.6413101 -71510 303502426      502327        syn-C2H3C(O)NH2, v=0
  326010.7838  0.0200 -3.5142 3  436.6413101 -71510 303502427      502328        syn-C2H3C(O)NH2, v=0
  326013.9025  0.0475 -5.5252 3 1632.8132215  71510 303A73078      A72979        syn-C2H3C(O)NH2, v=0
  326041.4612  0.0010 -5.1005 3  259.0377 89  71510 303441035      431034        syn-C2H3C(O)NH2, v=0
  326094.9832  0.0200 -3.7752 3  473.0983127 -71510 30363 657      63 558        syn-C2H3C(O)NH2, v=0
  326094.9832  0.0200 -3.7752 3  473.0983127 -71510 30363 757      63 658        syn-C2H3C(O)NH2, v=0
  326097.6889  0.0253 -4.5839 3 1105.8893181  71510 303901971      901872        syn-C2H3C(O)NH2, v=0
  326136.7994  0.0048 -5.2400 3   87.6822 53  71510 30326 720      26 423        syn-C2H3C(O)NH2, v=0
  326206.6206  0.0019 -3.3458 3  227.0250 83  71510 303411032      40 931        syn-C2H3C(O)NH2, v=0
  326260.5418  0.0455 -5.5790 3 1265.4140187  71510 303932965      923062        syn-C2H3C(O)NH2, v=0
  326276.9510  0.0023 -6.1876 3  308.3001 89  71510 303441827      451530        syn-C2H3C(O)NH2, v=0
  326280.6083  0.0019 -4.8479 3   42.7001 37  71510 30318 712      17 413        syn-C2H3C(O)NH2, v=0
  326294.2873  0.0456 -5.5789 3 1265.4139187  71510 303932964      923063        syn-C2H3C(O)NH2, v=0
  326306.4277  0.0009 -5.1144 3  258.0118 87  71510 303431232      421231        syn-C2H3C(O)NH2, v=0
  326342.5917  0.1804 -5.6395 3 1684.0373221  71510 303B02684      B02585        syn-C2H3C(O)NH2, v=0
  326389.8177  0.0587 -4.9724 3 1325.6301197  71510 303982276      982177        syn-C2H3C(O)NH2, v=0
  326424.0238  0.0248 -4.5831 3 1105.8909181  71510 303902071      901972        syn-C2H3C(O)NH2, v=0
  326448.3724  0.0051 -4.2226 3  316.7863111  71510 30355 154      55 055        syn-C2H3C(O)NH2, v=0
  326448.3724  0.0051 -4.2226 3  316.7863111  71510 30355 254      55 155        syn-C2H3C(O)NH2, v=0
  326454.8998  0.0010 -5.2527 3  308.2942 89  71510 303441827      431826        syn-C2H3C(O)NH2, v=0
  326454.9313  0.0010 -5.2527 3  308.2942 89  71510 303441826      431825        syn-C2H3C(O)NH2, v=0
  326460.1975  0.0101 -4.7464 3  819.8541153  71510 303762156      752253        syn-C2H3C(O)NH2, v=0
  326506.2692  0.0023 -6.1870 3  308.2925 89  71510 303441826      451531        syn-C2H3C(O)NH2, v=0
  326537.8931  0.0200 -3.5022 3  424.3293 99 -71510 303492425      492326        syn-C2H3C(O)NH2, v=0
  326537.8931  0.0200 -3.5022 3  424.3293 99 -71510 303492426      492327        syn-C2H3C(O)NH2, v=0
  326571.8641  0.0130 -4.8254 3  867.5548157  71510 303782257      772354        syn-C2H3C(O)NH2, v=0
  326704.2449  0.0705 -6.0944 3 1930.9450235  71510 303B73187      B73088        syn-C2H3C(O)NH2, v=0
  326744.5108  0.0200 -3.3227 3  237.4683 85 -71510 303421033      41 932        syn-C2H3C(O)NH2, v=0
  326754.9585  0.1161 -6.0183 3 1890.1627233  71510 303B63087      B62988        syn-C2H3C(O)NH2, v=0
  326768.0729  0.0054 -4.5644 3  198.5326 77  71510 303381028      38 731        syn-C2H3C(O)NH2, v=0
  326769.7036  0.0047 -4.2015 3  907.0498157  71510 303782652      782553        syn-C2H3C(O)NH2, v=0
  326795.0116  0.0047 -4.2014 3  907.0488157  71510 303782653      782554        syn-C2H3C(O)NH2, v=0
  326831.3826  0.0042 -6.4202 3  364.2943101  71510 303501635      511140        syn-C2H3C(O)NH2, v=0
  326880.8563  0.0205 -5.0360 3  871.6073159  71510 303792060      782157        syn-C2H3C(O)NH2, v=0
  326977.3877  0.0200 -3.8558 3  695.6993135 -71510 303672542      672443        syn-C2H3C(O)NH2, v=0
  326977.3877  0.0200 -3.8558 3  695.6993135 -71510 303672543      672444        syn-C2H3C(O)NH2, v=0
  327032.4765  0.0200 -3.4914 3  412.2711 97 -71510 303482424      482325        syn-C2H3C(O)NH2, v=0
  327032.4765  0.0200 -3.4914 3  412.2711 97 -71510 303482425      482326        syn-C2H3C(O)NH2, v=0
  327055.8320  0.0054 -6.4161 3  383.9162105  71510 303521538      531043        syn-C2H3C(O)NH2, v=0
  327148.8997  0.0516 -5.9217 3 1842.0096229  71510 303B43184      B43085        syn-C2H3C(O)NH2, v=0
  327159.0839  0.0200 -3.3674 3  216.7457 81 -71510 303401031      39 930        syn-C2H3C(O)NH2, v=0
  327196.2098  0.0010 -5.1289 3  263.2753 87  71510 303431330      421329        syn-C2H3C(O)NH2, v=0
  327269.5578  0.0036 -4.6540 3   43.9289 41  71510 30320 317      19 218        syn-C2H3C(O)NH2, v=0
  327367.0450  0.0010 -5.2243 3  300.3247 89  71510 303441728      431727        syn-C2H3C(O)NH2, v=0
  327367.5076  0.0010 -5.2243 3  300.3247 89  71510 303441727      431726        syn-C2H3C(O)NH2, v=0
  327385.2426  0.0200 -3.2237 3  105.6464 55 -71510 303271018      26 917        syn-C2H3C(O)NH2, v=0
  327423.4736  0.0218 -4.8162 3 1253.6754187  71510 303932865      932766        syn-C2H3C(O)NH2, v=0
  327460.6518  0.0107 -4.2820 3  924.7775167  71510 303831667      831568        syn-C2H3C(O)NH2, v=0
  327466.6004  0.0398 -5.4617 3 1207.0513183  71510 303912864      902961        syn-C2H3C(O)NH2, v=0
  327482.8049  0.0107 -4.2819 3  924.7775167  71510 303831767      831668        syn-C2H3C(O)NH2, v=0
  327496.2774  0.0200 -3.4818 3  400.4662 95 -71510 303472423      472324        syn-C2H3C(O)NH2, v=0
  327496.2774  0.0200 -3.4818 3  400.4662 95 -71510 303472424      472325        syn-C2H3C(O)NH2, v=0
  327554.7120  0.0399 -5.4614 3 1207.0511183  71510 303912863      902962        syn-C2H3C(O)NH2, v=0
  327574.2690  0.0107 -4.5084 3 1083.7281173  71510 303862759      862660        syn-C2H3C(O)NH2, v=0
  327628.5250  0.0411 -5.1080 3 1411.3637199  71510 303992970      992871        syn-C2H3C(O)NH2, v=0
  327647.5984  0.1349 -5.9286 3 1228.5845189  71510 303942372      932469        syn-C2H3C(O)NH2, v=0
  327693.0237  0.0334 -5.1530 3 1436.6518201  71510 303A02972      A02873        syn-C2H3C(O)NH2, v=0
  327701.0066  0.0200 -3.7867 3  512.6589131 -71510 30365 758      65 659        syn-C2H3C(O)NH2, v=0
  327701.0066  0.0200 -3.7867 3  512.6589131 -71510 30365 858      65 759        syn-C2H3C(O)NH2, v=0
  327713.1740  0.0038 -6.2911 3  568.0129123  71510 303612240      621943        syn-C2H3C(O)NH2, v=0
  327797.7795  0.0778 -5.1264 3 1411.3840203  71510 303A12378      A12279        syn-C2H3C(O)NH2, v=0
  327844.1862  0.0104 -4.5077 3 1083.7177173  71510 303862760      862661        syn-C2H3C(O)NH2, v=0
  327870.8640  0.0949 -5.4040 3 1563.8755213  71510 303A62681      A62582        syn-C2H3C(O)NH2, v=0
  327930.7508  0.0200 -3.4734 3  388.9141 93 -71510 303462422      462323        syn-C2H3C(O)NH2, v=0
  327930.7508  0.0200 -3.4734 3  388.9141 93 -71510 303462423      462324        syn-C2H3C(O)NH2, v=0
  327962.8961  0.0033 -6.3700 3  599.5231 91  71510 3034539 6      4439 5        syn-C2H3C(O)NH2, v=0
  327962.8961  0.0033 -6.3700 3  599.5231 91  71510 3034539 7      4439 6        syn-C2H3C(O)NH2, v=0
  327964.2493  0.1362 -5.4596 3 1590.5971215  71510 303A72582      A72483        syn-C2H3C(O)NH2, v=0
  327992.4117  0.0024 -5.3172 3   31.0426 33  71510 30316 610      15 313        syn-C2H3C(O)NH2, v=0
  328074.0267  0.0030 -6.2702 3  581.4021 91  71510 3034538 7      4438 6        syn-C2H3C(O)NH2, v=0
  328074.0267  0.0030 -6.2702 3  581.4021 91  71510 3034538 8      4438 7        syn-C2H3C(O)NH2, v=0
  328117.6685  0.0010 -5.0943 3  258.8467 89  71510 30344 935      43 934        syn-C2H3C(O)NH2, v=0
  328137.2055  0.3901 -6.2608 3 2009.9462241  71510 303C02991      C02892        syn-C2H3C(O)NH2, v=0
  328176.6260  0.0200 -3.8146 3  410.6351121 -71510 30360 456      60 357        syn-C2H3C(O)NH2, v=0
  328176.6260  0.0200 -3.8146 3  410.6351121 -71510 30360 556      60 457        syn-C2H3C(O)NH2, v=0
  328190.8895  0.0027 -6.1804 3  563.7531 91  71510 3034537 8      4437 7        syn-C2H3C(O)NH2, v=0
  328190.8895  0.0027 -6.1804 3  563.7531 91  71510 3034537 9      4437 8        syn-C2H3C(O)NH2, v=0
  328222.5422  0.0200 -3.8282 3  679.0234133 -71510 303662541      662442        syn-C2H3C(O)NH2, v=0
  328222.5422  0.0200 -3.8282 3  679.0234133 -71510 303662542      662443        syn-C2H3C(O)NH2, v=0
  328233.7986  0.0018 -4.6668 3   47.3623 39  71510 30319 713      18 414        syn-C2H3C(O)NH2, v=0
  328314.2346  0.0024 -6.0985 3  546.5764 91  71510 3034536 9      4436 8        syn-C2H3C(O)NH2, v=0
  328314.2346  0.0024 -6.0985 3  546.5764 91  71510 303453610      4436 9        syn-C2H3C(O)NH2, v=0
  328323.2524  0.1298 -5.8838 3 1820.3957229  71510 303B42986      B42887        syn-C2H3C(O)NH2, v=0
  328337.4249  0.0200 -3.4663 3  377.6145 91 -71510 303452421      452322        syn-C2H3C(O)NH2, v=0
  328337.4249  0.0200 -3.4663 3  377.6145 91 -71510 303452422      452323        syn-C2H3C(O)NH2, v=0
  328380.5603  0.1029 -5.2887 3 1499.7093209  71510 303A42480      A42381        syn-C2H3C(O)NH2, v=0
  328444.9232  0.0022 -6.0230 3  529.8726 91  71510 303453510      4435 9        syn-C2H3C(O)NH2, v=0
  328444.9232  0.0022 -6.0230 3  529.8726 91  71510 303453511      443510        syn-C2H3C(O)NH2, v=0
  328449.3892  0.2742 -6.2605 3 2014.6460239  71510 303B93386      B93287        syn-C2H3C(O)NH2, v=0
  328497.3188  0.0010 -5.1973 3  292.8905 89  71510 303441629      431628        syn-C2H3C(O)NH2, v=0
  328503.0449  0.0010 -5.1973 3  292.8907 89  71510 303441628      431627        syn-C2H3C(O)NH2, v=0
  328583.9487  0.0020 -5.9529 3  513.6421 91  71510 303453411      443410        syn-C2H3C(O)NH2, v=0
  328583.9487  0.0020 -5.9529 3  513.6421 91  71510 303453412      443411        syn-C2H3C(O)NH2, v=0
  328590.6748  0.0010 -3.2212 3  105.6125 55  71510 303271017      26 918        syn-C2H3C(O)NH2, v=0
  328594.8686  0.0530 -4.9667 3 1325.6436197  71510 303982376      982277        syn-C2H3C(O)NH2, v=0
  328616.3648  0.0037 -6.2889 3  567.9828123  71510 303612239      621944        syn-C2H3C(O)NH2, v=0
  328673.8858  0.0200 -3.3001 3  248.0743 87 -71510 303431034      42 933        syn-C2H3C(O)NH2, v=0
  328690.3708  0.0914 -6.1489 3 1961.0527237  71510 303B83188      B83089        syn-C2H3C(O)NH2, v=0
  328717.7102  0.0200 -3.4606 3  366.5667 89 -71510 303442420      442321        syn-C2H3C(O)NH2, v=0
  328717.7102  0.0200 -3.4606 3  366.5667 89 -71510 303442421      442322        syn-C2H3C(O)NH2, v=0
  328732.4616  0.0019 -5.8875 3  497.8855 91  71510 303453312      443311        syn-C2H3C(O)NH2, v=0
  328732.4616  0.0019 -5.8875 3  497.8855 91  71510 303453313      443312        syn-C2H3C(O)NH2, v=0
  328749.9841  0.0010 -5.0728 3  240.9746 85  71510 303421032      411031        syn-C2H3C(O)NH2, v=0
  328768.2422  0.0042 -4.1646 3  887.4859155  71510 303772651      772552        syn-C2H3C(O)NH2, v=0
  328782.2790  0.0042 -4.1646 3  887.4854155  71510 303772652      772553        syn-C2H3C(O)NH2, v=0
  328782.5144  0.0196 -4.8127 3 1253.6220187  71510 303932866      932767        syn-C2H3C(O)NH2, v=0
  328831.1147  0.0034 -4.6513 3   43.9286 41  71510 30320 417      19 118        syn-C2H3C(O)NH2, v=0
  328891.8015  0.0017 -5.8261 3  482.6033 91  71510 303453213      443212        syn-C2H3C(O)NH2, v=0
  328891.8015  0.0017 -5.8261 3  482.6033 91  71510 303453214      443213        syn-C2H3C(O)NH2, v=0
  328919.9011  0.0346 -5.3473 3 1150.1304179  71510 303892763      882860        syn-C2H3C(O)NH2, v=0
  329034.7690  0.0200 -3.8104 3  553.4868135 -71510 30367 859      67 760        syn-C2H3C(O)NH2, v=0
  329034.7690  0.0200 -3.8104 3  553.4868135 -71510 30367 959      67 860        syn-C2H3C(O)NH2, v=0
  329063.5365  0.0016 -5.7683 3  467.7961 91  71510 303453114      443113        syn-C2H3C(O)NH2, v=0
  329063.5365  0.0016 -5.7683 3  467.7961 91  71510 303453115      443114        syn-C2H3C(O)NH2, v=0
  329072.9382  0.0200 -3.4562 3  355.7704 87 -71510 303432419      432320        syn-C2H3C(O)NH2, v=0
  329072.9382  0.0200 -3.4562 3  355.7704 87 -71510 303432420      432321        syn-C2H3C(O)NH2, v=0
  329115.8592  0.0551 -5.8617 3 1812.8592227  71510 303B33183      B33084        syn-C2H3C(O)NH2, v=0
  329132.4382  0.0081 -4.2013 3  874.1042163  71510 303811566      811467        syn-C2H3C(O)NH2, v=0
  329139.3873  0.0081 -4.2012 3  874.1043163  71510 303811666      811567        syn-C2H3C(O)NH2, v=0
  329145.2473  0.0349 -5.3467 3 1150.1299179  71510 303892762      882861        syn-C2H3C(O)NH2, v=0
  329249.5124  0.0015 -5.7137 3  453.4649 91  71510 303453015      443014        syn-C2H3C(O)NH2, v=0
  329249.5124  0.0015 -5.7137 3  453.4649 91  71510 303453016      443015        syn-C2H3C(O)NH2, v=0
  329261.2643  0.0043 -3.9869 3  351.1107115  71510 30357 255      57 156        syn-C2H3C(O)NH2, v=0
  329261.2643  0.0043 -3.9869 3  351.1107115  71510 30357 355      57 256        syn-C2H3C(O)NH2, v=0
  329354.6962  0.0200 -2.9674 3   79.4122 35 -71510 3031715 2      1614 3        syn-C2H3C(O)NH2, v=0
  329354.6962  0.0200 -2.9674 3   79.4122 35 -71510 3031715 3      1614 2        syn-C2H3C(O)NH2, v=0
  329398.8114  0.0200 -3.8015 3  662.6109131 -71510 303652540      652441        syn-C2H3C(O)NH2, v=0
  329398.8114  0.0200 -3.8015 3  662.6109131 -71510 303652541      652442        syn-C2H3C(O)NH2, v=0
  329404.3690  0.0200 -3.4534 3  345.2252 85 -71510 303422418      422319        syn-C2H3C(O)NH2, v=0
  329404.3690  0.0200 -3.4534 3  345.2252 85 -71510 303422419      422320        syn-C2H3C(O)NH2, v=0
  329451.9166  0.0014 -5.6621 3  439.6104 91  71510 303452916      442915        syn-C2H3C(O)NH2, v=0
  329451.9166  0.0014 -5.6621 3  439.6104 91  71510 303452917      442916        syn-C2H3C(O)NH2, v=0
  329481.5233  0.0473 -5.4665 3 1605.4973213  71510 303A63077      A62978        syn-C2H3C(O)NH2, v=0
  329500.8042  0.0200 -3.3853 3  206.6398 79 -71510 303391030      38 929        syn-C2H3C(O)NH2, v=0
  329539.7410  0.0341 -4.7156 3 1184.7052187  71510 303932073      931974        syn-C2H3C(O)NH2, v=0
  329566.9599  0.0196 -4.4859 3 1051.0619177  71510 303881870      881771        syn-C2H3C(O)NH2, v=0
  329637.7381  0.0021 -4.3142 3  274.4117 89  71510 303441331      441034        syn-C2H3C(O)NH2, v=0
  329659.1692  0.0086 -4.7240 3  792.5725151  71510 303752056      742153        syn-C2H3C(O)NH2, v=0
  329673.3584  0.0014 -5.6133 3  426.2336 91  71510 303452817      442816        syn-C2H3C(O)NH2, v=0
  329673.3584  0.0014 -5.6133 3  426.2336 91  71510 303452818      442817        syn-C2H3C(O)NH2, v=0
  329684.3394  0.0194 -4.4856 3 1051.0625177  71510 303881970      881871        syn-C2H3C(O)NH2, v=0
  329713.2426  0.0200 -3.4522 3  334.9306 83 -71510 303412417      412318        syn-C2H3C(O)NH2, v=0
  329713.2426  0.0200 -3.4522 3  334.9306 83 -71510 303412418      412319        syn-C2H3C(O)NH2, v=0
  329760.3355  0.0200 -3.0027 3   81.5855 39 -71510 3031914 5      1813 6        syn-C2H3C(O)NH2, v=0
  329760.3355  0.0200 -3.0027 3   81.5855 39 -71510 3031914 6      1813 5        syn-C2H3C(O)NH2, v=0
  329761.7355  0.0200 -3.1415 3   97.1874 51 -71510 303251115      241014        syn-C2H3C(O)NH2, v=0
  329783.0628  0.0200 -3.1415 3   97.1867 51 -71510 303251114      241015        syn-C2H3C(O)NH2, v=0
  329794.5601  0.0183 -4.9038 3  916.7249161  71510 303802357      792456        syn-C2H3C(O)NH2, v=0
  329825.8282  0.0200 -3.2756 3  269.9133 91 -71510 30345 936      441035        syn-C2H3C(O)NH2, v=0
  329884.3008  0.0048 -6.3674 3  641.1757131  71510 303652343      662046        syn-C2H3C(O)NH2, v=0
  329916.9752  0.0013 -5.5669 3  413.3358 91  71510 303452718      442717        syn-C2H3C(O)NH2, v=0
  329916.9752  0.0013 -5.5669 3  413.3358 91  71510 303452719      442718        syn-C2H3C(O)NH2, v=0
  329926.3325  0.0010 -5.1713 3  286.0135 89  71510 303441530      431529        syn-C2H3C(O)NH2, v=0
  329984.8435  0.0010 -5.1711 3  286.0157 89  71510 303441529      431528        syn-C2H3C(O)NH2, v=0
  330000.7334  0.0200 -3.4527 3  324.8863 81 -71510 303402416      402317        syn-C2H3C(O)NH2, v=0
  330000.7334  0.0200 -3.4527 3  324.8863 81 -71510 303402417      402318        syn-C2H3C(O)NH2, v=0
  330081.1137  0.0200 -3.0409 3   85.2480 43 -71510 3032113 9      2012 8        syn-C2H3C(O)NH2, v=0
  330081.1137  0.0200 -3.0409 3   85.2480 43 -71510 3032113 8      2012 9        syn-C2H3C(O)NH2, v=0
  330081.5226  0.0023 -3.8441 3  595.5745139  71510 30369 960      69 861        syn-C2H3C(O)NH2, v=0
  330081.5245  0.0023 -3.8441 3  595.5745139  71510 303691060      69 961        syn-C2H3C(O)NH2, v=0
  330083.0197  0.0331 -4.7142 3 1184.7080187  71510 303932173      932074        syn-C2H3C(O)NH2, v=0
  330103.7620  0.1127 -5.5727 3 1656.5195219  71510 303A92783      A92684        syn-C2H3C(O)NH2, v=0
  330112.4793  0.0012 -5.0678 3  292.9994105  71510 30352 250      51 249        syn-C2H3C(O)NH2, v=0
  330112.4756  0.0200 -2.9088 3  292.9994105 -71510 30352 250      51 349        syn-C2H3C(O)NH2, v=0
  330112.4756  0.0200 -2.9088 3  292.9994105 -71510 30352 350      51 249        syn-C2H3C(O)NH2, v=0
  330112.4793  0.0012 -5.0678 3  292.9994105  71510 30352 350      51 349        syn-C2H3C(O)NH2, v=0
  330116.0861  0.0014 -5.0585 3  294.0357107  71510 30353 152      52 151        syn-C2H3C(O)NH2, v=0
  330116.0798  0.0200 -2.8780 3  294.0357107 -71510 30353 152      52 251        syn-C2H3C(O)NH2, v=0
  330116.0798  0.0200 -2.8780 3  294.0357107 -71510 30353 252      52 151        syn-C2H3C(O)NH2, v=0
  330116.0861  0.0014 -5.0585 3  294.0357107  71510 30353 252      52 251        syn-C2H3C(O)NH2, v=0
  330124.0978  0.0011 -5.0762 3  291.4420103  71510 30351 348      50 347        syn-C2H3C(O)NH2, v=0
  330124.1036  0.0200 -2.9416 3  291.4420103 -71510 30351 348      50 447        syn-C2H3C(O)NH2, v=0
  330124.1036  0.0200 -2.9416 3  291.4420103 -71510 30351 448      50 347        syn-C2H3C(O)NH2, v=0
  330124.0978  0.0011 -5.0762 3  291.4420103  71510 30351 448      50 447        syn-C2H3C(O)NH2, v=0
  330126.0565  0.0016 -5.0483 3  294.5609109  71510 30354 054      53 053        syn-C2H3C(O)NH2, v=0
  330126.0620  0.0200 -2.8487 3  294.5609109 -71510 30354 054      53 153        syn-C2H3C(O)NH2, v=0
  330126.0620  0.0200 -2.8487 3  294.5609109 -71510 30354 154      53 053        syn-C2H3C(O)NH2, v=0
  330126.0565  0.0016 -5.0483 3  294.5609109  71510 30354 154      53 153        syn-C2H3C(O)NH2, v=0
  330151.2751  0.0043 -3.9527 3  421.9889111  71510 303551441      541540        syn-C2H3C(O)NH2, v=0
  330164.7771  0.0200 -2.9770 3  289.3501101 -71510 30350 446      49 545        syn-C2H3C(O)NH2, v=0
  330164.7657  0.0010 -5.0835 3  289.3501101  71510 30350 546      49 545        syn-C2H3C(O)NH2, v=0
  330164.7658  0.0010 -5.0835 3  289.3501101  71510 30350 446      49 445        syn-C2H3C(O)NH2, v=0
  330164.7771  0.0200 -2.9770 3  289.3501101 -71510 30350 546      49 445        syn-C2H3C(O)NH2, v=0
  330186.5720  0.0013 -5.5230 3  400.9183 91  71510 303452619      442618        syn-C2H3C(O)NH2, v=0
  330186.5720  0.0013 -5.5230 3  400.9183 91  71510 303452620      442619        syn-C2H3C(O)NH2, v=0
  330186.7696  0.0200 -3.0853 3   90.4302 47 -71510 303231212      221111        syn-C2H3C(O)NH2, v=0
  330186.7696  0.0200 -3.0853 3   90.4302 47 -71510 303231211      221112        syn-C2H3C(O)NH2, v=0
  330256.8411  0.0200 -3.0160 3  286.7060 99 -71510 30349 544      48 643        syn-C2H3C(O)NH2, v=0
  330256.8377  0.0010 -5.0896 3  286.7060 99  71510 30349 644      48 643        syn-C2H3C(O)NH2, v=0
  330256.8437  0.0010 -5.0896 3  286.7060 99  71510 30349 544      48 543        syn-C2H3C(O)NH2, v=0
  330256.8411  0.0200 -3.0160 3  286.7060 99 -71510 30349 644      48 543        syn-C2H3C(O)NH2, v=0
  330267.8987  0.0200 -3.4551 3  315.0918 79 -71510 303392415      392316        syn-C2H3C(O)NH2, v=0
  330267.8987  0.0200 -3.4551 3  315.0918 79 -71510 303392416      392317        syn-C2H3C(O)NH2, v=0
  330297.6700  0.0062 -4.1262 3  824.6299159  71510 303791465      791366        syn-C2H3C(O)NH2, v=0
  330299.7340  0.0062 -4.1262 3  824.6299159  71510 303791565      791466        syn-C2H3C(O)NH2, v=0
  330308.0742  0.0200 -3.7911 3  448.2443125 -71510 30362 557      62 458        syn-C2H3C(O)NH2, v=0
  330308.0742  0.0200 -3.7911 3  448.2443125 -71510 30362 657      62 558        syn-C2H3C(O)NH2, v=0
  330330.2927  0.0096 -4.4646 3 1062.0381171  71510 303852758      852659        syn-C2H3C(O)NH2, v=0
  330438.0453  0.0200 -3.0602 3  283.4847 97 -71510 30348 642      47 741        syn-C2H3C(O)NH2, v=0
  330438.3255  0.0009 -5.0943 3  283.4847 97  71510 30348 742      47 741        syn-C2H3C(O)NH2, v=0
  330438.5476  0.0009 -5.0943 3  283.4847 97  71510 30348 642      47 641        syn-C2H3C(O)NH2, v=0
  330438.8358  0.0200 -3.0602 3  283.4847 97 -71510 30348 742      47 641        syn-C2H3C(O)NH2, v=0
  330486.8078  0.0012 -5.4812 3  388.9829 91  71510 303452520      442519        syn-C2H3C(O)NH2, v=0
  330486.8078  0.0012 -5.4812 3  388.9829 91  71510 303452521      442520        syn-C2H3C(O)NH2, v=0
  330489.4291  0.0094 -4.4642 3 1062.0320171  71510 303852759      852660        syn-C2H3C(O)NH2, v=0
  330510.1962  0.0200 -3.7757 3  646.4607129 -71510 303642539      642440        syn-C2H3C(O)NH2, v=0
  330510.1962  0.0200 -3.7757 3  646.4607129 -71510 303642540      642441        syn-C2H3C(O)NH2, v=0
  330515.9221  0.0200 -3.4596 3  305.5468 77 -71510 303382414      382315        syn-C2H3C(O)NH2, v=0
  330515.9221  0.0200 -3.4596 3  305.5468 77 -71510 303382415      382316        syn-C2H3C(O)NH2, v=0
  330555.6077  0.0064 -5.5441 3   77.5533 51  71510 30325 520      25 223        syn-C2H3C(O)NH2, v=0
  330565.3210  0.0127 -4.6912 3  800.7827151  71510 303752154      742253        syn-C2H3C(O)NH2, v=0
  330635.9113  0.0299 -5.2359 3 1094.6548175  71510 303872662      862759        syn-C2H3C(O)NH2, v=0
  330648.7636  0.0038 -4.1287 3  868.1939153  71510 303762650      762551        syn-C2H3C(O)NH2, v=0
  330656.4482  0.0038 -4.1287 3  868.1936153  71510 303762651      762552        syn-C2H3C(O)NH2, v=0
  330684.5145  0.0669 -5.3662 3 1551.9669209  71510 303A43074      A42975        syn-C2H3C(O)NH2, v=0
  330745.7378  0.0200 -3.4664 3  296.2510 75 -71510 303372413      372314        syn-C2H3C(O)NH2, v=0
  330745.7378  0.0200 -3.4664 3  296.2510 75 -71510 303372414      372315        syn-C2H3C(O)NH2, v=0
  330769.7053  0.0200 -3.1122 3  279.6499 95 -71510 30347 740      46 839        syn-C2H3C(O)NH2, v=0
  330776.9947  0.0009 -5.0974 3  279.6499 95  71510 30347 840      46 839        syn-C2H3C(O)NH2, v=0
  330782.9339  0.0009 -5.0974 3  279.6495 95  71510 30347 740      46 739        syn-C2H3C(O)NH2, v=0
  330790.2168  0.0200 -3.1121 3  279.6495 95 -71510 30347 840      46 739        syn-C2H3C(O)NH2, v=0
  330823.4514  0.0012 -5.4416 3  377.5315 91  71510 303452421      442420        syn-C2H3C(O)NH2, v=0
  330823.4514  0.0012 -5.4416 3  377.5315 91  71510 303452422      442421        syn-C2H3C(O)NH2, v=0
  330824.3325  0.0027 -3.8865 3  638.9141143  71510 303711061      71 962        syn-C2H3C(O)NH2, v=0
  330824.3412  0.0027 -3.8865 3  638.9141143  71510 303711161      711062        syn-C2H3C(O)NH2, v=0
  330874.9205  0.0010 -5.0753 3  243.9519 85  71510 303421131      411130        syn-C2H3C(O)NH2, v=0
  330920.4111  0.0026 -6.1773 3  362.6401 97  71510 303481930      491633        syn-C2H3C(O)NH2, v=0
  330942.7543  0.0047 -6.3647 3  641.1404131  71510 303652342      662047        syn-C2H3C(O)NH2, v=0
  330958.3726  0.0200 -3.4758 3  287.2039 73 -71510 303362412      362313        syn-C2H3C(O)NH2, v=0
  330958.3726  0.0200 -3.4758 3  287.2039 73 -71510 303362413      362314        syn-C2H3C(O)NH2, v=0
  331011.0253  0.0048 -4.0568 3  776.3645155  71510 303771364      771265        syn-C2H3C(O)NH2, v=0
  331011.6043  0.0048 -4.0568 3  776.3645155  71510 303771464      771365        syn-C2H3C(O)NH2, v=0
  331154.8006  0.0200 -3.4880 3  278.4053 71 -71510 303352411      352312        syn-C2H3C(O)NH2, v=0
  331154.8006  0.0200 -3.4880 3  278.4053 71 -71510 303352412      352313        syn-C2H3C(O)NH2, v=0
  331178.7633  0.0191 -4.7655 3 1230.1000185  71510 303922864      922765        syn-C2H3C(O)NH2, v=0
  331198.9035  0.0305 -5.2344 3 1094.6534175  71510 303872661      862760        syn-C2H3C(O)NH2, v=0
  331203.7359  0.0011 -5.4039 3  366.5667 91  71510 303452322      442321        syn-C2H3C(O)NH2, v=0
  331203.7359  0.0011 -5.4039 3  366.5667 91  71510 303452323      442322        syn-C2H3C(O)NH2, v=0
  331210.0470  0.0026 -6.1766 3  362.6304 97  71510 303481929      491634        syn-C2H3C(O)NH2, v=0
  331219.6271  0.0200 -3.1774 3  275.1467 93 -71510 30346 838      45 937        syn-C2H3C(O)NH2, v=0
  331223.6609  0.0024 -4.2969 3  285.8915 91  71510 303451332      451035        syn-C2H3C(O)NH2, v=0
  331231.0144  0.0670 -5.1178 3 1411.4064203  71510 303A12478      A12379        syn-C2H3C(O)NH2, v=0
  331243.2818  0.0032 -3.9365 3  683.4979147  71510 303731162      731063        syn-C2H3C(O)NH2, v=0
  331243.3196  0.0032 -3.9365 3  683.4979147  71510 303731262      731163        syn-C2H3C(O)NH2, v=0
  331313.1574  0.0029 -3.5542 3  105.2881 57  71510 30328 820      27 721        syn-C2H3C(O)NH2, v=0
  331314.8704  0.0038 -3.9935 3  729.3175151  71510 303751263      751164        syn-C2H3C(O)NH2, v=0
  331315.0233  0.0038 -3.9935 3  729.3175151  71510 303751363      751264        syn-C2H3C(O)NH2, v=0
  331335.8907  0.0200 -3.5036 3  269.8548 69 -71510 303342410      342311        syn-C2H3C(O)NH2, v=0
  331335.8907  0.0200 -3.5036 3  269.8548 69 -71510 303342411      342312        syn-C2H3C(O)NH2, v=0
  331370.5266  0.0313 -5.0983 3 1411.2136199  71510 303992971      992872        syn-C2H3C(O)NH2, v=0
  331374.6111  0.0010 -5.0983 3  275.1467 93  71510 30346 938      45 937        syn-C2H3C(O)NH2, v=0
  331400.0025  0.0010 -5.0989 3  264.0289 89  71510 303441134      431133        syn-C2H3C(O)NH2, v=0
  331459.4506  0.1745 -5.9418 3 1853.5909229  71510 303B43282      B43183        syn-C2H3C(O)NH2, v=0
  331486.3927  0.0010 -5.0980 3  275.1378 93  71510 30346 838      45 837        syn-C2H3C(O)NH2, v=0
  331502.4881  0.0200 -3.5231 3  261.5521 67 -71510 3033324 9      332310        syn-C2H3C(O)NH2, v=0
  331502.4881  0.0200 -3.5231 3  261.5521 67 -71510 303332410      332311        syn-C2H3C(O)NH2, v=0
  331560.3924  0.0200 -3.7508 3  630.5722127 -71510 303632538      632439        syn-C2H3C(O)NH2, v=0
  331560.3924  0.0200 -3.7508 3  630.5722127 -71510 303632539      632440        syn-C2H3C(O)NH2, v=0
  331570.9599  0.0015 -4.5008 3   52.2378 41  71510 30320 714      19 415        syn-C2H3C(O)NH2, v=0
  331636.8668  0.0011 -5.3681 3  356.0915 91  71510 303452223      442222        syn-C2H3C(O)NH2, v=0
  331636.8668  0.0011 -5.3681 3  356.0915 91  71510 303452224      442223        syn-C2H3C(O)NH2, v=0
  331641.4161  0.0200 -3.1762 3  275.1378 93 -71510 30346 938      45 837        syn-C2H3C(O)NH2, v=0
  331655.4879  0.0200 -3.5472 3  253.4969 65 -71510 3033224 8      3223 9        syn-C2H3C(O)NH2, v=0
  331655.4879  0.0200 -3.5472 3  253.4969 65 -71510 3033224 9      322310        syn-C2H3C(O)NH2, v=0
  331694.2792  0.0010 -5.1463 3  279.7231 89  71510 303441431      431430        syn-C2H3C(O)NH2, v=0
  331760.9679  0.0584 -5.8011 3 1783.9712225  71510 303B23182      B23083        syn-C2H3C(O)NH2, v=0
  331768.1539  0.0200 -3.2787 3  258.8467 89 -71510 303441035      43 934        syn-C2H3C(O)NH2, v=0
  331795.6998  0.0200 -3.5770 3  245.6888 63 -71510 3033124 7      3123 8        syn-C2H3C(O)NH2, v=0
  331795.6998  0.0200 -3.5770 3  245.6888 63 -71510 3033124 8      3123 9        syn-C2H3C(O)NH2, v=0
  331796.2247  0.1168 -6.2019 3 1991.3760239  71510 303B93189      B93090        syn-C2H3C(O)NH2, v=0
  331807.0964  0.0031 -4.8892 3  115.6135 59  71510 30329 921      29 624        syn-C2H3C(O)NH2, v=0
  331842.2232  0.1395 -6.0662 3 1919.8759235  71510 303B73088      B72989        syn-C2H3C(O)NH2, v=0
  331848.3043  0.0032 -4.3748 3   51.7637 43  71510 30321 517      20 218        syn-C2H3C(O)NH2, v=0
  331859.5114  0.0200 -3.8793 3  386.7387119 -71510 30359 356      59 257        syn-C2H3C(O)NH2, v=0
  331859.5114  0.0200 -3.8793 3  386.7387119 -71510 30359 456      59 357        syn-C2H3C(O)NH2, v=0
  331923.9404  0.0015 -3.6138 3  238.1277 61  71510 3033024 6      3023 7        syn-C2H3C(O)NH2, v=0
  331923.9404  0.0015 -3.6138 3  238.1277 61  71510 3033024 7      3023 8        syn-C2H3C(O)NH2, v=0
  332018.7665  0.0178 -4.7633 3 1230.0672185  71510 303922865      922766        syn-C2H3C(O)NH2, v=0
  332040.8837  0.0200 -3.6598 3  230.8132 59 -71510 3032924 5      2923 6        syn-C2H3C(O)NH2, v=0
  332040.8837  0.0200 -3.6598 3  230.8132 59 -71510 3032924 6      2923 7        syn-C2H3C(O)NH2, v=0
  332085.4673  0.1085 -5.6439 3 1699.3705219  71510 303A93178      A93079        syn-C2H3C(O)NH2, v=0
  332109.2215  0.0010 -5.0972 3  269.9133 91  71510 303451036      441035        syn-C2H3C(O)NH2, v=0
  332134.7679  0.0011 -5.3340 3  346.1097 91  71510 303452124      442123        syn-C2H3C(O)NH2, v=0
  332134.7679  0.0011 -5.3340 3  346.1097 91  71510 303452125      442124        syn-C2H3C(O)NH2, v=0
  332147.2346  0.0200 -3.7182 3  223.7450 57 -71510 3032824 4      2823 5        syn-C2H3C(O)NH2, v=0
  332147.2346  0.0200 -3.7182 3  223.7450 57 -71510 3032824 5      2823 6        syn-C2H3C(O)NH2, v=0
  332170.5788  0.0010 -5.1451 3  279.7434 89  71510 303441430      431429        syn-C2H3C(O)NH2, v=0
  332196.4433  0.0200 -3.7885 3  487.1358129 -71510 30364 658      64 559        syn-C2H3C(O)NH2, v=0
  332196.4433  0.0200 -3.7885 3  487.1358129 -71510 30364 758      64 659        syn-C2H3C(O)NH2, v=0
  332221.1806  0.0023 -6.2544 3  248.1550 79  71510 303391723      401426        syn-C2H3C(O)NH2, v=0
  332243.7440  0.0017 -3.7944 3  216.9230 55  71510 3032724 3      2723 4        syn-C2H3C(O)NH2, v=0
  332243.7440  0.0017 -3.7944 3  216.9230 55  71510 3032724 4      2723 5        syn-C2H3C(O)NH2, v=0
  332263.0243  0.0151 -4.3935 3  997.4013173  71510 303861769      861670        syn-C2H3C(O)NH2, v=0
  332303.1561  0.0151 -4.3934 3  997.4015173  71510 303861869      861770        syn-C2H3C(O)NH2, v=0
  332313.5321  0.0023 -6.2542 3  248.1519 79  71510 303391722      401427        syn-C2H3C(O)NH2, v=0
  332331.0413  0.0200 -3.8988 3  210.3468 53 -71510 3032624 2      2623 3        syn-C2H3C(O)NH2, v=0
  332331.0413  0.0200 -3.8988 3  210.3468 53 -71510 3032624 3      2623 4        syn-C2H3C(O)NH2, v=0
  332334.7276  0.0069 -5.0565 3  118.3921 61  71510 30330 723      30 426        syn-C2H3C(O)NH2, v=0
  332369.7643  0.0042 -5.0318 3  104.6268 57  71510 30328 821      28 524        syn-C2H3C(O)NH2, v=0
  332396.2383  0.1017 -6.3648 3 1671.8447213  71510 303A63572      A53669        syn-C2H3C(O)NH2, v=0
  332396.3807  0.1017 -6.3648 3 1671.8447213  71510 303A63571      A53670        syn-C2H3C(O)NH2, v=0
  332409.7947  0.0018 -4.0544 3  204.0162 51  71510 3032524 1      2523 2        syn-C2H3C(O)NH2, v=0
  332409.7947  0.0018 -4.0544 3  204.0162 51  71510 3032524 2      2523 3        syn-C2H3C(O)NH2, v=0
  332419.6715  0.1307 -5.7473 3 1751.7220225  71510 303B22885      B22786        syn-C2H3C(O)NH2, v=0
  332420.9515  0.0034 -4.0937 3  849.1724151  71510 303752649      752550        syn-C2H3C(O)NH2, v=0
  332425.1038  0.0034 -4.0937 3  849.1723151  71510 303752650      752551        syn-C2H3C(O)NH2, v=0
  332480.5802  0.0200 -4.3349 3  197.9309 49 -71510 3032424 0      2423 1        syn-C2H3C(O)NH2, v=0
  332480.5802  0.0200 -4.3349 3  197.9309 49 -71510 3032424 1      2423 2        syn-C2H3C(O)NH2, v=0
  332486.2571  0.0053 -4.2306 3  328.2017113  71510 30356 155      56 056        syn-C2H3C(O)NH2, v=0
  332486.2571  0.0053 -4.2306 3  328.2017113  71510 30356 255      56 156        syn-C2H3C(O)NH2, v=0
  332543.9234  0.0455 -4.8549 3 1266.1172193  71510 303962175      962076        syn-C2H3C(O)NH2, v=0
  332552.8928  0.0200 -3.7268 3  614.9444125 -71510 303622537      622438        syn-C2H3C(O)NH2, v=0
  332552.8928  0.0200 -3.7268 3  614.9444125 -71510 303622538      622439        syn-C2H3C(O)NH2, v=0
  332586.4174  0.0348 -5.0506 3 1386.1574197  71510 303982969      982870        syn-C2H3C(O)NH2, v=0
  332587.2182  0.0256 -5.1279 3 1040.6285171  71510 303852561      842658        syn-C2H3C(O)NH2, v=0
  332697.0435  0.0022 -4.3546 3  263.0918 87  71510 303431330      431033        syn-C2H3C(O)NH2, v=0
  332713.2171  0.0011 -5.3017 3  336.6265 91  71510 303452026      442025        syn-C2H3C(O)NH2, v=0
  332713.2173  0.0011 -5.3017 3  336.6265 91  71510 303452025      442024        syn-C2H3C(O)NH2, v=0
  332733.7902  0.0048 -4.4619 3  232.8531 83  71510 303411130      41 833        syn-C2H3C(O)NH2, v=0
  332774.7036  0.0909 -6.2291 3 1604.4079209  71510 303A43471      A33568        syn-C2H3C(O)NH2, v=0
  332775.1063  0.0909 -6.2291 3 1604.4079209  71510 303A43470      A33569        syn-C2H3C(O)NH2, v=0
  332893.4462  0.0086 -4.4219 3 1040.6285169  71510 303842757      842658        syn-C2H3C(O)NH2, v=0
  332919.1038  0.0028 -3.3965 3  196.7240 77  71510 303381029      37 928        syn-C2H3C(O)NH2, v=0
  332986.0727  0.0085 -4.4217 3 1040.6249169  71510 303842758      842659        syn-C2H3C(O)NH2, v=0
  333003.2535  0.0018 -5.6189 3   26.1464 29  71510 30314 7 7      13 410        syn-C2H3C(O)NH2, v=0
  333003.5478  0.0060 -5.9196 3   62.5290 47  71510 30323 419      23 122        syn-C2H3C(O)NH2, v=0
  333009.8029  0.2995 -6.0539 3 1908.0593235  71510 303B72889      B72790        syn-C2H3C(O)NH2, v=0
  333030.3834  0.0029 -5.3193 3   80.1377 47  71510 303231013      23 716        syn-C2H3C(O)NH2, v=0
  333120.4777  0.0154 -4.9263 3  851.3160157  71510 303782059      772156        syn-C2H3C(O)NH2, v=0
  333162.6506  0.0461 -5.4081 3 1578.4626211  71510 303A53076      A52977        syn-C2H3C(O)NH2, v=0
  333254.5061  0.0200 -3.2292 3  112.4350 57 -71510 303281019      27 918        syn-C2H3C(O)NH2, v=0
  333263.0169  0.0413 -5.2994 3  983.7030169  71510 303842164      832261        syn-C2H3C(O)NH2, v=0
  333268.7155  0.0811 -6.0963 3 1538.3996205  71510 303A23370      A13467        syn-C2H3C(O)NH2, v=0
  333269.8402  0.0811 -6.0963 3 1538.3996205  71510 303A23369      A13468        syn-C2H3C(O)NH2, v=0
  333323.0628  0.0048 -4.0573 3  470.8262117  71510 303581543      571642        syn-C2H3C(O)NH2, v=0
  333361.8058  0.0779 -5.5996 3 1102.7059179  71510 303892268      882365        syn-C2H3C(O)NH2, v=0
  333393.6535  0.0010 -5.2709 3  327.6482 91  71510 303451927      441926        syn-C2H3C(O)NH2, v=0
  333393.6578  0.0010 -5.2709 3  327.6482 91  71510 303451926      441925        syn-C2H3C(O)NH2, v=0
  333431.9106  0.0434 -4.8526 3 1266.1222193  71510 303962275      962176        syn-C2H3C(O)NH2, v=0
  333457.0551  0.0010 -5.1233 3  274.0395 89  71510 303441332      431331        syn-C2H3C(O)NH2, v=0
  333476.3028  0.0010 -5.0932 3  269.7915 91  71510 30345 936      44 935        syn-C2H3C(O)NH2, v=0
  333490.6876  0.0200 -3.7037 3  599.5768123 -71510 303612536      612437        syn-C2H3C(O)NH2, v=0
  333490.6876  0.0200 -3.7037 3  599.5768123 -71510 303612537      612438        syn-C2H3C(O)NH2, v=0
  333594.2976  0.0267 -4.6113 3 1128.0955183  71510 303911972      911873        syn-C2H3C(O)NH2, v=0
  333630.4633  0.0834 -5.2756 3 1499.7459209  71510 303A42580      A42481        syn-C2H3C(O)NH2, v=0
  333794.0903  0.0039 -6.2543 3   47.2092 39  71510 30319 712      19 217        syn-C2H3C(O)NH2, v=0
  333795.8506  0.0264 -4.6108 3 1128.0965183  71510 303912072      911973        syn-C2H3C(O)NH2, v=0
  333831.0958  0.0200 -3.8013 3  527.3024133 -71510 30366 759      66 660        syn-C2H3C(O)NH2, v=0
  333831.0958  0.0200 -3.8013 3  527.3024133 -71510 30366 859      66 760        syn-C2H3C(O)NH2, v=0
  333881.1158  0.0011 -5.0942 3  258.5281 87  71510 303431231      421230        syn-C2H3C(O)NH2, v=0
  333896.0240  0.0721 -5.9664 3 1473.8217201  71510 303A03269      993366        syn-C2H3C(O)NH2, v=0
  333899.1233  0.0721 -5.9664 3 1473.8217201  71510 303A03268      993367        syn-C2H3C(O)NH2, v=0
  333900.8737  0.0010 -5.1060 3  268.8962 89  71510 303441233      431232        syn-C2H3C(O)NH2, v=0
  333933.8914  0.0099 -4.7728 3  811.8092153  71510 303762057      752154        syn-C2H3C(O)NH2, v=0
  333956.4740  0.0268 -5.1241 3 1040.6249171  71510 303852560      842659        syn-C2H3C(O)NH2, v=0
  334093.0625  0.0031 -4.0597 3  830.4202149  71510 303742648      742549        syn-C2H3C(O)NH2, v=0
  334095.2767  0.0031 -4.0597 3  830.4201149  71510 303742649      742550        syn-C2H3C(O)NH2, v=0
  334206.1948  0.0010 -5.2417 3  319.1835 91  71510 303451828      441827        syn-C2H3C(O)NH2, v=0
  334206.2646  0.0010 -5.2417 3  319.1835 91  71510 303451827      441826        syn-C2H3C(O)NH2, v=0
  334236.3167  0.0028 -3.8260 3  423.6634123  71510 30361 457      61 358        syn-C2H3C(O)NH2, v=0
  334236.3167  0.0028 -3.8260 3  423.6634123  71510 30361 557      61 458        syn-C2H3C(O)NH2, v=0
  334307.4682  0.0011 -5.0720 3  251.9405 87  71510 303431033      421032        syn-C2H3C(O)NH2, v=0
  334325.4157  0.0116 -4.3065 3  944.9200169  71510 303841668      841569        syn-C2H3C(O)NH2, v=0
  334338.4536  0.0116 -4.3065 3  944.9200169  71510 303841768      841669        syn-C2H3C(O)NH2, v=0
  334376.8212  0.0200 -3.6815 3  584.4685121 -71510 303602535      602436        syn-C2H3C(O)NH2, v=0
  334376.8212  0.0200 -3.6815 3  584.4685121 -71510 303602536      602437        syn-C2H3C(O)NH2, v=0
  334389.4407  0.0045 -4.1715 3   65.0154 47  71510 30323 518      22 419        syn-C2H3C(O)NH2, v=0
  334571.6052  0.0200 -3.3651 3  115.7134 59 -71510 30329 920      28 821        syn-C2H3C(O)NH2, v=0
  334589.4818  0.0169 -4.7164 3 1206.8164183  71510 303912863      912764        syn-C2H3C(O)NH2, v=0
  334642.6063  0.0216 -5.0240 3  988.0569167  71510 303832460      822557        syn-C2H3C(O)NH2, v=0
  334672.5826  0.0691 -6.2747 3 2033.1139241  71510 303C03289      C03190        syn-C2H3C(O)NH2, v=0
  334678.1143  0.0639 -5.8394 3 1410.6764197  71510 303983168      973265        syn-C2H3C(O)NH2, v=0
  334686.5302  0.0639 -5.8393 3 1410.6764197  71510 303983167      973266        syn-C2H3C(O)NH2, v=0
  334808.4720  0.0618 -6.2149 3 2002.4436239  71510 303B93288      B93189        syn-C2H3C(O)NH2, v=0
  334927.0972  0.0603 -5.7401 3 1755.3533223  71510 303B13181      B13082        syn-C2H3C(O)NH2, v=0
  334943.7216  0.1479 -5.9275 3 1849.4783231  71510 303B52987      B52888        syn-C2H3C(O)NH2, v=0
  334981.9996  0.0290 -5.0444 3 1386.0622197  71510 303982970      982871        syn-C2H3C(O)NH2, v=0
  334989.1386  0.0200 -3.3834 3  286.3565 93 -71510 303461036      451135        syn-C2H3C(O)NH2, v=0
  335019.7185  0.0029 -6.1903 3  421.4317105  71510 303522033      531736        syn-C2H3C(O)NH2, v=0
  335049.4535  0.0599 -5.0018 3 1350.1186199  71510 303992277      992178        syn-C2H3C(O)NH2, v=0
  335101.7092  0.0162 -4.7151 3 1206.7966183  71510 303912864      912765        syn-C2H3C(O)NH2, v=0
  335194.8192  0.0010 -5.2137 3  311.2445 91  71510 303451729      441728        syn-C2H3C(O)NH2, v=0
  335195.7837  0.0010 -5.2137 3  311.2445 91  71510 303451728      441727        syn-C2H3C(O)NH2, v=0
  335200.2926  0.0022 -3.8262 3  568.7369137  71510 30368 860      68 761        syn-C2H3C(O)NH2, v=0
  335200.2928  0.0022 -3.8262 3  568.7369137  71510 30368 960      68 861        syn-C2H3C(O)NH2, v=0
  335213.9496  0.0200 -3.6602 3  569.6190119 -71510 303592534      592435        syn-C2H3C(O)NH2, v=0
  335213.9496  0.0200 -3.6602 3  569.6190119 -71510 303592535      592436        syn-C2H3C(O)NH2, v=0
  335288.2286  0.0078 -4.3803 3 1019.4969167  71510 303832756      832657        syn-C2H3C(O)NH2, v=0
  335300.5565  0.0120 -4.8392 3  831.3861155  71510 303772058      762155        syn-C2H3C(O)NH2, v=0
  335301.7025  0.0045 -3.9963 3  363.1309117  71510 30358 256      58 157        syn-C2H3C(O)NH2, v=0
  335301.7025  0.0045 -3.9963 3  363.1309117  71510 30358 356      58 257        syn-C2H3C(O)NH2, v=0
  335307.8739  0.0033 -6.3113 3  610.4627 93  71510 3034639 7      4539 6        syn-C2H3C(O)NH2, v=0
  335307.8739  0.0033 -6.3113 3  610.4627 93  71510 3034639 8      4539 7        syn-C2H3C(O)NH2, v=0
  335341.4638  0.0077 -4.3802 3 1019.4949167  71510 303832757      832658        syn-C2H3C(O)NH2, v=0
  335378.2938  0.0029 -6.1894 3  421.4197105  71510 303522032      531737        syn-C2H3C(O)NH2, v=0
  335380.5329  0.0038 -4.8856 3  131.7542 61  71510 303301119      30 822        syn-C2H3C(O)NH2, v=0
  335397.6317  0.0052 -4.1618 3  522.3245123  71510 303611645      601744        syn-C2H3C(O)NH2, v=0
  335425.1446  0.0030 -6.2204 3  592.3455 93  71510 3034638 8      4538 7        syn-C2H3C(O)NH2, v=0
  335425.1446  0.0030 -6.2204 3  592.3455 93  71510 3034638 9      4538 8        syn-C2H3C(O)NH2, v=0
  335504.8785  0.0043 -5.7570 3   28.5619 33  71510 30316 511      15 214        syn-C2H3C(O)NH2, v=0
  335519.4404  0.0010 -3.2247 3  112.3721 57  71510 303281018      27 919        syn-C2H3C(O)NH2, v=0
  335548.5823  0.0027 -6.1374 3  574.7003 93  71510 3034637 9      4537 8        syn-C2H3C(O)NH2, v=0
  335548.5823  0.0027 -6.1374 3  574.7003 93  71510 303463710      4537 9        syn-C2H3C(O)NH2, v=0
  335610.3599  0.0869 -6.3331 3 2064.0177243  71510 303C13290      C13191        syn-C2H3C(O)NH2, v=0
  335640.6998  0.0565 -5.7151 3 1348.9660193  71510 303963067      953164        syn-C2H3C(O)NH2, v=0
  335663.1884  0.0565 -5.7151 3 1348.9659193  71510 303963066      953165        syn-C2H3C(O)NH2, v=0
  335672.2608  0.0028 -4.0266 3  811.9362147  71510 303732647      732548        syn-C2H3C(O)NH2, v=0
  335673.4260  0.0028 -4.0266 3  811.9361147  71510 303732648      732549        syn-C2H3C(O)NH2, v=0
  335678.9899  0.0024 -6.0608 3  557.5278 93  71510 303463610      4536 9        syn-C2H3C(O)NH2, v=0
  335678.9899  0.0024 -6.0608 3  557.5278 93  71510 303463611      453610        syn-C2H3C(O)NH2, v=0
  335759.6738  0.0200 -3.2590 3  269.7915 91 -71510 303451036      44 935        syn-C2H3C(O)NH2, v=0
  335763.8440  0.0110 -4.7659 3  839.1776155  71510 303772157      762254        syn-C2H3C(O)NH2, v=0
  335817.2896  0.0022 -5.9896 3  540.8284 93  71510 303463511      453510        syn-C2H3C(O)NH2, v=0
  335817.2896  0.0022 -5.9896 3  540.8284 93  71510 303463512      453511        syn-C2H3C(O)NH2, v=0
  335844.6375  0.1018 -5.4401 3 1590.6559215  71510 303A72682      A72583        syn-C2H3C(O)NH2, v=0
  335844.6951  0.0089 -4.2249 3  893.6293165  71510 303821567      821468        syn-C2H3C(O)NH2, v=0
  335848.7152  0.0089 -4.2249 3  893.6293165  71510 303821667      821568        syn-C2H3C(O)NH2, v=0
  335923.3105  0.0630 -6.1538 3 1972.0166237  71510 303B83287      B83188        syn-C2H3C(O)NH2, v=0
  335964.5454  0.0020 -5.9230 3  524.6025 93  71510 303463412      453411        syn-C2H3C(O)NH2, v=0
  335964.5454  0.0020 -5.9230 3  524.6025 93  71510 303463413      453412        syn-C2H3C(O)NH2, v=0
  335982.7932  0.1448 -6.2534 3 2021.9067241  71510 303C03190      C03091        syn-C2H3C(O)NH2, v=0
  336004.6584  0.0200 -3.6398 3  555.0275117 -71510 303582533      582434        syn-C2H3C(O)NH2, v=0
  336004.6584  0.0200 -3.6398 3  555.0275117 -71510 303582534      582435        syn-C2H3C(O)NH2, v=0
  336121.9902  0.0018 -5.8605 3  508.8508 93  71510 303463313      453312        syn-C2H3C(O)NH2, v=0
  336121.9902  0.0018 -5.8605 3  508.8508 93  71510 303463314      453313        syn-C2H3C(O)NH2, v=0
  336160.9719  0.0012 -5.0668 3  304.0108107  71510 30353 251      52 250        syn-C2H3C(O)NH2, v=0
  336160.9744  0.0200 -2.9068 3  304.0108107 -71510 30353 251      52 350        syn-C2H3C(O)NH2, v=0
  336160.9744  0.0200 -2.9068 3  304.0108107 -71510 30353 351      52 250        syn-C2H3C(O)NH2, v=0
  336160.9719  0.0012 -5.0668 3  304.0108107  71510 30353 351      52 350        syn-C2H3C(O)NH2, v=0
  336165.0832  0.0014 -5.0577 3  305.0472109  71510 30354 153      53 152        syn-C2H3C(O)NH2, v=0
  336165.0898  0.0200 -2.8766 3  305.0472109 -71510 30354 153      53 252        syn-C2H3C(O)NH2, v=0
  336165.0898  0.0200 -2.8766 3  305.0472109 -71510 30354 253      53 152        syn-C2H3C(O)NH2, v=0
  336165.0832  0.0014 -5.0577 3  305.0472109  71510 30354 253      53 252        syn-C2H3C(O)NH2, v=0
  336171.2497  0.0011 -5.0749 3  302.4537105  71510 30352 349      51 348        syn-C2H3C(O)NH2, v=0
  336171.2483  0.0200 -2.9387 3  302.4537105 -71510 30352 349      51 448        syn-C2H3C(O)NH2, v=0
  336171.2483  0.0200 -2.9387 3  302.4537105 -71510 30352 449      51 348        syn-C2H3C(O)NH2, v=0
  336171.2497  0.0011 -5.0749 3  302.4537105  71510 30352 449      51 448        syn-C2H3C(O)NH2, v=0
  336175.1773  0.0017 -5.0477 3  305.5727111  71510 30355 055      54 054        syn-C2H3C(O)NH2, v=0
  336175.1704  0.0200 -2.8479 3  305.5727111 -71510 30355 055      54 154        syn-C2H3C(O)NH2, v=0
  336175.1704  0.0200 -2.8479 3  305.5727111 -71510 30355 155      54 054        syn-C2H3C(O)NH2, v=0
  336175.1773  0.0017 -5.0477 3  305.5727111  71510 30355 155      54 154        syn-C2H3C(O)NH2, v=0
  336203.7602  0.0056 -5.9143 3   62.5290 47  71510 30323 519      23 222        syn-C2H3C(O)NH2, v=0
  336208.9007  0.0200 -2.9731 3  300.3632103 -71510 30351 447      50 546        syn-C2H3C(O)NH2, v=0
  336208.9001  0.0011 -5.0820 3  300.3632103  71510 30351 547      50 546        syn-C2H3C(O)NH2, v=0
  336208.9002  0.0011 -5.0820 3  300.3632103  71510 30351 447      50 446        syn-C2H3C(O)NH2, v=0
  336208.9007  0.0200 -2.9731 3  300.3632103 -71510 30351 547      50 446        syn-C2H3C(O)NH2, v=0
  336213.1437  0.0200 -2.9239 3   82.3608 33 -71510 3031616 0      1515 1        syn-C2H3C(O)NH2, v=0
  336213.1437  0.0200 -2.9239 3   82.3608 33 -71510 3031616 1      1515 0        syn-C2H3C(O)NH2, v=0
  336240.4051  0.2287 -5.8567 3 1808.6949229  71510 303B42787      B42688        syn-C2H3C(O)NH2, v=0
  336285.3404  0.0025 -6.3825 3  194.7647 69  71510 303341619      351322        syn-C2H3C(O)NH2, v=0
  336290.1268  0.0200 -3.8612 3  611.4318141 -71510 30370 961      70 862        syn-C2H3C(O)NH2, v=0
  336290.1268  0.0200 -3.8612 3  611.4318141 -71510 303701061      70 962        syn-C2H3C(O)NH2, v=0
  336291.0603  0.0017 -5.8016 3  493.5739 93  71510 303463214      453213        syn-C2H3C(O)NH2, v=0
  336291.0603  0.0017 -5.8016 3  493.5739 93  71510 303463215      453214        syn-C2H3C(O)NH2, v=0
  336294.6798  0.0200 -3.0108 3  297.7222101 -71510 30350 545      49 644        syn-C2H3C(O)NH2, v=0
  336294.6694  0.0010 -5.0879 3  297.7222101  71510 30350 645      49 644        syn-C2H3C(O)NH2, v=0
  336294.6724  0.0010 -5.0879 3  297.7221101  71510 30350 545      49 544        syn-C2H3C(O)NH2, v=0
  336294.6798  0.0200 -3.0108 3  297.7221101 -71510 30350 645      49 544        syn-C2H3C(O)NH2, v=0
  336301.8459  0.0010 -5.1161 3  274.1894 89  71510 303441331      431330        syn-C2H3C(O)NH2, v=0
  336318.5539  0.0025 -6.3824 3  194.7635 69  71510 303341618      351323        syn-C2H3C(O)NH2, v=0
  336383.9397  0.0200 -3.8038 3  461.8777127 -71510 30363 558      63 459        syn-C2H3C(O)NH2, v=0
  336383.9397  0.0200 -3.8038 3  461.8777127 -71510 30363 658      63 559        syn-C2H3C(O)NH2, v=0
  336424.9004  0.0010 -5.1870 3  303.8480 91  71510 303451630      441629        syn-C2H3C(O)NH2, v=0
  336436.1057  0.0010 -5.1870 3  303.8484 91  71510 303451629      441628        syn-C2H3C(O)NH2, v=0
  336455.3279  0.0178 -4.9260 3  936.9481163  71510 303812359      802456        syn-C2H3C(O)NH2, v=0
  336463.3938  0.0200 -3.0533 3  294.5069 99 -71510 30349 643      48 742        syn-C2H3C(O)NH2, v=0
  336463.3247  0.0010 -5.0925 3  294.5069 99  71510 30349 743      48 742        syn-C2H3C(O)NH2, v=0
  336463.4426  0.0010 -5.0925 3  294.5069 99  71510 30349 643      48 642        syn-C2H3C(O)NH2, v=0
  336463.3938  0.0200 -3.0533 3  294.5069 99 -71510 30349 743      48 642        syn-C2H3C(O)NH2, v=0
  336473.4377  0.0016 -5.7459 3  478.7725 93  71510 303463115      453114        syn-C2H3C(O)NH2, v=0
  336473.4377  0.0016 -5.7459 3  478.7725 93  71510 303463116      453115        syn-C2H3C(O)NH2, v=0
  336475.3322  0.0559 -4.9983 3 1350.1270199  71510 303992377      992278        syn-C2H3C(O)NH2, v=0
  336638.7225  0.0556 -5.3034 3 1525.4135207  71510 303A33073      A32974        syn-C2H3C(O)NH2, v=0
  336640.8668  0.0200 -2.9580 3   83.5566 37 -71510 3031815 3      1714 4        syn-C2H3C(O)NH2, v=0
  336640.8668  0.0200 -2.9580 3   83.5566 37 -71510 3031815 4      1714 3        syn-C2H3C(O)NH2, v=0
  336671.1040  0.0015 -5.6933 3  464.4475 93  71510 303463016      453015        syn-C2H3C(O)NH2, v=0
  336671.1040  0.0015 -5.6933 3  464.4475 93  71510 303463017      453016        syn-C2H3C(O)NH2, v=0
  336681.7482  0.0010 -3.1382 3  103.3874 53  71510 303261116      251015        syn-C2H3C(O)NH2, v=0
  336712.9073  0.0200 -3.2513 3  280.9913 93 -71510 30346 937      451036        syn-C2H3C(O)NH2, v=0
  336730.1413  0.0200 -3.1381 3  103.3860 53 -71510 303261115      251016        syn-C2H3C(O)NH2, v=0
  336750.8378  0.0014 -4.3576 3   57.3107 43  71510 30321 715      20 416        syn-C2H3C(O)NH2, v=0
  336751.2444  0.0200 -3.6204 3  540.6935115 -71510 303572532      572433        syn-C2H3C(O)NH2, v=0
  336751.2444  0.0200 -3.6204 3  540.6935115 -71510 303572533      572434        syn-C2H3C(O)NH2, v=0
  336769.9161  0.0209 -4.5128 3 1072.6426179  71510 303891871      891772        syn-C2H3C(O)NH2, v=0
  336772.3133  0.0200 -3.1029 3  290.6834 97 -71510 30348 741      47 840        syn-C2H3C(O)NH2, v=0
  336776.3013  0.0010 -5.0955 3  290.6834 97  71510 30348 841      47 840        syn-C2H3C(O)NH2, v=0
  336779.6025  0.0010 -5.0954 3  290.6832 97  71510 30348 741      47 740        syn-C2H3C(O)NH2, v=0
  336783.5852  0.0200 -3.1029 3  290.6832 97 -71510 30348 841      47 740        syn-C2H3C(O)NH2, v=0
  336813.4586  0.0497 -5.5937 3 1288.6930189  71510 303942966      933063        syn-C2H3C(O)NH2, v=0
  336836.6545  0.0168 -4.7961 3  867.5223157  71510 303782256      772355        syn-C2H3C(O)NH2, v=0
  336841.0483  0.0208 -4.5126 3 1072.6429179  71510 303891971      891872        syn-C2H3C(O)NH2, v=0
  336872.4975  0.0498 -5.5936 3 1288.6928189  71510 303942965      933064        syn-C2H3C(O)NH2, v=0
  336884.7943  0.0069 -4.1488 3  843.5397161  71510 303801466      801367        syn-C2H3C(O)NH2, v=0
  336885.9684  0.0069 -4.1488 3  843.5397161  71510 303801566      801467        syn-C2H3C(O)NH2, v=0
  336886.4087  0.0014 -5.6433 3  450.5997 93  71510 303462917      452916        syn-C2H3C(O)NH2, v=0
  336886.4087  0.0014 -5.6433 3  450.5997 93  71510 303462918      452917        syn-C2H3C(O)NH2, v=0
  336943.2141  0.0440 -5.3502 3 1551.7124209  71510 303A43075      A42976        syn-C2H3C(O)NH2, v=0
  336945.7521  0.0200 -3.3989 3  187.0210 75 -71510 303371028      36 927        syn-C2H3C(O)NH2, v=0
  336971.7961  0.0300 -4.9954 3 1361.2573195  71510 303972968      972869        syn-C2H3C(O)NH2, v=0
  336975.1183  0.0784 -5.1565 3 1436.7022205  71510 303A22379      A22280        syn-C2H3C(O)NH2, v=0
  336986.8723  0.0058 -4.2654 3  576.4857129  71510 303641747      631846        syn-C2H3C(O)NH2, v=0
  337029.7626  0.0200 -2.9933 3   86.2281 41 -71510 3032014 6      1913 7        syn-C2H3C(O)NH2, v=0
  337029.7626  0.0200 -2.9933 3   86.2281 41 -71510 3032014 7      1913 6        syn-C2H3C(O)NH2, v=0
  337084.7103  0.0200 -3.9048 3  655.3796145 -71510 303721062      72 963        syn-C2H3C(O)NH2, v=0
  337084.7103  0.0200 -3.9048 3  655.3796145 -71510 303721162      721063        syn-C2H3C(O)NH2, v=0
  337122.1579  0.0013 -5.5958 3  437.2303 93  71510 303462818      452817        syn-C2H3C(O)NH2, v=0
  337122.1579  0.0013 -5.5958 3  437.2303 93  71510 303462819      452818        syn-C2H3C(O)NH2, v=0
  337164.8529  0.0025 -3.9944 3  793.7192145  71510 303722646      722547        syn-C2H3C(O)NH2, v=0
  337165.4578  0.0025 -3.9944 3  793.7191145  71510 303722647      722548        syn-C2H3C(O)NH2, v=0
  337244.5927  0.0010 -3.1640 3  286.2001 95  71510 30347 839      46 938        syn-C2H3C(O)NH2, v=0
  337263.8764  0.0358 -4.7444 3 1207.7332189  71510 303942074      941975        syn-C2H3C(O)NH2, v=0
  337285.4574  0.0142 -4.8376 3  887.3146159  71510 303792258      782355        syn-C2H3C(O)NH2, v=0
  337309.1778  0.0200 -3.0323 3   90.3957 45 -71510 303221310      2112 9        syn-C2H3C(O)NH2, v=0
  337309.1778  0.0200 -3.0323 3   90.3957 45 -71510 3032213 9      211210        syn-C2H3C(O)NH2, v=0
  337323.5423  0.0200 -3.0786 3   96.0944 49 -71510 303241213      231112        syn-C2H3C(O)NH2, v=0
  337323.5423  0.0200 -3.0786 3   96.0944 49 -71510 303241212      231113        syn-C2H3C(O)NH2, v=0
  337333.7961  0.0010 -5.0964 3  286.2001 95  71510 30347 939      46 938        syn-C2H3C(O)NH2, v=0
  337381.7290  0.0013 -5.5508 3  424.3407 93  71510 303462719      452718        syn-C2H3C(O)NH2, v=0
  337381.7290  0.0013 -5.5508 3  424.3407 93  71510 303462720      452719        syn-C2H3C(O)NH2, v=0
  337399.6119  0.0010 -5.0962 3  286.1950 95  71510 30347 839      46 838        syn-C2H3C(O)NH2, v=0
  337435.7769  0.0035 -4.6176 3  187.0210 73  71510 303361224      36 927        syn-C2H3C(O)NH2, v=0
  337456.0562  0.0200 -3.6019 3  526.6163113 -71510 303562531      562432        syn-C2H3C(O)NH2, v=0
  337456.0562  0.0200 -3.6019 3  526.6163113 -71510 303562532      562433        syn-C2H3C(O)NH2, v=0
  337488.8101  0.0200 -3.1634 3  286.1950 95 -71510 30347 939      46 838        syn-C2H3C(O)NH2, v=0
  337493.9948  0.0054 -4.0785 3  794.6611157  71510 303781365      781266        syn-C2H3C(O)NH2, v=0
  337494.3188  0.0054 -4.0785 3  794.6611157  71510 303781465      781366        syn-C2H3C(O)NH2, v=0
  337533.5887  0.0070 -4.3398 3  998.6415165  71510 303822755      822656        syn-C2H3C(O)NH2, v=0
  337563.8026  0.0070 -4.3397 3  998.6404165  71510 303822756      822657        syn-C2H3C(O)NH2, v=0
  337565.4373  0.0036 -3.9560 3  700.5724149  71510 303741163      741064        syn-C2H3C(O)NH2, v=0
  337565.4578  0.0036 -3.9560 3  700.5724149  71510 303741263      741164        syn-C2H3C(O)NH2, v=0
  337603.3997  0.0351 -4.7435 3 1207.7349189  71510 303942174      942075        syn-C2H3C(O)NH2, v=0
  337669.2237  0.0012 -5.5079 3  411.9322 93  71510 303462620      452619        syn-C2H3C(O)NH2, v=0
  337669.2237  0.0012 -5.5079 3  411.9322 93  71510 303462621      452620        syn-C2H3C(O)NH2, v=0
  337673.8501  0.1131 -6.3899 3 2095.1452245  71510 303C23291      C23192        syn-C2H3C(O)NH2, v=0
  337710.4951  0.0043 -4.0140 3  747.0024153  71510 303761264      761165        syn-C2H3C(O)NH2, v=0
  337710.5793  0.0043 -4.0140 3  747.0024153  71510 303761364      761265        syn-C2H3C(O)NH2, v=0
  337718.3536  0.0151 -4.6687 3 1183.8206181  71510 303902862      902763        syn-C2H3C(O)NH2, v=0
  337780.5838  0.0027 -4.2018 3   59.8241 45  71510 30322 617      21 318        syn-C2H3C(O)NH2, v=0
  337805.6705  0.0030 -4.3045 3  297.5305 93  71510 303461333      461036        syn-C2H3C(O)NH2, v=0
  337807.1929  0.0027 -3.6639 3  344.7013101  71510 303501238      491337        syn-C2H3C(O)NH2, v=0
  337812.7404  0.1628 -6.1130 3 1949.7845237  71510 303B83089      B82990        syn-C2H3C(O)NH2, v=0
  337869.1849  0.0238 -5.0152 3  988.0480167  71510 303832459      822558        syn-C2H3C(O)NH2, v=0
  337888.9206  0.0679 -6.0917 3 1941.8427235  71510 303B73286      B73187        syn-C2H3C(O)NH2, v=0
  337906.4712  0.0037 -3.8901 3  399.3637121  71510 30360 357      60 258        syn-C2H3C(O)NH2, v=0
  337906.4712  0.0037 -3.8901 3  399.3637121  71510 30360 457      60 358        syn-C2H3C(O)NH2, v=0
  337908.1878  0.0023 -6.2073 3  297.0228 87  71510 303431826      441529        syn-C2H3C(O)NH2, v=0
  337943.2077  0.1221 -5.6109 3 1684.1302221  71510 303B02784      B02685        syn-C2H3C(O)NH2, v=0
  337964.8304  0.0010 -5.0947 3  275.0832 91  71510 303451135      441134        syn-C2H3C(O)NH2, v=0
  337979.1809  0.0010 -5.1613 3  297.0187 91  71510 303451531      441530        syn-C2H3C(O)NH2, v=0
  337989.6726  0.0012 -5.4671 3  400.0068 93  71510 303462521      452520        syn-C2H3C(O)NH2, v=0
  337989.6726  0.0012 -5.4671 3  400.0068 93  71510 303462522      452521        syn-C2H3C(O)NH2, v=0
  338026.6583  0.0148 -4.6679 3 1183.8087181  71510 303902863      902764        syn-C2H3C(O)NH2, v=0
  338030.5187  0.0023 -6.2070 3  297.0187 87  71510 303431825      441530        syn-C2H3C(O)NH2, v=0
  338037.1564  0.1746 -5.6687 3 1711.8662223  71510 303B12685      B12586        syn-C2H3C(O)NH2, v=0
  338086.1366  0.0010 -5.1610 3  297.0228 91  71510 303451530      441529        syn-C2H3C(O)NH2, v=0
  338118.1386  0.0010 -5.0950 3  280.9913 93  71510 303461037      451036        syn-C2H3C(O)NH2, v=0
  338121.0339  0.0200 -3.5844 3  512.7954111 -71510 303552530      552431        syn-C2H3C(O)NH2, v=0
  338121.0339  0.0200 -3.5844 3  512.7954111 -71510 303552531      552432        syn-C2H3C(O)NH2, v=0
  338124.9731  0.0020 -4.9837 3  105.2881 55  71510 303271018      27 721        syn-C2H3C(O)NH2, v=0
  338213.5774  0.1024 -5.3190 3 1525.8603211  71510 303A52481      A52382        syn-C2H3C(O)NH2, v=0
  338227.5256  0.0436 -5.4752 3 1229.8601185  71510 303922865      912962        syn-C2H3C(O)NH2, v=0
  338293.7014  0.0200 -3.8025 3  501.3746131 -71510 30365 659      65 560        syn-C2H3C(O)NH2, v=0
  338293.7014  0.0200 -3.8025 3  501.3746131 -71510 30365 759      65 660        syn-C2H3C(O)NH2, v=0
  338304.0211  0.0021 -5.0531 3   98.5609 53  71510 303261017      26 720        syn-C2H3C(O)NH2, v=0
  338349.3173  0.0012 -5.4284 3  388.5666 93  71510 303462422      452421        syn-C2H3C(O)NH2, v=0
  338349.3173  0.0012 -5.4284 3  388.5666 93  71510 303462423      452422        syn-C2H3C(O)NH2, v=0
  338379.5060  0.0439 -5.4748 3 1229.8598185  71510 303922864      912963        syn-C2H3C(O)NH2, v=0
  338461.9832  0.0606 -5.6791 3 1727.0118221  71510 303B03180      B03081        syn-C2H3C(O)NH2, v=0
  338482.9541  0.0266 -4.9916 3 1361.1977195  71510 303972969      972870        syn-C2H3C(O)NH2, v=0
  338523.5680  0.0056 -4.2394 3  339.8188115  71510 30357 156      57 057        syn-C2H3C(O)NH2, v=0
  338523.5680  0.0056 -4.2394 3  339.8188115  71510 30357 256      57 157        syn-C2H3C(O)NH2, v=0
  338538.1284  0.0200 -3.2386 3  119.5077 59 -71510 303291020      28 919        syn-C2H3C(O)NH2, v=0
  338576.6059  0.0200 -3.9631 3  775.7682143 -71510 303712645      712546        syn-C2H3C(O)NH2, v=0
  338576.6059  0.0200 -3.9631 3  775.7682143 -71510 303712646      712547        syn-C2H3C(O)NH2, v=0
  338607.6386  0.0032 -6.2240 3  484.6734113  71510 303562136      571839        syn-C2H3C(O)NH2, v=0
  338625.7357  0.1336 -5.4897 3 1617.5846217  71510 303A82583      A82484        syn-C2H3C(O)NH2, v=0
  338665.4343  0.0069 -4.3684 3  633.3110135  71510 303671849      661948        syn-C2H3C(O)NH2, v=0
  338748.2222  0.0200 -3.5679 3  499.2302109 -71510 303542529      542430        syn-C2H3C(O)NH2, v=0
  338748.2222  0.0200 -3.5679 3  499.2302109 -71510 303542530      542431        syn-C2H3C(O)NH2, v=0
  338756.0039  0.0011 -5.3915 3  377.6145 93  71510 303462323      452322        syn-C2H3C(O)NH2, v=0
  338756.0039  0.0011 -5.3915 3  377.6145 93  71510 303462324      452323        syn-C2H3C(O)NH2, v=0
  338996.2629  0.0010 -5.0925 3  280.9151 93  71510 30346 937      45 936        syn-C2H3C(O)NH2, v=0
  339031.5394  0.0020 -4.9233 3  112.2423 57  71510 303281019      28 722        syn-C2H3C(O)NH2, v=0
  339044.1748  0.0032 -6.2230 3  484.6588113  71510 303562135      571840        syn-C2H3C(O)NH2, v=0
  339199.9900  0.0027 -5.4182 3   74.2485 45  71510 303221012      22 715        syn-C2H3C(O)NH2, v=0
  339215.0815  0.2246 -6.1771 3 1983.9385237  71510 303B83385      B83286        syn-C2H3C(O)NH2, v=0
  339219.7496  0.0011 -5.3564 3  367.1537 93  71510 303462224      452223        syn-C2H3C(O)NH2, v=0
  339219.7496  0.0011 -5.3564 3  367.1537 93  71510 303462225      452224        syn-C2H3C(O)NH2, v=0
  339225.2897  0.0707 -5.1509 3 1436.7163205  71510 303A22479      A22380        syn-C2H3C(O)NH2, v=0
  339246.6500  0.0163 -4.4197 3 1018.3600175  71510 303871770      871671        syn-C2H3C(O)NH2, v=0
  339270.5368  0.0163 -4.4196 3 1018.3601175  71510 303871870      871771        syn-C2H3C(O)NH2, v=0
  339320.8976  0.0889 -5.5750 3 1671.4532217  71510 303A83177      A83078        syn-C2H3C(O)NH2, v=0
  339332.7900  0.0021 -5.1309 3   92.0671 51  71510 303251016      25 719        syn-C2H3C(O)NH2, v=0
  339339.4652  0.0200 -3.5524 3  485.9201107 -71510 303532528      532429        syn-C2H3C(O)NH2, v=0
  339339.4652  0.0200 -3.5524 3  485.9201107 -71510 303532529      532430        syn-C2H3C(O)NH2, v=0
  339361.1513  0.0012 -5.0734 3  263.0918 89  71510 303441034      431033        syn-C2H3C(O)NH2, v=0
  339412.4972  0.0010 -5.0646 3  254.9887 87  71510 303431132      421131        syn-C2H3C(O)NH2, v=0
  339644.5408  0.0064 -4.3003 3  978.0605163  71510 303812754      812655        syn-C2H3C(O)NH2, v=0
  339647.5209  0.0055 -5.5326 3   77.5535 51  71510 30325 620      25 323        syn-C2H3C(O)NH2, v=0
  339661.4757  0.0064 -4.3002 3  978.0599163  71510 303812755      812656        syn-C2H3C(O)NH2, v=0
  339753.5826  0.0011 -5.3230 3  357.1886 93  71510 303462125      452124        syn-C2H3C(O)NH2, v=0
  339753.5826  0.0011 -5.3230 3  357.1886 93  71510 303462126      452125        syn-C2H3C(O)NH2, v=0
  339808.3019  0.0026 -4.4132 3  251.9405 85  71510 303421329      421032        syn-C2H3C(O)NH2, v=0
  339847.6795  0.0010 -5.1366 3  290.7873 91  71510 303451432      441431        syn-C2H3C(O)NH2, v=0
  339896.4684  0.0200 -3.5379 3  472.8647105 -71510 303522527      522428        syn-C2H3C(O)NH2, v=0
  339896.4684  0.0200 -3.5379 3  472.8647105 -71510 303522528      522429        syn-C2H3C(O)NH2, v=0
  339907.3991  0.0381 -5.3597 3 1172.4706181  71510 303902764      892861        syn-C2H3C(O)NH2, v=0
  339912.2060  0.0200 -3.9327 3  758.0823141 -71510 303702644      702545        syn-C2H3C(O)NH2, v=0
  339912.2060  0.0200 -3.9327 3  758.0822141 -71510 303702645      702546        syn-C2H3C(O)NH2, v=0
  339955.6581  0.0200 -3.8166 3  542.1471135 -71510 30367 760      67 661        syn-C2H3C(O)NH2, v=0
  339955.6581  0.0200 -3.8166 3  542.1471135 -71510 30367 860      67 761        syn-C2H3C(O)NH2, v=0
  339995.9969  0.0043 -4.3849 3  269.7915 89  71510 303441232      44 935        syn-C2H3C(O)NH2, v=0
  340015.3814  0.1434 -5.7879 3 1780.1631227  71510 303B32886      B32787        syn-C2H3C(O)NH2, v=0
  340097.8646  0.0047 -3.9852 3   79.5125 51  71510 30325 619      24 520        syn-C2H3C(O)NH2, v=0
  340290.1121  0.0386 -5.3587 3 1172.4697181  71510 303902763      892862        syn-C2H3C(O)NH2, v=0
  340294.0190  0.0200 -3.8381 3  436.8933125 -71510 30362 458      62 359        syn-C2H3C(O)NH2, v=0
  340294.0190  0.0200 -3.8381 3  436.8933125 -71510 30362 558      62 459        syn-C2H3C(O)NH2, v=0
  340304.5643  0.1419 -5.8660 3 1824.2895227  71510 303B33281      B33182        syn-C2H3C(O)NH2, v=0
  340317.7374  0.0067 -4.8879 3  145.6011 67  71510 30333 825      33 528        syn-C2H3C(O)NH2, v=0
  340374.8334  0.0011 -5.2912 3  347.7246 93  71510 303462027      452026        syn-C2H3C(O)NH2, v=0
  340374.8340  0.0011 -5.2912 3  347.7246 93  71510 303462026      452025        syn-C2H3C(O)NH2, v=0
  340401.5148  0.0200 -3.2412 3  280.9151 93 -71510 303461037      45 936        syn-C2H3C(O)NH2, v=0
  340420.9474  0.0200 -3.5244 3  460.0634103 -71510 303512526      512427        syn-C2H3C(O)NH2, v=0
  340420.9474  0.0200 -3.5244 3  460.0634103 -71510 303512527      512428        syn-C2H3C(O)NH2, v=0
  340541.4566  0.0472 -4.8849 3 1289.9685195  71510 303972176      972077        syn-C2H3C(O)NH2, v=0
  340555.7085  0.0727 -6.0288 3 1911.9306233  71510 303B63285      B63186        syn-C2H3C(O)NH2, v=0
  340611.6379  0.0136 -4.6222 3 1161.1090179  71510 303892861      892762        syn-C2H3C(O)NH2, v=0
  340651.4846  0.0010 -5.1346 3  290.8234 91  71510 303451431      441430        syn-C2H3C(O)NH2, v=0
  340732.4652  0.0414 -5.2930 3 1525.2487207  71510 303A33074      A32975        syn-C2H3C(O)NH2, v=0
  340787.7143  0.0018 -5.4635 3   29.5856 31  71510 30315 7 8      14 411        syn-C2H3C(O)NH2, v=0
  340794.8623  0.0134 -4.6218 3 1161.1020179  71510 303892862      892763        syn-C2H3C(O)NH2, v=0
  340896.4292  0.0090 -4.4715 3  692.8012141  71510 303701951      692050        syn-C2H3C(O)NH2, v=0
  340905.2948  0.0263 -4.9421 3 1336.6561193  71510 303962967      962868        syn-C2H3C(O)NH2, v=0
  340914.4570  0.0200 -3.5121 3  447.5158101 -71510 303502525      502426        syn-C2H3C(O)NH2, v=0
  340914.4570  0.0200 -3.5121 3  447.5158101 -71510 303502526      502427        syn-C2H3C(O)NH2, v=0
  340965.9963  0.0283 -4.6398 3 1150.4954185  71510 303921973      921874        syn-C2H3C(O)NH2, v=0
  340975.6544  0.0022 -5.2166 3   85.8130 49  71510 303241015      24 718        syn-C2H3C(O)NH2, v=0
  341012.0779  0.0200 -3.5019 3  314.8990 97 -71510 303481137      471236        syn-C2H3C(O)NH2, v=0
  341038.6541  0.0029 -3.3915 3  177.5560 73  71510 303361027      35 926        syn-C2H3C(O)NH2, v=0
  341089.5342  0.0280 -4.6395 3 1150.4959185  71510 303922073      921974        syn-C2H3C(O)NH2, v=0
  341103.0704  0.0458 -4.8835 3 1289.9715195  71510 303972276      972177        syn-C2H3C(O)NH2, v=0
  341107.2149  0.0011 -5.2609 3  338.7690 93  71510 303461928      451927        syn-C2H3C(O)NH2, v=0
  341107.2248  0.0011 -5.2609 3  338.7690 93  71510 303461927      451926        syn-C2H3C(O)NH2, v=0
  341136.5686  0.0127 -4.3319 3  965.2596171  71510 303851669      851570        syn-C2H3C(O)NH2, v=0
  341144.1962  0.0127 -4.3319 3  965.2596171  71510 303851769      851670        syn-C2H3C(O)NH2, v=0
  341168.3270  0.1736 -6.3036 3 2052.6375243  71510 303C13191      C13092        syn-C2H3C(O)NH2, v=0
  341176.4287  0.0200 -3.9032 3  740.6605139 -71510 303692643      692544        syn-C2H3C(O)NH2, v=0
  341176.4287  0.0200 -3.9032 3  740.6605139 -71510 303692644      692545        syn-C2H3C(O)NH2, v=0
  341244.9277  0.0021 -4.8725 3  119.4174 59  71510 303291020      29 723        syn-C2H3C(O)NH2, v=0
  341299.4661  0.0010 -5.0995 3  280.0339 91  71510 303451234      441233        syn-C2H3C(O)NH2, v=0
  341341.2906  0.0047 -4.0065 3  375.3528119  71510 30359 257      59 158        syn-C2H3C(O)NH2, v=0
  341341.2906  0.0047 -4.0065 3  375.3528119  71510 30359 357      59 258        syn-C2H3C(O)NH2, v=0
  341358.4532  0.0200 -3.8428 3  584.1880139 -71510 30369 861      69 762        syn-C2H3C(O)NH2, v=0
  341358.4532  0.0200 -3.8428 3  584.1880139 -71510 30369 961      69 862        syn-C2H3C(O)NH2, v=0
  341378.4730  0.0200 -3.5009 3  435.2214 99 -71510 303492524      492425        syn-C2H3C(O)NH2, v=0
  341378.4730  0.0200 -3.5009 3  435.2214 99 -71510 303492525      492426        syn-C2H3C(O)NH2, v=0
  341473.8612  0.0010 -5.1146 3  285.1624 91  71510 303451333      441332        syn-C2H3C(O)NH2, v=0
  341633.2793  0.0058 -4.2617 3  957.7525161  71510 303802753      802654        syn-C2H3C(O)NH2, v=0
  341642.6536  0.0058 -4.2617 3  957.7521161  71510 303802754      802655        syn-C2H3C(O)NH2, v=0
  341703.8567  0.0882 -5.3105 3 1525.8835211  71510 303A52581      A52482        syn-C2H3C(O)NH2, v=0
  341713.5217  0.0036 -6.2767 3  552.3633121  71510 303602239      611942        syn-C2H3C(O)NH2, v=0
  341814.4064  0.0200 -3.4908 3  423.1797 97 -71510 303482523      482424        syn-C2H3C(O)NH2, v=0
  341814.4064  0.0200 -3.4908 3  423.1797 97 -71510 303482524      482425        syn-C2H3C(O)NH2, v=0
  341826.8435  0.0471 -5.2433 3 1499.1777205  71510 303A23072      A22973        syn-C2H3C(O)NH2, v=0
  341845.4152  0.0244 -4.9397 3 1336.6193193  71510 303962968      962869        syn-C2H3C(O)NH2, v=0
  341850.5013  0.0330 -5.2473 3 1116.5283177  71510 303882663      872760        syn-C2H3C(O)NH2, v=0
  341984.3337  0.0010 -5.2321 3  330.3315 93  71510 303461829      451828        syn-C2H3C(O)NH2, v=0
  341984.4848  0.0010 -5.2321 3  330.3315 93  71510 303461828      451827        syn-C2H3C(O)NH2, v=0
  342169.5838  0.1648 -5.9707 3 1878.7492233  71510 303B62988      B62889        syn-C2H3C(O)NH2, v=0
  342209.0471  0.0013 -5.0666 3  315.2239109  71510 30354 252      53 251        syn-C2H3C(O)NH2, v=0
  342209.0383  0.0200 -2.9056 3  315.2239109 -71510 30354 252      53 351        syn-C2H3C(O)NH2, v=0
  342209.0383  0.0200 -2.9056 3  315.2239109 -71510 30354 352      53 251        syn-C2H3C(O)NH2, v=0
  342209.0471  0.0013 -5.0666 3  315.2239109  71510 30354 352      53 351        syn-C2H3C(O)NH2, v=0
  342213.6337  0.0015 -5.0577 3  316.2605111  71510 30355 154      54 153        syn-C2H3C(O)NH2, v=0
  342213.6106  0.0200 -2.8761 3  316.2605111 -71510 30355 154      54 253        syn-C2H3C(O)NH2, v=0
  342213.6106  0.0200 -2.8761 3  316.2605111 -71510 30355 254      54 153        syn-C2H3C(O)NH2, v=0
  342213.6337  0.0015 -5.0577 3  316.2605111  71510 30355 254      54 253        syn-C2H3C(O)NH2, v=0
  342218.0700  0.0012 -5.0745 3  313.6672107  71510 30353 350      52 349        syn-C2H3C(O)NH2, v=0
  342218.0588  0.0200 -2.9367 3  313.6672107 -71510 30353 350      52 449        syn-C2H3C(O)NH2, v=0
  342218.0588  0.0200 -2.9367 3  313.6672107 -71510 30353 450      52 349        syn-C2H3C(O)NH2, v=0
  342218.0700  0.0012 -5.0745 3  313.6672107  71510 30353 450      52 449        syn-C2H3C(O)NH2, v=0
  342223.6552  0.0013 -3.4820 3  411.3903 95  71510 303472522      472423        syn-C2H3C(O)NH2, v=0
  342223.6552  0.0013 -3.4820 3  411.3903 95  71510 303472523      472424        syn-C2H3C(O)NH2, v=0
  342223.8443  0.0017 -5.0479 3  316.7863113  71510 30356 056      55 055        syn-C2H3C(O)NH2, v=0
  342223.8443  0.0017 -2.8480 3  316.7863113  71510 30356 056      55 155        syn-C2H3C(O)NH2, v=0
  342223.8443  0.0017 -2.8480 3  316.7863113  71510 30356 156      55 055        syn-C2H3C(O)NH2, v=0
  342223.8443  0.0017 -5.0479 3  316.7863113  71510 30356 156      55 155        syn-C2H3C(O)NH2, v=0
  342227.6877  0.0594 -5.6183 3 1698.9516219  71510 303A93179      A93080        syn-C2H3C(O)NH2, v=0
  342237.4278  0.0035 -6.2755 3  552.3458121  71510 303602238      611943        syn-C2H3C(O)NH2, v=0
  342252.9186  0.0011 -5.0814 3  311.5779105  71510 30352 448      51 447        syn-C2H3C(O)NH2, v=0
  342252.9087  0.0200 -2.9702 3  311.5779105 -71510 30352 448      51 547        syn-C2H3C(O)NH2, v=0
  342252.9087  0.0200 -2.9702 3  311.5779105 -71510 30352 548      51 447        syn-C2H3C(O)NH2, v=0
  342252.9186  0.0011 -5.0814 3  311.5779105  71510 30352 548      51 547        syn-C2H3C(O)NH2, v=0
  342308.6851  0.0035 -4.8811 3  122.8095 61  71510 30330 922      30 625        syn-C2H3C(O)NH2, v=0
  342332.8920  0.0200 -3.0067 3  308.9397103 -71510 30351 546      50 645        syn-C2H3C(O)NH2, v=0
  342332.8925  0.0010 -5.0871 3  308.9397103  71510 30351 646      50 645        syn-C2H3C(O)NH2, v=0
  342332.8941  0.0010 -5.0871 3  308.9397103  71510 30351 546      50 545        syn-C2H3C(O)NH2, v=0
  342332.8920  0.0200 -3.0067 3  308.9397103 -71510 30351 646      50 545        syn-C2H3C(O)NH2, v=0
  342373.4855  0.0200 -3.8745 3  723.5020137 -71510 303682642      682543        syn-C2H3C(O)NH2, v=0
  342373.4855  0.0200 -3.8745 3  723.5020137 -71510 303682643      682544        syn-C2H3C(O)NH2, v=0
  342454.4363  0.1870 -6.0992 3 1335.4387197  71510 303982475      972572        syn-C2H3C(O)NH2, v=0
  342457.0159  0.0200 -3.8172 3  475.7126129 -71510 30364 559      64 460        syn-C2H3C(O)NH2, v=0
  342457.0159  0.0200 -3.8172 3  475.7126129 -71510 30364 659      64 560        syn-C2H3C(O)NH2, v=0
  342489.0986  0.0028 -3.8790 3  627.4899143  71510 30371 962      71 863        syn-C2H3C(O)NH2, v=0
  342489.0992  0.0028 -3.8790 3  627.4899143  71510 303711062      71 963        syn-C2H3C(O)NH2, v=0
  342489.9335  0.0200 -3.0476 3  305.7302101 -71510 30350 644      49 743        syn-C2H3C(O)NH2, v=0
  342489.8858  0.0010 -5.0915 3  305.7302101  71510 30350 744      49 743        syn-C2H3C(O)NH2, v=0
  342489.9482  0.0010 -5.0915 3  305.7301101  71510 30350 644      49 643        syn-C2H3C(O)NH2, v=0
  342489.9335  0.0200 -3.0476 3  305.7301101 -71510 30350 744      49 643        syn-C2H3C(O)NH2, v=0
  342515.6685  0.0098 -4.2494 3  913.3524167  71510 303831568      831469        syn-C2H3C(O)NH2, v=0
  342517.9814  0.0098 -4.2494 3  913.3524167  71510 303831668      831569        syn-C2H3C(O)NH2, v=0
  342538.8252  0.0037 -6.3542 3  640.2327 95  71510 3034740 7      4640 6        syn-C2H3C(O)NH2, v=0
  342538.8252  0.0037 -6.3542 3  640.2327 95  71510 3034740 8      4640 7        syn-C2H3C(O)NH2, v=0
  342607.4725  0.0200 -3.4744 3  399.8527 93 -71510 303462521      462422        syn-C2H3C(O)NH2, v=0
  342607.4725  0.0200 -3.4744 3  399.8527 93 -71510 303462522      462423        syn-C2H3C(O)NH2, v=0
  342633.3151  0.0010 -3.2310 3  119.3954 59  71510 303291019      28 920        syn-C2H3C(O)NH2, v=0
  342656.6089  0.0033 -6.2623 3  621.6474 95  71510 3034739 8      4639 7        syn-C2H3C(O)NH2, v=0
  342656.6089  0.0033 -6.2623 3  621.6474 95  71510 3034739 9      4639 8        syn-C2H3C(O)NH2, v=0
  342665.4108  0.3720 -6.2895 3 2040.4928243  71510 303C12992      C12893        syn-C2H3C(O)NH2, v=0
  342700.4471  0.0976 -6.2514 3 1630.3163211  71510 303A53472      A43569        syn-C2H3C(O)NH2, v=0
  342701.1867  0.0976 -6.2514 3 1630.3163211  71510 303A53471      A43570        syn-C2H3C(O)NH2, v=0
  342777.3977  0.0200 -3.0950 3  301.9171 99 -71510 30349 742      48 841        syn-C2H3C(O)NH2, v=0
  342779.5889  0.0010 -5.0944 3  301.9171 99  71510 30349 842      48 841        syn-C2H3C(O)NH2, v=0
  342780.2655  0.0029 -6.1781 3  603.5340 95  71510 3034738 9      4638 8        syn-C2H3C(O)NH2, v=0
  342780.2655  0.0029 -6.1781 3  603.5340 95  71510 303473810      4638 9        syn-C2H3C(O)NH2, v=0
  342781.4102  0.0010 -5.0944 3  301.9169 99  71510 30349 742      48 741        syn-C2H3C(O)NH2, v=0
  342783.5835  0.0010 -3.0950 3  301.9169 99  71510 30349 842      48 741        syn-C2H3C(O)NH2, v=0
  342790.4017  0.0341 -5.2448 3 1116.5259177  71510 303882662      872761        syn-C2H3C(O)NH2, v=0
  342817.5748  0.0051 -5.2530 3   93.8530 55  71510 30327 721      27 424        syn-C2H3C(O)NH2, v=0
  342910.5452  0.0026 -6.1005 3  585.8930 95  71510 303473710      4637 9        syn-C2H3C(O)NH2, v=0
  342910.5452  0.0026 -6.1005 3  585.8930 95  71510 303473711      463710        syn-C2H3C(O)NH2, v=0
  342967.1000  0.0200 -3.4682 3  388.5666 91 -71510 303452520      452421        syn-C2H3C(O)NH2, v=0
  342967.1000  0.0200 -3.4682 3  388.5666 91 -71510 303452521      452422        syn-C2H3C(O)NH2, v=0
  342987.6628  0.0200 -3.2526 3  126.8735 61 -71510 303301021      29 920        syn-C2H3C(O)NH2, v=0
  343011.3427  0.0023 -5.3098 3   79.8045 47  71510 303231014      23 717        syn-C2H3C(O)NH2, v=0
  343011.5515  0.0025 -6.1882 3  350.3417 95  71510 303471929      481632        syn-C2H3C(O)NH2, v=0
  343037.9577  0.0023 -6.2892 3  238.1654 77  71510 303381722      391425        syn-C2H3C(O)NH2, v=0
  343048.3063  0.0024 -6.0282 3  568.7249 95  71510 303473611      463610        syn-C2H3C(O)NH2, v=0
  343048.3063  0.0024 -6.0282 3  568.7249 95  71510 303473612      463611        syn-C2H3C(O)NH2, v=0
  343055.6467  0.0010 -5.2045 3  322.4254 93  71510 303461730      451729        syn-C2H3C(O)NH2, v=0
  343057.6127  0.0010 -5.2045 3  322.4254 93  71510 303461729      451728        syn-C2H3C(O)NH2, v=0
  343084.9112  0.0023 -6.2891 3  238.1639 77  71510 303381721      391426        syn-C2H3C(O)NH2, v=0
  343169.1820  0.0025 -6.1878 3  350.3364 95  71510 303471928      481633        syn-C2H3C(O)NH2, v=0
  343194.5353  0.0021 -5.9605 3  552.0300 95  71510 303473512      463511        syn-C2H3C(O)NH2, v=0
  343194.5353  0.0021 -5.9605 3  552.0300 95  71510 303473513      463512        syn-C2H3C(O)NH2, v=0
  343236.7256  0.0200 -3.2314 3  292.2697 95 -71510 30347 938      461037        syn-C2H3C(O)NH2, v=0
  343246.1535  0.0200 -3.1526 3  297.4524 97 -71510 30348 840      47 939        syn-C2H3C(O)NH2, v=0
  343297.0031  0.0010 -5.0953 3  297.4524 97  71510 30348 940      47 939        syn-C2H3C(O)NH2, v=0
  343303.7590  0.0123 -4.5770 3 1138.6791177  71510 303882860      882761        syn-C2H3C(O)NH2, v=0
  343303.7703  0.0200 -3.4634 3  377.5315 89 -71510 303442519      442420        syn-C2H3C(O)NH2, v=0
  343303.7703  0.0200 -3.4634 3  377.5315 89 -71510 303442520      442421        syn-C2H3C(O)NH2, v=0
  343316.7723  0.0872 -6.1173 3 1563.8350207  71510 303A33371      A23468        syn-C2H3C(O)NH2, v=0
  343318.8166  0.0872 -6.1173 3 1563.8350207  71510 303A33370      A23469        syn-C2H3C(O)NH2, v=0
  343332.5939  0.0200 -3.9238 3  672.0455147 -71510 303731063      73 964        syn-C2H3C(O)NH2, v=0
  343332.5939  0.0200 -3.9238 3  672.0455147 -71510 303731163      731064        syn-C2H3C(O)NH2, v=0
  343335.3313  0.0010 -5.0952 3  297.4494 97  71510 30348 840      47 839        syn-C2H3C(O)NH2, v=0
  343350.3703  0.0019 -5.8969 3  535.8091 95  71510 303473413      463412        syn-C2H3C(O)NH2, v=0
  343350.3703  0.0019 -5.8969 3  535.8091 95  71510 303473414      463413        syn-C2H3C(O)NH2, v=0
  343381.2980  0.0616 -5.0330 3 1374.7951201  71510 303A02278      A02179        syn-C2H3C(O)NH2, v=0
  343386.1974  0.0200 -3.1522 3  297.4494 97 -71510 30348 940      47 839        syn-C2H3C(O)NH2, v=0
  343411.3025  0.0122 -4.5767 3 1138.6750177  71510 303882861      882762        syn-C2H3C(O)NH2, v=0
  343439.5940  0.0077 -4.1723 3  862.6483163  71510 303811467      811368        syn-C2H3C(O)NH2, v=0
  343440.2586  0.0077 -4.1723 3  862.6483163  71510 303811567      811468        syn-C2H3C(O)NH2, v=0
  343491.9748  0.0035 -5.0957 3   40.3060 41  71510 30320 218      19 119        syn-C2H3C(O)NH2, v=0
  343502.8050  0.0200 -2.9154 3   86.2568 35 -71510 3031716 1      1615 2        syn-C2H3C(O)NH2, v=0
  343502.8050  0.0200 -2.9154 3   86.2568 35 -71510 3031716 2      1615 1        syn-C2H3C(O)NH2, v=0
  343507.1078  0.0200 -3.8467 3  706.6060135 -71510 303672641      672542        syn-C2H3C(O)NH2, v=0
  343507.1078  0.0200 -3.8467 3  706.6060135 -71510 303672642      672543        syn-C2H3C(O)NH2, v=0
  343509.9448  0.0052 -4.2241 3  937.7159159  71510 303792752      792653        syn-C2H3C(O)NH2, v=0
  343512.9578  0.0200 -3.1367 3  109.8486 55 -71510 303271117      261016        syn-C2H3C(O)NH2, v=0
  343515.0694  0.0052 -4.2241 3  937.7157159  71510 303792753      792654        syn-C2H3C(O)NH2, v=0
  343517.1310  0.0018 -5.8369 3  520.0626 95  71510 303473314      463313        syn-C2H3C(O)NH2, v=0
  343517.1310  0.0018 -5.8369 3  520.0626 95  71510 303473315      463314        syn-C2H3C(O)NH2, v=0
  343600.8082  0.0035 -5.0955 3   40.3060 41  71510 30320 318      19 019        syn-C2H3C(O)NH2, v=0
  343618.2265  0.0010 -3.1364 3  109.8455 55  71510 303271116      261017        syn-C2H3C(O)NH2, v=0
  343618.5426  0.0012 -3.4601 3  366.7471 87  71510 303432518      432419        syn-C2H3C(O)NH2, v=0
  343618.5426  0.0012 -3.4601 3  366.7471 87  71510 303432519      432420        syn-C2H3C(O)NH2, v=0
  343696.3557  0.0016 -5.7801 3  504.7914 95  71510 303473215      463214        syn-C2H3C(O)NH2, v=0
  343696.3557  0.0016 -5.7801 3  504.7914 95  71510 303473216      463215        syn-C2H3C(O)NH2, v=0
  343765.6879  0.0757 -5.9656 3 1882.2882231  71510 303B53284      B53185        syn-C2H3C(O)NH2, v=0
  343771.0371  0.0217 -4.9059 3  936.9258163  71510 303812358      802457        syn-C2H3C(O)NH2, v=0
  343782.2546  0.0011 -5.0800 3  269.6652 89  71510 303441232      431231        syn-C2H3C(O)NH2, v=0
  343799.3435  0.0044 -3.7936 3   95.2521 55  71510 30327 720      26 621        syn-C2H3C(O)NH2, v=0
  343807.8939  0.0118 -4.7940 3  858.8087157  71510 303782158      772255        syn-C2H3C(O)NH2, v=0
  343871.7125  0.0040 -3.9762 3  717.8472151  71510 303751164      751065        syn-C2H3C(O)NH2, v=0
  343871.7236  0.0040 -3.9762 3  717.8472151  71510 303751264      751165        syn-C2H3C(O)NH2, v=0
  343886.4974  0.0223 -4.5407 3 1094.4184181  71510 303901872      901773        syn-C2H3C(O)NH2, v=0
  343889.8466  0.0015 -5.7263 3  489.9961 95  71510 303473116      463115        syn-C2H3C(O)NH2, v=0
  343889.8466  0.0015 -5.7263 3  489.9961 95  71510 303473117      463116        syn-C2H3C(O)NH2, v=0
  343912.5181  0.0200 -3.4585 3  356.2129 85 -71510 303422517      422418        syn-C2H3C(O)NH2, v=0
  343912.5181  0.0200 -3.4585 3  356.2129 85 -71510 303422518      422419        syn-C2H3C(O)NH2, v=0
  343923.2802  0.0200 -2.9490 3   87.9475 39 -71510 3031915 4      1814 5        syn-C2H3C(O)NH2, v=0
  343923.2802  0.0200 -2.9490 3   87.9475 39 -71510 3031915 5      1814 4        syn-C2H3C(O)NH2, v=0
  343929.3100  0.0223 -4.5406 3 1094.4186181  71510 303901972      901873        syn-C2H3C(O)NH2, v=0
  343946.1073  0.1082 -5.4767 3 1617.6223217  71510 303A82683      A82584        syn-C2H3C(O)NH2, v=0
  343951.4639  0.0060 -4.1009 3  813.1569159  71510 303791366      791267        syn-C2H3C(O)NH2, v=0
  343951.6444  0.0060 -4.1009 3  813.1569159  71510 303791466      791367        syn-C2H3C(O)NH2, v=0
  343952.1398  0.0039 -3.9016 3  412.1904123  71510 30361 358      61 259        syn-C2H3C(O)NH2, v=0
  343952.1398  0.0039 -3.9016 3  412.1904123  71510 30361 458      61 359        syn-C2H3C(O)NH2, v=0
  343979.5843  0.0121 -4.5761 3  754.9566147  71510 303732053      722152        syn-C2H3C(O)NH2, v=0
  343982.3679  0.0283 -5.1386 3 1062.0381173  71510 303862562      852659        syn-C2H3C(O)NH2, v=0
  344018.7322  0.0029 -5.2805 3   34.7790 35  71510 30317 611      16 314        syn-C2H3C(O)NH2, v=0
  344050.9998  0.0014 -4.2421 3   62.5704 45  71510 30322 716      21 417        syn-C2H3C(O)NH2, v=0
  344051.0948  0.0026 -5.5246 3   68.6592 43  71510 303211011      21 714        syn-C2H3C(O)NH2, v=0
  344081.9824  0.0778 -5.9862 3 1498.7846203  71510 303A13270      A03367        syn-C2H3C(O)NH2, v=0
  344085.9781  0.0200 -4.0354 3  764.8870155 -71510 303771265      771166        syn-C2H3C(O)NH2, v=0
  344085.9781  0.0200 -4.0354 3  764.8870155 -71510 303771365      771266        syn-C2H3C(O)NH2, v=0
  344087.5535  0.0778 -5.9862 3 1498.7846203  71510 303A13269      A03368        syn-C2H3C(O)NH2, v=0
  344089.3693  0.0010 -5.0938 3  292.2697 95  71510 303471038      461037        syn-C2H3C(O)NH2, v=0
  344099.7288  0.0014 -5.6753 3  475.6776 95  71510 303473017      463016        syn-C2H3C(O)NH2, v=0
  344099.7288  0.0014 -5.6753 3  475.6776 95  71510 303473018      463017        syn-C2H3C(O)NH2, v=0
  344157.5313  0.0012 -5.0759 3  274.4117 91  71510 303451035      441034        syn-C2H3C(O)NH2, v=0
  344186.7795  0.0200 -3.4586 3  345.9286 83 -71510 303412516      412417        syn-C2H3C(O)NH2, v=0
  344186.7795  0.0200 -3.4586 3  345.9286 83 -71510 303412517      412418        syn-C2H3C(O)NH2, v=0
  344290.2945  0.0200 -2.9847 3   91.1188 43 -71510 3032114 7      2013 8        syn-C2H3C(O)NH2, v=0
  344290.2945  0.0200 -2.9847 3   91.1188 43 -71510 3032114 8      2013 7        syn-C2H3C(O)NH2, v=0
  344294.1635  0.0588 -5.0307 3 1374.8002201  71510 303A02378      A02279        syn-C2H3C(O)NH2, v=0
  344328.5238  0.0014 -5.6267 3  461.8370 95  71510 303472918      462917        syn-C2H3C(O)NH2, v=0
  344328.5238  0.0014 -5.6267 3  461.8370 95  71510 303472919      462918        syn-C2H3C(O)NH2, v=0
  344354.8277  0.0010 -5.0921 3  286.3565 93  71510 303461136      451135        syn-C2H3C(O)NH2, v=0
  344363.7590  0.0043 -6.3470 3  624.4992129  71510 303642342      652045        syn-C2H3C(O)NH2, v=0
  344387.1194  0.0200 -3.8173 3  515.8149133 -71510 30366 660      66 561        syn-C2H3C(O)NH2, v=0
  344387.1194  0.0200 -3.8173 3  515.8149133 -71510 30366 760      66 661        syn-C2H3C(O)NH2, v=0
  344393.6633  0.0010 -5.1781 3  315.0700 93  71510 303461631      451630        syn-C2H3C(O)NH2, v=0
  344415.1087  0.0010 -5.1780 3  315.0707 93  71510 303461630      451629        syn-C2H3C(O)NH2, v=0
  344424.6017  0.0200 -3.0731 3  102.0130 51 -71510 303251214      241113        syn-C2H3C(O)NH2, v=0
  344425.7717  0.0200 -3.0731 3  102.0129 51 -71510 303251213      241114        syn-C2H3C(O)NH2, v=0
  344442.2481  0.0200 -3.4605 3  335.8939 81 -71510 303402515      402416        syn-C2H3C(O)NH2, v=0
  344442.2481  0.0200 -3.4605 3  335.8939 81 -71510 303402516      402417        syn-C2H3C(O)NH2, v=0
  344462.5464  0.0385 -5.2367 3 1499.0726205  71510 303A23073      A22974        syn-C2H3C(O)NH2, v=0
  344465.2282  0.0200 -3.3417 3  297.8430 95 -71510 303471037      461136        syn-C2H3C(O)NH2, v=0
  344476.9747  0.0234 -4.8904 3 1312.3484191  71510 303952966      952867        syn-C2H3C(O)NH2, v=0
  344505.1755  0.0039 -4.3643 3   56.5208 45  71510 30322 418      21 319        syn-C2H3C(O)NH2, v=0
  344519.3023  0.0200 -3.0248 3   95.7942 47 -71510 303231311      221210        syn-C2H3C(O)NH2, v=0
  344519.3023  0.0200 -3.0248 3   95.7942 47 -71510 303231310      221211        syn-C2H3C(O)NH2, v=0
  344531.0754  0.1850 -6.1591 3 1979.8837239  71510 303B93090      B92991        syn-C2H3C(O)NH2, v=0
  344560.3027  0.0059 -4.2489 3  351.6376117  71510 30358 157      58 058        syn-C2H3C(O)NH2, v=0
  344560.3027  0.0059 -4.2489 3  351.6376117  71510 30358 257      58 158        syn-C2H3C(O)NH2, v=0
  344579.2462  0.0013 -5.5805 3  448.4755 95  71510 303472819      462818        syn-C2H3C(O)NH2, v=0
  344579.2462  0.0013 -5.5805 3  448.4755 95  71510 303472820      462819        syn-C2H3C(O)NH2, v=0
  344580.8659  0.0200 -3.8198 3  689.9718133 -71510 303662640      662541        syn-C2H3C(O)NH2, v=0
  344580.8659  0.0200 -3.8198 3  689.9718133 -71510 303662641      662542        syn-C2H3C(O)NH2, v=0
  344641.9796  0.0010 -5.0923 3  292.2228 95  71510 30347 938      46 937        syn-C2H3C(O)NH2, v=0
  344650.4536  0.0027 -3.3747 3  168.3537 71  71510 303351026      34 925        syn-C2H3C(O)NH2, v=0
  344679.9153  0.0200 -3.4646 3  326.1083 79 -71510 303392514      392415        syn-C2H3C(O)NH2, v=0
  344679.9153  0.0200 -3.4646 3  326.1083 79 -71510 303392515      392416        syn-C2H3C(O)NH2, v=0
  344770.6186  0.0310 -5.1639 3  961.9915167  71510 303832163      822260        syn-C2H3C(O)NH2, v=0
  344831.3070  0.0375 -4.7743 3 1230.9535191  71510 303952075      951976        syn-C2H3C(O)NH2, v=0
  344855.5290  0.0013 -5.5366 3  435.5945 95  71510 303472720      462719        syn-C2H3C(O)NH2, v=0
  344855.5290  0.0013 -5.5366 3  435.5945 95  71510 303472721      462720        syn-C2H3C(O)NH2, v=0
  344900.7627  0.0200 -3.4709 3  316.5716 77 -71510 303382513      382414        syn-C2H3C(O)NH2, v=0
  344900.7627  0.0200 -3.4709 3  316.5716 77 -71510 303382514      382415        syn-C2H3C(O)NH2, v=0
  344957.1896  0.0022 -4.8319 3  126.8078 61  71510 303301021      30 724        syn-C2H3C(O)NH2, v=0
  344984.8173  0.0043 -6.3455 3  624.4785129  71510 303642341      652046        syn-C2H3C(O)NH2, v=0
  345020.3987  0.0692 -5.8579 3 1435.1675199  71510 303993169      983266        syn-C2H3C(O)NH2, v=0
  345035.3497  0.0692 -5.8579 3 1435.1675199  71510 303993168      983267        syn-C2H3C(O)NH2, v=0
  345041.7914  0.0371 -4.7738 3 1230.9545191  71510 303952175      952076        syn-C2H3C(O)NH2, v=0
  345054.1602  0.0223 -4.8890 3 1312.3260191  71510 303952967      952868        syn-C2H3C(O)NH2, v=0
  345105.6006  0.0200 -3.4798 3  307.2835 75 -71510 303372512      372413        syn-C2H3C(O)NH2, v=0
  345105.6006  0.0200 -3.4798 3  307.2835 75 -71510 303372513      372414        syn-C2H3C(O)NH2, v=0
  345161.7904  0.0012 -5.4947 3  423.1956 95  71510 303472621      462620        syn-C2H3C(O)NH2, v=0
  345161.7904  0.0012 -5.4947 3  423.1956 95  71510 303472622      462621        syn-C2H3C(O)NH2, v=0
  345244.8454  0.0023 -5.4106 3   74.0467 45  71510 303221013      22 716        syn-C2H3C(O)NH2, v=0
  345283.1494  0.0047 -4.1874 3  917.9496157  71510 303782751      782652        syn-C2H3C(O)NH2, v=0
  345285.9158  0.0047 -4.1874 3  917.9495157  71510 303782752      782653        syn-C2H3C(O)NH2, v=0
  345295.3178  0.0200 -3.4917 3  298.2435 73 -71510 303362511      362412        syn-C2H3C(O)NH2, v=0
  345295.3178  0.0200 -3.4917 3  298.2435 73 -71510 303362512      362413        syn-C2H3C(O)NH2, v=0
  345320.2706  0.0066 -5.2822 3  100.2248 57  71510 30328 622      28 325        syn-C2H3C(O)NH2, v=0
  345470.7053  0.0200 -3.5068 3  289.4514 71 -71510 303352510      352411        syn-C2H3C(O)NH2, v=0
  345470.7053  0.0200 -3.5068 3  289.4514 71 -71510 303352511      352412        syn-C2H3C(O)NH2, v=0
  345494.6325  0.0200 -3.2253 3  292.2228 95 -71510 303471038      46 937        syn-C2H3C(O)NH2, v=0
  345503.4592  0.0012 -5.4548 3  411.2809 95  71510 303472522      462521        syn-C2H3C(O)NH2, v=0
  345503.4592  0.0012 -5.4548 3  411.2809 95  71510 303472523      462522        syn-C2H3C(O)NH2, v=0
  345543.0473  0.0739 -5.5096 3 1643.8681215  71510 303A73176      A73077        syn-C2H3C(O)NH2, v=0
  345597.9190  0.0015 -3.7938 3  673.5984131  71510 303652639      652540        syn-C2H3C(O)NH2, v=0
  345597.9231  0.0015 -3.7938 3  673.5984131  71510 303652640      652541        syn-C2H3C(O)NH2, v=0
  345632.5668  0.0200 -3.5259 3  280.9070 69 -71510 3033425 9      342410        syn-C2H3C(O)NH2, v=0
  345632.5668  0.0200 -3.5259 3  280.9070 69 -71510 303342510      342411        syn-C2H3C(O)NH2, v=0
  345722.2146  0.0797 -5.1885 3 1462.2059207  71510 303A32380      A32281        syn-C2H3C(O)NH2, v=0
  345743.4542  0.0011 -5.1040 3  285.4072 91  71510 303451332      441331        syn-C2H3C(O)NH2, v=0
  345781.6926  0.0200 -3.5496 3  272.6098 67 -71510 3033325 8      3324 9        syn-C2H3C(O)NH2, v=0
  345781.6926  0.0200 -3.5496 3  272.6098 67 -71510 3033325 9      332410        syn-C2H3C(O)NH2, v=0
  345820.7340  0.0112 -4.5328 3 1116.5283175  71510 303872859      872760        syn-C2H3C(O)NH2, v=0
  345883.0878  0.0111 -4.5327 3 1116.5259175  71510 303872860      872761        syn-C2H3C(O)NH2, v=0
  345887.2857  0.0012 -5.4169 3  399.8527 95  71510 303472423      462422        syn-C2H3C(O)NH2, v=0
  345887.2857  0.0012 -5.4169 3  399.8527 95  71510 303472424      462423        syn-C2H3C(O)NH2, v=0
  345918.7495  0.0200 -3.5790 3  264.5597 65 -71510 3033225 7      3224 8        syn-C2H3C(O)NH2, v=0
  345918.7495  0.0200 -3.5790 3  264.5597 65 -71510 3033225 8      3224 9        syn-C2H3C(O)NH2, v=0
  346002.9875  0.1306 -5.6495 3 1711.9263223  71510 303B12785      B12686        syn-C2H3C(O)NH2, v=0
  346044.5216  0.0200 -3.6154 3  256.7564 63 -71510 3033125 6      3124 7        syn-C2H3C(O)NH2, v=0
  346044.5216  0.0200 -3.6154 3  256.7564 63 -71510 3033125 7      3124 8        syn-C2H3C(O)NH2, v=0
  346069.7171  0.0239 -5.0348 3 1009.0068169  71510 303842461      832558        syn-C2H3C(O)NH2, v=0
  346073.3906  0.2865 -6.0845 3 1937.7509237  71510 303B82890      B82791        syn-C2H3C(O)NH2, v=0
  346074.8877  0.0200 -3.8326 3  557.1931137 -71510 30368 761      68 662        syn-C2H3C(O)NH2, v=0
  346074.8877  0.0200 -3.8326 3  557.1931137 -71510 30368 861      68 762        syn-C2H3C(O)NH2, v=0
  346076.9025  0.0010 -5.1526 3  308.2925 93  71510 303461532      451531        syn-C2H3C(O)NH2, v=0
  346106.7474  0.0570 -5.5581 3 1671.1762217  71510 303A83178      A83079        syn-C2H3C(O)NH2, v=0
  346159.6458  0.0200 -3.6610 3  249.1995 61 -71510 3033025 5      3024 6        syn-C2H3C(O)NH2, v=0
  346159.6458  0.0200 -3.6610 3  249.1995 61 -71510 3033025 6      3024 7        syn-C2H3C(O)NH2, v=0
  346160.6515  0.0614 -5.7324 3 1372.9862195  71510 303973068      963165        syn-C2H3C(O)NH2, v=0
  346166.9618  0.0176 -4.4468 3 1039.5151177  71510 303881771      881672        syn-C2H3C(O)NH2, v=0
  346181.0916  0.0176 -4.4468 3 1039.5151177  71510 303881871      881772        syn-C2H3C(O)NH2, v=0
  346200.1027  0.0615 -5.7323 3 1372.9861195  71510 303973067      963166        syn-C2H3C(O)NH2, v=0
  346207.2438  0.0036 -4.6376 3   48.2758 43  71510 30321 318      20 219        syn-C2H3C(O)NH2, v=0
  346224.5469  0.0304 -5.1327 3 1062.0320173  71510 303862561      852660        syn-C2H3C(O)NH2, v=0
  346264.7781  0.0017 -3.7191 3  241.8889 59  71510 3032925 4      2924 5        syn-C2H3C(O)NH2, v=0
  346264.7781  0.0017 -3.7191 3  241.8889 59  71510 3032925 5      2924 6        syn-C2H3C(O)NH2, v=0
  346267.9273  0.0010 -5.1521 3  308.3001 93  71510 303461531      451530        syn-C2H3C(O)NH2, v=0
  346309.9102  0.0200 -3.2718 3  134.5429 63 -71510 303311022      30 921        syn-C2H3C(O)NH2, v=0
  346321.7787  0.0012 -5.3807 3  388.9141 95  71510 303472324      462323        syn-C2H3C(O)NH2, v=0
  346321.7787  0.0012 -5.3807 3  388.9141 95  71510 303472325      462324        syn-C2H3C(O)NH2, v=0
  346327.0553  0.0200 -3.3930 3  122.9906 61 -71510 30330 921      29 822        syn-C2H3C(O)NH2, v=0
  346331.6156  0.0063 -4.7464 3  175.4687 73  71510 30336 927      36 630        syn-C2H3C(O)NH2, v=0
  346349.8488  0.0200 -3.8509 3  450.3247127 -71510 30363 459      63 360        syn-C2H3C(O)NH2, v=0
  346349.8488  0.0200 -3.8509 3  450.3247127 -71510 30363 559      63 460        syn-C2H3C(O)NH2, v=0
  346360.5230  0.0200 -3.7950 3  234.8243 57 -71510 3032825 3      2824 4        syn-C2H3C(O)NH2, v=0
  346360.5230  0.0200 -3.7950 3  234.8243 57 -71510 3032825 4      2824 5        syn-C2H3C(O)NH2, v=0
  346413.6530  0.0407 -5.1856 3 1473.2502203  71510 303A13071      A12972        syn-C2H3C(O)NH2, v=0
  346447.5743  0.0200 -3.8991 3  228.0054 55 -71510 3032725 2      2724 3        syn-C2H3C(O)NH2, v=0
  346447.5743  0.0200 -3.8991 3  228.0054 55 -71510 3032725 3      2724 4        syn-C2H3C(O)NH2, v=0
  346526.3971  0.0200 -4.0544 3  221.4321 53 -71510 3032625 1      2624 2        syn-C2H3C(O)NH2, v=0
  346526.3971  0.0200 -4.0544 3  221.4321 53 -71510 3032625 2      2624 3        syn-C2H3C(O)NH2, v=0
  346561.3047  0.0015 -3.7686 3  657.4853129  71510 303642638      642539        syn-C2H3C(O)NH2, v=0
  346561.3066  0.0015 -3.7686 3  657.4853129  71510 303642639      642540        syn-C2H3C(O)NH2, v=0
  346595.1568  0.0829 -6.3320 3 2075.2124243  71510 303C13389      C13290        syn-C2H3C(O)NH2, v=0
  346597.6256  0.0020 -4.3347 3  215.1042 51  71510 3032525 0      2524 1        syn-C2H3C(O)NH2, v=0
  346597.6256  0.0020 -4.3347 3  215.1042 51  71510 3032525 1      2524 2        syn-C2H3C(O)NH2, v=0
  346817.8389  0.0011 -5.3462 3  378.4688 95  71510 303472225      462224        syn-C2H3C(O)NH2, v=0
  346817.8389  0.0011 -5.3462 3  378.4688 95  71510 303472226      462225        syn-C2H3C(O)NH2, v=0
  346885.4902  0.0036 -4.9663 3  123.8962 59  71510 303291118      29 821        syn-C2H3C(O)NH2, v=0
  346925.1259  0.0034 -3.7645 3  389.0070107  71510 303531340      521439        syn-C2H3C(O)NH2, v=0
  346960.3425  0.0200 -4.1516 3  898.4524155 -71510 303772750      772651        syn-C2H3C(O)NH2, v=0
  346961.8387  0.0200 -4.1516 3  898.4524155 -71510 303772751      772652        syn-C2H3C(O)NH2, v=0
  347119.5376  0.0035 -4.6360 3   48.2757 43  71510 30321 418      20 119        syn-C2H3C(O)NH2, v=0
  347173.9240  0.0011 -5.0581 3  266.3103 89  71510 303441133      431132        syn-C2H3C(O)NH2, v=0
  347178.8077  0.0045 -5.0404 3  111.4100 59  71510 30329 822      29 525        syn-C2H3C(O)NH2, v=0
  347181.0306  0.0743 -5.1850 3 1462.2146207  71510 303A32480      A32381        syn-C2H3C(O)NH2, v=0
  347237.2828  0.2020 -6.3528 3 2083.5626245  71510 303C23192      C23093        syn-C2H3C(O)NH2, v=0
  347282.9358  0.0025 -3.3507 3  159.4369 69  71510 303341025      33 924        syn-C2H3C(O)NH2, v=0
  347364.6157  0.0766 -5.9023 3 1852.9221229  71510 303B43283      B43184        syn-C2H3C(O)NH2, v=0
  347380.0384  0.0050 -4.0173 3  387.7764121  71510 30360 258      60 159        syn-C2H3C(O)NH2, v=0
  347380.0384  0.0050 -4.0173 3  387.7764121  71510 30360 358      60 259        syn-C2H3C(O)NH2, v=0
  347389.7060  0.0011 -5.3134 3  368.5215 95  71510 303472127      462126        syn-C2H3C(O)NH2, v=0
  347389.7061  0.0011 -5.3134 3  368.5215 95  71510 303472126      462125        syn-C2H3C(O)NH2, v=0
  347429.7466  0.0153 -4.8550 3  907.3692161  71510 303802259      792356        syn-C2H3C(O)NH2, v=0
  347473.7975  0.0200 -3.7443 3  641.6318127 -71510 303632637      632538        syn-C2H3C(O)NH2, v=0
  347473.7975  0.0200 -3.7443 3  641.6318127 -71510 303632638      632539        syn-C2H3C(O)NH2, v=0
  347482.6477  0.1028 -5.3517 3 1552.1937213  71510 303A62482      A62383        syn-C2H3C(O)NH2, v=0
  347509.6283  0.0200 -3.8601 3  599.8401141 -71510 30370 862      70 763        syn-C2H3C(O)NH2, v=0
  347509.6283  0.0200 -3.8601 3  599.8401141 -71510 30370 962      70 863        syn-C2H3C(O)NH2, v=0
  347515.9618  0.0024 -5.5196 3   68.5435 43  71510 303211012      21 715        syn-C2H3C(O)NH2, v=0
  347534.4305  0.0543 -5.6098 3 1312.2433191  71510 303952967      943064        syn-C2H3C(O)NH2, v=0
  347567.8521  0.0028 -6.1933 3  408.1109103  71510 303512032      521735        syn-C2H3C(O)NH2, v=0
  347572.6140  0.0195 -4.9386 3  957.4449165  71510 303822360      812457        syn-C2H3C(O)NH2, v=0
  347636.6058  0.0545 -5.6096 3 1312.2430191  71510 303952966      943065        syn-C2H3C(O)NH2, v=0
  347667.6159  0.0045 -6.2371 3   51.7637 41  71510 30320 713      20 218        syn-C2H3C(O)NH2, v=0
  347753.3644  0.0209 -4.8402 3 1288.3299189  71510 303942965      942866        syn-C2H3C(O)NH2, v=0
  347766.4272  0.0028 -6.1928 3  408.1043103  71510 303512031      521736        syn-C2H3C(O)NH2, v=0
  347821.3315  0.0025 -5.6405 3   63.3606 41  71510 303201010      20 713        syn-C2H3C(O)NH2, v=0
  347852.6969  0.1164 -5.7945 3 1795.3380225  71510 303B23280      B23181        syn-C2H3C(O)NH2, v=0
  347899.4411  0.0138 -4.3582 3  985.7966173  71510 303861670      861571        syn-C2H3C(O)NH2, v=0
  347903.8784  0.0138 -4.3582 3  985.7966173  71510 303861770      861671        syn-C2H3C(O)NH2, v=0
  347943.7010  0.1549 -5.8286 3 1808.7895229  71510 303B42887      B42788        syn-C2H3C(O)NH2, v=0
  348012.8378  0.0010 -5.1283 3  302.1234 93  71510 303461433      451432        syn-C2H3C(O)NH2, v=0
  348042.0935  0.2209 -5.8886 3 1837.5391231  71510 303B52788      B52689        syn-C2H3C(O)NH2, v=0
  348042.4012  0.0159 -4.6830 3  819.7767153  71510 303762155      752254        syn-C2H3C(O)NH2, v=0
  348056.4314  0.0011 -5.2821 3  359.0783 95  71510 303472028      462027        syn-C2H3C(O)NH2, v=0
  348056.4327  0.0011 -5.2821 3  359.0783 95  71510 303472027      462026        syn-C2H3C(O)NH2, v=0
  348086.0971  0.0356 -5.1814 3 1473.1840203  71510 303A13072      A12973        syn-C2H3C(O)NH2, v=0
  348103.2435  0.0203 -4.8393 3 1288.3164189  71510 303942966      942867        syn-C2H3C(O)NH2, v=0
  348182.6299  0.0102 -4.4897 3 1094.6548173  71510 303862858      862759        syn-C2H3C(O)NH2, v=0
  348218.3471  0.0101 -4.4896 3 1094.6534173  71510 303862859      862760        syn-C2H3C(O)NH2, v=0
  348222.9599  0.0200 -3.2959 3  142.5246 65 -71510 303321023      31 922        syn-C2H3C(O)NH2, v=0
  348232.6681  0.0299 -4.6693 3 1173.0894187  71510 303931974      931875        syn-C2H3C(O)NH2, v=0
  348256.6940  0.0013 -5.0673 3  326.6388111  71510 30355 253      54 252        syn-C2H3C(O)NH2, v=0
  348256.6961  0.0200 -2.9053 3  326.6388111 -71510 30355 253      54 352        syn-C2H3C(O)NH2, v=0
  348256.6961  0.0200 -2.9053 3  326.6388111 -71510 30355 353      54 252        syn-C2H3C(O)NH2, v=0
  348256.6940  0.0013 -5.0673 3  326.6388111  71510 30355 353      54 352        syn-C2H3C(O)NH2, v=0
  348261.7290  0.0015 -5.0586 3  327.6755113  71510 30356 155      55 154        syn-C2H3C(O)NH2, v=0
  348261.7213  0.0200 -2.8765 3  327.6755113 -71510 30356 155      55 254        syn-C2H3C(O)NH2, v=0
  348261.7213  0.0200 -2.8765 3  327.6755113 -71510 30356 255      55 154        syn-C2H3C(O)NH2, v=0
  348261.7290  0.0015 -5.0586 3  327.6755113  71510 30356 255      55 254        syn-C2H3C(O)NH2, v=0
  348264.5400  0.0012 -5.0750 3  325.0824109  71510 30354 351      53 350        syn-C2H3C(O)NH2, v=0
  348264.5277  0.0200 -2.9357 3  325.0824109 -71510 30354 351      53 450        syn-C2H3C(O)NH2, v=0
  348264.5277  0.0200 -2.9357 3  325.0824109 -71510 30354 451      53 350        syn-C2H3C(O)NH2, v=0
  348264.5400  0.0012 -5.0750 3  325.0824109  71510 30354 451      53 450        syn-C2H3C(O)NH2, v=0
  348272.0493  0.0018 -5.0490 3  328.2017115  71510 30357 057      56 056        syn-C2H3C(O)NH2, v=0
  348272.0379  0.0200 -2.8489 3  328.2017115 -71510 30357 057      56 156        syn-C2H3C(O)NH2, v=0
  348272.0379  0.0200 -2.8489 3  328.2017115 -71510 30357 157      56 056        syn-C2H3C(O)NH2, v=0
  348272.0493  0.0018 -5.0490 3  328.2017115  71510 30357 157      56 156        syn-C2H3C(O)NH2, v=0
  348296.7877  0.0200 -2.9682 3  322.9943107 -71510 30353 449      52 548        syn-C2H3C(O)NH2, v=0
  348296.7815  0.0011 -5.0817 3  322.9943107  71510 30353 449      52 448        syn-C2H3C(O)NH2, v=0
  348296.7877  0.0200 -2.9682 3  322.9943107 -71510 30353 549      52 448        syn-C2H3C(O)NH2, v=0
  348296.7815  0.0011 -5.0817 3  322.9943107  71510 30353 549      52 548        syn-C2H3C(O)NH2, v=0
  348307.8484  0.0298 -4.6691 3 1173.0897187  71510 303932074      931975        syn-C2H3C(O)NH2, v=0
  348337.9413  0.0200 -3.7209 3  626.0372125 -71510 303622636      622537        syn-C2H3C(O)NH2, v=0
  348337.9413  0.0200 -3.7209 3  626.0372125 -71510 303622637      622538        syn-C2H3C(O)NH2, v=0
  348339.6457  0.0491 -4.9163 3 1314.0107197  71510 303982177      982078        syn-C2H3C(O)NH2, v=0
  348371.4050  0.0200 -3.0036 3  320.3587105 -71510 30352 547      51 646        syn-C2H3C(O)NH2, v=0
  348371.4129  0.0011 -5.0872 3  320.3587105  71510 30352 647      51 646        syn-C2H3C(O)NH2, v=0
  348371.4137  0.0011 -5.0872 3  320.3587105  71510 30352 547      51 546        syn-C2H3C(O)NH2, v=0
  348371.4050  0.0200 -3.0036 3  320.3587105 -71510 30352 647      51 546        syn-C2H3C(O)NH2, v=0
  348420.5588  0.1832 -6.0987 3 1953.6002235  71510 303B73384      B73285        syn-C2H3C(O)NH2, v=0
  348483.3085  0.0010 -5.0949 3  291.4185 93  71510 303461235      451234        syn-C2H3C(O)NH2, v=0
  348517.7887  0.0200 -3.0431 3  317.1544103 -71510 30351 645      50 744        syn-C2H3C(O)NH2, v=0
  348517.7776  0.0010 -5.0915 3  317.1544103  71510 30351 745      50 744        syn-C2H3C(O)NH2, v=0
  348517.8104  0.0010 -5.0915 3  317.1544103  71510 30351 645      50 644        syn-C2H3C(O)NH2, v=0
  348517.7887  0.0200 -3.0431 3  317.1544103 -71510 30351 745      50 644        syn-C2H3C(O)NH2, v=0
  348527.3536  0.0200 -3.8314 3  489.7490131 -71510 30365 560      65 461        syn-C2H3C(O)NH2, v=0
  348527.3536  0.0200 -3.8314 3  489.7490131 -71510 30365 660      65 561        syn-C2H3C(O)NH2, v=0
  348545.8882  0.0200 -3.3232 3  150.8236 67 -71510 303331024      32 923        syn-C2H3C(O)NH2, v=0
  348548.0526  0.0039 -4.1167 3  879.2231153  71510 303762749      762650        syn-C2H3C(O)NH2, v=0
  348548.8288  0.0039 -4.1167 3  879.2231153  71510 303762750      762651        syn-C2H3C(O)NH2, v=0
  348554.9630  0.1324 -5.5226 3 1644.7509219  71510 303A92584      A92485        syn-C2H3C(O)NH2, v=0
  348678.9569  0.0200 -3.8975 3  643.7489145 -71510 30372 963      72 864        syn-C2H3C(O)NH2, v=0
  348678.9569  0.0200 -3.8975 3  643.7489145 -71510 303721063      72 964        syn-C2H3C(O)NH2, v=0
  348691.8231  0.0482 -4.9154 3 1314.0125197  71510 303982277      982178        syn-C2H3C(O)NH2, v=0
  348785.2506  0.0200 -3.0884 3  313.3510101 -71510 30350 743      49 842        syn-C2H3C(O)NH2, v=0
  348786.4241  0.0010 -5.0942 3  313.3510101  71510 30350 843      49 842        syn-C2H3C(O)NH2, v=0
  348787.4221  0.0010 -5.0942 3  313.3509101  71510 30350 743      49 742        syn-C2H3C(O)NH2, v=0
  348788.5912  0.0200 -3.0884 3  313.3509101 -71510 30350 843      49 742        syn-C2H3C(O)NH2, v=0
  348799.7598  0.1708 -5.7014 3 1739.8691225  71510 303B22686      B22587        syn-C2H3C(O)NH2, v=0
  348844.2782  0.0011 -5.2523 3  350.1471 95  71510 303471929      461928        syn-C2H3C(O)NH2, v=0
  348844.3005  0.0011 -5.2523 3  350.1471 95  71510 303471928      461927        syn-C2H3C(O)NH2, v=0
  348928.7944  0.0012 -5.0788 3  285.8915 93  71510 303461036      451035        syn-C2H3C(O)NH2, v=0
  349148.9583  0.0108 -4.2747 3  933.2736169  71510 303841569      841470        syn-C2H3C(O)NH2, v=0
  349150.2821  0.0108 -4.2747 3  933.2736169  71510 303841669      841570        syn-C2H3C(O)NH2, v=0
  349156.2139  0.0200 -3.6984 3  610.7008123 -71510 303612635      612536        syn-C2H3C(O)NH2, v=0
  349156.2139  0.0200 -3.6984 3  610.7008123 -71510 303612636      612537        syn-C2H3C(O)NH2, v=0
  349163.9450  0.0023 -6.2314 3  286.0157 85  71510 303421825      431528        syn-C2H3C(O)NH2, v=0
  349171.4262  0.0478 -5.4901 3 1252.9419187  71510 303932866      922963        syn-C2H3C(O)NH2, v=0
  349201.4216  0.1116 -5.7573 3 1204.0774187  71510 303932371      922468        syn-C2H3C(O)NH2, v=0
  349227.7511  0.0023 -6.2312 3  286.0135 85  71510 303421824      431529        syn-C2H3C(O)NH2, v=0
  349236.6968  0.0200 -3.1429 3  308.9035 99 -71510 30349 841      48 940        syn-C2H3C(O)NH2, v=0
  349265.4852  0.0010 -5.0951 3  308.9035 99  71510 30349 941      48 940        syn-C2H3C(O)NH2, v=0
  349280.8997  0.0896 -6.2670 3 2044.2773241  71510 303C03388      C03289        syn-C2H3C(O)NH2, v=0
  349287.5835  0.0010 -5.0950 3  308.9018 99  71510 30349 841      48 840        syn-C2H3C(O)NH2, v=0
  349316.3650  0.0200 -3.1427 3  308.9018 99 -71510 30349 941      48 840        syn-C2H3C(O)NH2, v=0
  349318.9543  0.0018 -5.3278 3   33.2563 33  71510 30316 7 9      15 412        syn-C2H3C(O)NH2, v=0
  349332.0367  0.0011 -5.1252 3  302.1863 93  71510 303461432      451431        syn-C2H3C(O)NH2, v=0
  349373.6729  0.0026 -6.2452 3   50.0592 39  71510 30319 811      19 316        syn-C2H3C(O)NH2, v=0
  349375.5736  0.0035 -3.6002 3  112.2423 59  71510 30329 821      28 722        syn-C2H3C(O)NH2, v=0
  349387.5653  0.0010 -5.1076 3  296.5528 93  71510 303461334      451333        syn-C2H3C(O)NH2, v=0
  349430.6049  0.0483 -5.4895 3 1252.9413187  71510 303932865      922964        syn-C2H3C(O)NH2, v=0
  349477.9206  0.0038 -4.3354 3  309.3331 95  71510 303471334      471037        syn-C2H3C(O)NH2, v=0
  349528.1802  0.0200 -3.2149 3  303.7472 97 -71510 30348 939      471038        syn-C2H3C(O)NH2, v=0
  349568.9193  0.0200 -3.9435 3  688.9121149 -71510 303741064      74 965        syn-C2H3C(O)NH2, v=0
  349568.9193  0.0200 -3.9435 3  688.9121149 -71510 303741164      741065        syn-C2H3C(O)NH2, v=0
  349669.8496  0.0034 -4.3579 3   56.5188 45  71510 30322 518      21 219        syn-C2H3C(O)NH2, v=0
  349703.6048  0.0024 -5.6376 3   63.2978 41  71510 303201011      20 714        syn-C2H3C(O)NH2, v=0
  349775.3606  0.0927 -5.3462 3 1552.2083213  71510 303A62582      A62483        syn-C2H3C(O)NH2, v=0
  349790.8097  0.0011 -5.2239 3  341.7388 95  71510 303471830      461829        syn-C2H3C(O)NH2, v=0
  349791.1296  0.0011 -5.2239 3  341.7388 95  71510 303471829      461828        syn-C2H3C(O)NH2, v=0
  349857.0772  0.1803 -6.0138 3 1908.2060235  71510 303B72989      B72890        syn-C2H3C(O)NH2, v=0
  349885.1908  0.0036 -6.3060 3  651.6586 97  71510 3034840 8      4740 7        syn-C2H3C(O)NH2, v=0
  349885.1908  0.0036 -6.3060 3  651.6586 97  71510 3034840 9      4740 8        syn-C2H3C(O)NH2, v=0
  349930.8691  0.0200 -3.6768 3  595.6221121 -71510 303602634      602535        syn-C2H3C(O)NH2, v=0
  349930.8691  0.0200 -3.6768 3  595.6221121 -71510 303602635      602536        syn-C2H3C(O)NH2, v=0
  349964.6245  0.0085 -4.1966 3  881.9557165  71510 303821468      821369        syn-C2H3C(O)NH2, v=0
  349964.9989  0.0085 -4.1966 3  881.9557165  71510 303821568      821469        syn-C2H3C(O)NH2, v=0
  349996.5475  0.0200 -3.9137 3  425.2186125 -71510 30362 359      62 260        syn-C2H3C(O)NH2, v=0
  349996.5475  0.0200 -3.9137 3  425.2186125 -71510 30362 459      62 360        syn-C2H3C(O)NH2, v=0
  350004.9310  0.0539 -5.4986 3 1643.6879215  71510 303A73177      A73078        syn-C2H3C(O)NH2, v=0
  350009.1850  0.0032 -6.2208 3  633.0772 97  71510 3034839 9      4739 8        syn-C2H3C(O)NH2, v=0
  350009.1850  0.0032 -6.2208 3  633.0772 97  71510 303483910      4739 9        syn-C2H3C(O)NH2, v=0
  350039.0223  0.0010 -5.0936 3  303.7472 97  71510 303481039      471038        syn-C2H3C(O)NH2, v=0
  350052.0923  0.0036 -4.0827 3  860.2608151  71510 303752748      752649        syn-C2H3C(O)NH2, v=0
  350052.4956  0.0036 -4.0827 3  860.2608151  71510 303752749      752650        syn-C2H3C(O)NH2, v=0
  350070.4300  0.0127 -4.8335 3  878.7579159  71510 303792159      782256        syn-C2H3C(O)NH2, v=0
  350108.4389  0.0010 -3.2407 3  126.6813 61  71510 303301020      29 921        syn-C2H3C(O)NH2, v=0
  350139.4795  0.0029 -6.1421 3  614.9680 97  71510 303483810      4738 9        syn-C2H3C(O)NH2, v=0
  350139.4795  0.0029 -6.1421 3  614.9680 97  71510 303483811      473810        syn-C2H3C(O)NH2, v=0
  350154.8266  0.0611 -5.4429 3 1079.5834177  71510 303882267      872364        syn-C2H3C(O)NH2, v=0
  350163.1386  0.0044 -3.9971 3  735.3222153  71510 303761165      761066        syn-C2H3C(O)NH2, v=0
  350163.1446  0.0044 -3.9971 3  735.3222153  71510 303761265      761166        syn-C2H3C(O)NH2, v=0
  350172.1960  0.0031 -4.4833 3  240.9746 83  71510 303411328      411031        syn-C2H3C(O)NH2, v=0
  350227.9899  0.0200 -3.1370 3  116.5731 57 -71510 303281118      271017        syn-C2H3C(O)NH2, v=0
  350276.8750  0.0026 -6.0687 3  597.3313 97  71510 303483711      473710        syn-C2H3C(O)NH2, v=0
  350276.8750  0.0026 -6.0687 3  597.3313 97  71510 303483712      473711        syn-C2H3C(O)NH2, v=0
  350318.5266  0.0025 -4.8015 3  134.4091 63  71510 303311022      31 725        syn-C2H3C(O)NH2, v=0
  350380.8017  0.0010 -5.0926 3  303.7188 97  71510 30348 939      47 938        syn-C2H3C(O)NH2, v=0
  350385.3006  0.0067 -4.1241 3  831.8521161  71510 303801367      801268        syn-C2H3C(O)NH2, v=0
  350385.4006  0.0067 -4.1241 3  831.8521161  71510 303801467      801368        syn-C2H3C(O)NH2, v=0
  350405.2900  0.0092 -4.4476 3 1073.0567171  71510 303852857      852758        syn-C2H3C(O)NH2, v=0
  350422.2883  0.0023 -5.9999 3  580.1677 97  71510 303483612      473611        syn-C2H3C(O)NH2, v=0
  350422.2883  0.0023 -5.9999 3  580.1677 97  71510 303483613      473612        syn-C2H3C(O)NH2, v=0
  350425.5045  0.0092 -4.4475 3 1073.0560171  71510 303852858      852759        syn-C2H3C(O)NH2, v=0
  350442.6874  0.0200 -4.0575 3  782.9715157 -71510 303781266      781167        syn-C2H3C(O)NH2, v=0
  350442.6874  0.0200 -4.0575 3  782.9715157 -71510 303781366      781267        syn-C2H3C(O)NH2, v=0
  350448.3070  0.0200 -3.1366 3  116.5668 57 -71510 303281117      271018        syn-C2H3C(O)NH2, v=0
  350449.4165  0.0038 -4.6989 3  177.5560 71  71510 303351223      35 926        syn-C2H3C(O)NH2, v=0
  350476.7835  0.0025 -3.8327 3  530.4565135  71510 30367 661      67 562        syn-C2H3C(O)NH2, v=0
  350476.7835  0.0025 -3.8327 3  530.4565135  71510 30367 761      67 662        syn-C2H3C(O)NH2, v=0
  350525.9551  0.0356 -5.1297 3 1447.6236201  71510 303A03070      A02971        syn-C2H3C(O)NH2, v=0
  350576.7729  0.0021 -5.9352 3  563.4778 97  71510 303483513      473512        syn-C2H3C(O)NH2, v=0
  350576.7729  0.0021 -5.9352 3  563.4778 97  71510 303483514      473513        syn-C2H3C(O)NH2, v=0
  350596.4584  0.0063 -4.2590 3  363.6582119  71510 30359 158      59 059        syn-C2H3C(O)NH2, v=0
  350596.4584  0.0063 -4.2590 3  363.6582119  71510 30359 258      59 159        syn-C2H3C(O)NH2, v=0
  350599.0088  0.0010 -5.0909 3  297.8430 95  71510 303471137      461136        syn-C2H3C(O)NH2, v=0
  350663.9403  0.0200 -3.6561 3  580.8005119 -71510 303592633      592534        syn-C2H3C(O)NH2, v=0
  350663.9403  0.0200 -3.6561 3  580.8005119 -71510 303592634      592535        syn-C2H3C(O)NH2, v=0
  350741.5453  0.0019 -5.8741 3  547.2620 97  71510 303483414      473413        syn-C2H3C(O)NH2, v=0
  350741.5453  0.0019 -5.8741 3  547.2620 97  71510 303483415      473414        syn-C2H3C(O)NH2, v=0
  350756.1900  0.0025 -5.7673 3   58.3434 39  71510 3031910 9      19 712        syn-C2H3C(O)NH2, v=0
  350783.5879  0.0189 -4.7912 3 1264.5970187  71510 303932964      932865        syn-C2H3C(O)NH2, v=0
  350790.8172  0.0200 -2.9072 3   90.3983 37 -71510 3031816 2      1715 3        syn-C2H3C(O)NH2, v=0
  350790.8172  0.0200 -2.9072 3   90.3983 37 -71510 3031816 3      1715 2        syn-C2H3C(O)NH2, v=0
  350891.6829  0.0200 -3.2114 3  303.7188 97 -71510 303481039      47 938        syn-C2H3C(O)NH2, v=0
  350918.0167  0.0017 -5.8163 3  531.5211 97  71510 303483315      473314        syn-C2H3C(O)NH2, v=0
  350918.0167  0.0017 -5.8163 3  531.5211 97  71510 303483316      473315        syn-C2H3C(O)NH2, v=0
  350927.8909  0.0238 -4.5695 3 1116.3898183  71510 303911873      911774        syn-C2H3C(O)NH2, v=0
  350951.6066  0.0011 -5.1966 3  333.8685 95  71510 303471731      461730        syn-C2H3C(O)NH2, v=0
  350953.4929  0.0238 -4.5695 3 1116.3899183  71510 303911973      911874        syn-C2H3C(O)NH2, v=0
  350955.5278  0.0011 -5.1966 3  333.8686 95  71510 303471730      461729        syn-C2H3C(O)NH2, v=0
  350962.8664  0.0627 -5.4469 3 1616.6033213  71510 303A63175      A63076        syn-C2H3C(O)NH2, v=0
  350993.0720  0.0186 -4.7907 3 1264.5890187  71510 303932965      932866        syn-C2H3C(O)NH2, v=0
  351058.1166  0.0058 -4.6262 3  207.9842 79  71510 303391029      39 732        syn-C2H3C(O)NH2, v=0
  351085.4472  0.0419 -5.3735 3 1195.0856183  71510 303912765      902862        syn-C2H3C(O)NH2, v=0
  351107.8324  0.0016 -5.7614 3  516.2558 97  71510 303483216      473215        syn-C2H3C(O)NH2, v=0
  351107.8324  0.0016 -5.7614 3  516.2558 97  71510 303483217      473216        syn-C2H3C(O)NH2, v=0
  351200.7635  0.0200 -2.9407 3   92.5852 41 -71510 3032015 5      1914 6        syn-C2H3C(O)NH2, v=0
  351200.7635  0.0200 -2.9407 3   92.5852 41 -71510 3032015 6      1914 5        syn-C2H3C(O)NH2, v=0
  351211.7423  0.0755 -5.8392 3 1823.8373227  71510 303B33282      B33183        syn-C2H3C(O)NH2, v=0
  351235.8639  0.0277 -5.0211 3 1008.9916169  71510 303842460      832559        syn-C2H3C(O)NH2, v=0
  351312.9219  0.0015 -5.7092 3  501.4670 97  71510 303483117      473116        syn-C2H3C(O)NH2, v=0
  351312.9219  0.0015 -5.7092 3  501.4670 97  71510 303483118      473117        syn-C2H3C(O)NH2, v=0
  351357.5661  0.0200 -3.6363 3  566.2354117 -71510 303582632      582533        syn-C2H3C(O)NH2, v=0
  351357.5661  0.0200 -3.6363 3  566.2354117 -71510 303582633      582534        syn-C2H3C(O)NH2, v=0
  351456.3386  0.0636 -5.0656 3 1399.6606203  71510 303A12279      A12180        syn-C2H3C(O)NH2, v=0
  351477.7521  0.0200 -4.0496 3  841.5644149 -71510 303742747      742648        syn-C2H3C(O)NH2, v=0
  351477.7521  0.0200 -4.0496 3  841.5644149 -71510 303742748      742649        syn-C2H3C(O)NH2, v=0
  351484.7024  0.0200 -3.0690 3  108.1871 53 -71510 303261215      251114        syn-C2H3C(O)NH2, v=0
  351487.5803  0.0200 -3.0690 3  108.1870 53 -71510 303261214      251115        syn-C2H3C(O)NH2, v=0
  351535.5616  0.0014 -5.6596 3  487.1555 97  71510 303483018      473017        syn-C2H3C(O)NH2, v=0
  351535.5616  0.0014 -5.6596 3  487.1555 97  71510 303483019      473018        syn-C2H3C(O)NH2, v=0
  351540.1994  0.0200 -2.9769 3   96.2583 45 -71510 3032214 8      2113 9        syn-C2H3C(O)NH2, v=0
  351540.1994  0.0200 -2.9769 3   96.2583 45 -71510 3032214 9      2113 8        syn-C2H3C(O)NH2, v=0
  351572.8008  0.0327 -5.1272 3 1447.5825201  71510 303A03071      A02972        syn-C2H3C(O)NH2, v=0
  351609.8898  0.0031 -6.2200 3  470.3293111  71510 303552135      561838        syn-C2H3C(O)NH2, v=0
  351708.4736  0.0200 -3.0183 3  101.4441 49 -71510 303241312      231211        syn-C2H3C(O)NH2, v=0
  351708.4736  0.0200 -3.0183 3  101.4441 49 -71510 303241311      231212        syn-C2H3C(O)NH2, v=0
  351725.5862  0.0024 -5.7657 3   58.3110 39  71510 303191010      19 713        syn-C2H3C(O)NH2, v=0
  351727.6355  0.0428 -5.3719 3 1195.0841183  71510 303912764      902863        syn-C2H3C(O)NH2, v=0
  351778.4557  0.0014 -5.6123 3  473.3226 97  71510 303482919      472918        syn-C2H3C(O)NH2, v=0
  351778.4557  0.0014 -5.6123 3  473.3226 97  71510 303482920      472919        syn-C2H3C(O)NH2, v=0
  351851.3628  0.2055 -6.2048 3 2010.1702241  71510 303C03091      C02992        syn-C2H3C(O)NH2, v=0
  351855.3712  0.0031 -6.2194 3  470.3211111  71510 303552134      561839        syn-C2H3C(O)NH2, v=0
  351858.3666  0.0230 -5.0501 3  940.6445165  71510 303822162      812259        syn-C2H3C(O)NH2, v=0
  351874.2587  0.0063 -5.5562 3   83.3162 53  71510 30326 521      26 224        syn-C2H3C(O)NH2, v=0
  352013.5648  0.0200 -3.6174 3  551.9263115 -71510 303572631      572532        syn-C2H3C(O)NH2, v=0
  352013.5648  0.0200 -3.6174 3  551.9263115 -71510 303572632      572533        syn-C2H3C(O)NH2, v=0
  352035.4648  0.0616 -5.0642 3 1399.6638203  71510 303A12379      A12280        syn-C2H3C(O)NH2, v=0
  352044.8399  0.0013 -5.5672 3  459.9695 97  71510 303482820      472819        syn-C2H3C(O)NH2, v=0
  352044.8399  0.0013 -5.5672 3  459.9695 97  71510 303482821      472820        syn-C2H3C(O)NH2, v=0
  352098.8643  0.1140 -5.5142 3 1644.7747219  71510 303A92684      A92585        syn-C2H3C(O)NH2, v=0
  352189.0978  0.0200 -3.8494 3  572.4402139 -71510 30369 762      69 663        syn-C2H3C(O)NH2, v=0
  352189.0978  0.0200 -3.8494 3  572.4402139 -71510 30369 862      69 763        syn-C2H3C(O)NH2, v=0
  352269.4080  0.0395 -4.8054 3 1254.3668193  71510 303962076      961977        syn-C2H3C(O)NH2, v=0
  352338.6191  0.0013 -5.5243 3  447.0976 97  71510 303482721      472720        syn-C2H3C(O)NH2, v=0
  352338.6191  0.0013 -5.5243 3  447.0976 97  71510 303482722      472721        syn-C2H3C(O)NH2, v=0
  352398.9194  0.0392 -4.8051 3 1254.3674193  71510 303962176      962077        syn-C2H3C(O)NH2, v=0
  352403.8447  0.0200 -3.8644 3  463.9577129 -71510 30364 460      64 361        syn-C2H3C(O)NH2, v=0
  352403.8447  0.0200 -3.8644 3  463.9577129 -71510 30364 560      64 461        syn-C2H3C(O)NH2, v=0
  352405.7199  0.0011 -5.1704 3  326.5577 95  71510 303471632      461631        syn-C2H3C(O)NH2, v=0
  352445.8759  0.0011 -5.1703 3  326.5592 95  71510 303471631      461630        syn-C2H3C(O)NH2, v=0
  352501.5306  0.0084 -4.4064 3 1051.7326169  71510 303842856      842757        syn-C2H3C(O)NH2, v=0
  352512.8346  0.0084 -4.4064 3 1051.7322169  71510 303842857      842758        syn-C2H3C(O)NH2, v=0
  352531.7645  0.0940 -6.2015 3 2013.6116239  71510 303B93387      B93288        syn-C2H3C(O)NH2, v=0
  352633.6995  0.0200 -3.5995 3  537.8726113 -71510 303562630      562531        syn-C2H3C(O)NH2, v=0
  352633.6995  0.0200 -3.5995 3  537.8726113 -71510 303562631      562532        syn-C2H3C(O)NH2, v=0
  352655.5275  0.0060 -5.9310 3   67.6842 49  71510 30324 420      24 123        syn-C2H3C(O)NH2, v=0
  352664.5497  0.0012 -5.4833 3  434.7090 97  71510 303482622      472621        syn-C2H3C(O)NH2, v=0
  352664.5497  0.0012 -5.4833 3  434.7090 97  71510 303482623      472622        syn-C2H3C(O)NH2, v=0
  352734.9230  0.1047 -6.2748 3 1656.4908213  71510 303A63473      A53570        syn-C2H3C(O)NH2, v=0
  352736.2687  0.1047 -6.2748 3 1656.4908213  71510 303A63472      A53571        syn-C2H3C(O)NH2, v=0
  352796.6895  0.0200 -3.3092 3  309.5377 97 -71510 303481038      471137        syn-C2H3C(O)NH2, v=0
  352829.5333  0.0200 -4.0173 3  823.1330147 -71510 303732746      732647        syn-C2H3C(O)NH2, v=0
  352829.5333  0.0200 -4.0173 3  823.1330147 -71510 303732747      732648        syn-C2H3C(O)NH2, v=0
  352986.6907  0.0023 -4.3114 3  326.2739 97  71510 303481434      481137        syn-C2H3C(O)NH2, v=0
  353028.4874  0.0012 -5.4442 3  422.8056 97  71510 303482523      472522        syn-C2H3C(O)NH2, v=0
  353028.4874  0.0012 -5.4442 3  422.8056 97  71510 303482524      472523        syn-C2H3C(O)NH2, v=0
  353030.7501  0.0189 -4.4748 3 1060.8668179  71510 303891772      891673        syn-C2H3C(O)NH2, v=0
  353039.0593  0.0189 -4.4748 3 1060.8668179  71510 303891872      891773        syn-C2H3C(O)NH2, v=0
  353061.7585  0.0025 -5.9067 3   53.5994 37  71510 3031810 8      18 711        syn-C2H3C(O)NH2, v=0
  353072.4879  0.0206 -4.7934 3  887.2608159  71510 303792257      782356        syn-C2H3C(O)NH2, v=0
  353219.6395  0.0200 -3.5826 3  524.0739111 -71510 303552629      552530        syn-C2H3C(O)NH2, v=0
  353219.6395  0.0200 -3.5826 3  524.0739111 -71510 303552630      552531        syn-C2H3C(O)NH2, v=0
  353242.2274  0.0364 -5.2603 3 1138.6791179  71510 303892664      882761        syn-C2H3C(O)NH2, v=0
  353417.9541  0.0053 -4.0288 3  400.4016123  71510 30361 259      61 160        syn-C2H3C(O)NH2, v=0
  353417.9541  0.0053 -4.0288 3  400.4016123  71510 30361 359      61 260        syn-C2H3C(O)NH2, v=0
  353437.7301  0.0012 -5.4070 3  411.3903 97  71510 303482424      472423        syn-C2H3C(O)NH2, v=0
  353437.7301  0.0012 -5.4070 3  411.3903 97  71510 303482425      472424        syn-C2H3C(O)NH2, v=0
  353448.8185  0.0042 -3.8734 3  435.9627113  71510 303561442      551541        syn-C2H3C(O)NH2, v=0
  353469.9147  0.0011 -5.0679 3  281.1326 91  71510 303451233      441232        syn-C2H3C(O)NH2, v=0
  353484.1281  0.0939 -6.1396 3 1589.5375209  71510 303A43372      A33469        syn-C2H3C(O)NH2, v=0
  353487.8085  0.0939 -6.1396 3 1589.5375209  71510 303A43371      A33470        syn-C2H3C(O)NH2, v=0
  353524.4248  0.0017 -4.1543 3   68.0122 47  71510 30323 717      22 418        syn-C2H3C(O)NH2, v=0
  353534.4378  0.0024 -5.9059 3   53.5837 37  71510 3031810 9      18 712        syn-C2H3C(O)NH2, v=0
  353542.1203  0.0023 -6.3289 3  228.4420 75  71510 303371721      381424        syn-C2H3C(O)NH2, v=0
  353565.3950  0.0023 -6.3289 3  228.4412 75  71510 303371720      381425        syn-C2H3C(O)NH2, v=0
  353604.1968  0.0171 -4.7434 3 1241.1469185  71510 303922963      922864        syn-C2H3C(O)NH2, v=0
  353654.1195  0.0029 -3.8781 3  615.6933143  71510 30371 863      71 764        syn-C2H3C(O)NH2, v=0
  353654.1196  0.0029 -3.8781 3  615.6933143  71510 30371 963      71 864        syn-C2H3C(O)NH2, v=0
  353718.7560  0.0030 -4.1744 3   64.9981 47  71510 30323 618      22 319        syn-C2H3C(O)NH2, v=0
  353728.1149  0.0170 -4.7431 3 1241.1422185  71510 303922964      922865        syn-C2H3C(O)NH2, v=0
  353773.0206  0.0200 -3.5667 3  510.5296109 -71510 303542628      542529        syn-C2H3C(O)NH2, v=0
  353773.0206  0.0200 -3.5667 3  510.5296109 -71510 303542629      542530        syn-C2H3C(O)NH2, v=0
  353830.9296  0.0011 -5.0818 3  297.5305 95  71510 303471037      461036        syn-C2H3C(O)NH2, v=0
  353851.1032  0.0504 -5.4399 3 1616.4876213  71510 303A63176      A63077        syn-C2H3C(O)NH2, v=0
  353901.5042  0.0012 -5.3714 3  400.4662 97  71510 303482325      472324        syn-C2H3C(O)NH2, v=0
  353901.5042  0.0012 -5.3714 3  400.4662 97  71510 303482326      472325        syn-C2H3C(O)NH2, v=0
  353939.1482  0.0144 -4.8872 3  899.0381161  71510 303802160      792257        syn-C2H3C(O)NH2, v=0
  354041.2550  0.0200 -3.4415 3  326.9804 99 -71510 303491138      481237        syn-C2H3C(O)NH2, v=0
  354102.0644  0.0011 -5.0555 3  277.8908 91  71510 303451134      441133        syn-C2H3C(O)NH2, v=0
  354111.8048  0.0027 -3.9859 3  804.9658145  71510 303722745      722646        syn-C2H3C(O)NH2, v=0
  354111.8570  0.0027 -3.9859 3  804.9658145  71510 303722746      722647        syn-C2H3C(O)NH2, v=0
  354135.2354  0.0816 -5.2223 3 1487.8966209  71510 303A42381      A42282        syn-C2H3C(O)NH2, v=0
  354186.2028  0.1382 -5.6887 3 1739.9076225  71510 303B22786      B22687        syn-C2H3C(O)NH2, v=0
  354216.5769  0.0011 -5.1452 3  319.8363 95  71510 303471533      461532        syn-C2H3C(O)NH2, v=0
  354258.8146  0.0317 -5.0755 3 1422.2922199  71510 303993069      992970        syn-C2H3C(O)NH2, v=0
  354295.3245  0.0014 -3.5517 3  497.2393107  71510 303532627      532528        syn-C2H3C(O)NH2, v=0
  354295.3245  0.0014 -3.5517 3  497.2393107  71510 303532628      532529        syn-C2H3C(O)NH2, v=0
  354303.9016  0.0013 -5.0688 3  338.2554113  71510 30356 254      55 253        syn-C2H3C(O)NH2, v=0
  354303.8929  0.0200 -2.9059 3  338.2554113 -71510 30356 254      55 353        syn-C2H3C(O)NH2, v=0
  354303.8929  0.0200 -2.9059 3  338.2554113 -71510 30356 354      55 253        syn-C2H3C(O)NH2, v=0
  354303.9016  0.0013 -5.0688 3  338.2554113  71510 30356 354      55 353        syn-C2H3C(O)NH2, v=0
  354309.3602  0.0015 -5.0603 3  339.2922115  71510 30357 156      56 155        syn-C2H3C(O)NH2, v=0
  354309.3516  0.0200 -2.8777 3  339.2922115 -71510 30357 156      56 255        syn-C2H3C(O)NH2, v=0
  354309.3516  0.0200 -2.8777 3  339.2922115 -71510 30357 256      56 155        syn-C2H3C(O)NH2, v=0
  354309.3602  0.0015 -5.0603 3  339.2922115  71510 30357 256      56 255        syn-C2H3C(O)NH2, v=0
  354310.6423  0.0012 -5.0763 3  336.6992111  71510 30355 352      54 351        syn-C2H3C(O)NH2, v=0
  354310.6717  0.0200 -2.9355 3  336.6992111 -71510 30355 352      54 451        syn-C2H3C(O)NH2, v=0
  354310.6717  0.0200 -2.9355 3  336.6992111 -71510 30355 452      54 351        syn-C2H3C(O)NH2, v=0
  354310.6423  0.0012 -5.0763 3  336.6992111  71510 30355 452      54 451        syn-C2H3C(O)NH2, v=0
  354319.7839  0.0019 -5.0509 3  339.8188117  71510 30358 058      57 057        syn-C2H3C(O)NH2, v=0
  354319.7659  0.0200 -2.8506 3  339.8188117 -71510 30358 058      57 157        syn-C2H3C(O)NH2, v=0
  354319.7659  0.0200 -2.8506 3  339.8188117 -71510 30358 158      57 057        syn-C2H3C(O)NH2, v=0
  354319.7839  0.0019 -5.0509 3  339.8188117  71510 30358 158      57 157        syn-C2H3C(O)NH2, v=0
  354340.4528  0.0012 -5.0828 3  334.6122109  71510 30354 450      53 449        syn-C2H3C(O)NH2, v=0
  354340.4415  0.0200 -2.9672 3  334.6122109 -71510 30354 450      53 549        syn-C2H3C(O)NH2, v=0
  354340.4415  0.0200 -2.9672 3  334.6122109 -71510 30354 550      53 449        syn-C2H3C(O)NH2, v=0
  354340.4528  0.0012 -5.0828 3  334.6122109  71510 30354 550      53 549        syn-C2H3C(O)NH2, v=0
  354344.5049  0.0969 -5.7264 3 1766.7218223  71510 303B13279      B13180        syn-C2H3C(O)NH2, v=0
  354399.5660  0.0840 -6.0072 3 1524.0158205  71510 303A23271      A13368        syn-C2H3C(O)NH2, v=0
  354409.4833  0.0840 -6.0072 3 1524.0158205  71510 303A23270      A13369        syn-C2H3C(O)NH2, v=0
  354410.1363  0.0200 -3.0015 3  331.9791107 -71510 30353 548      52 647        syn-C2H3C(O)NH2, v=0
  354410.1471  0.0011 -5.0882 3  331.9791107  71510 30353 648      52 647        syn-C2H3C(O)NH2, v=0
  354410.1475  0.0011 -5.0882 3  331.9791107  71510 30353 548      52 547        syn-C2H3C(O)NH2, v=0
  354410.1363  0.0200 -3.0015 3  331.9791107 -71510 30353 648      52 547        syn-C2H3C(O)NH2, v=0
  354431.6738  0.0011 -5.3376 3  390.0374 97  71510 303482226      472225        syn-C2H3C(O)NH2, v=0
  354431.6738  0.0011 -5.3376 3  390.0374 97  71510 303482227      472226        syn-C2H3C(O)NH2, v=0
  354460.9499  0.0038 -4.8814 3  130.2074 63  71510 30331 923      31 626        syn-C2H3C(O)NH2, v=0
  354481.9658  0.0077 -4.3662 3 1030.6809167  71510 303832855      832756        syn-C2H3C(O)NH2, v=0
  354488.2118  0.0077 -4.3662 3 1030.6807167  71510 303832856      832757        syn-C2H3C(O)NH2, v=0
  354546.8139  0.0200 -3.0396 3  328.7797105 -71510 30352 646      51 745        syn-C2H3C(O)NH2, v=0
  354546.7969  0.0011 -5.0923 3  328.7797105  71510 30352 746      51 745        syn-C2H3C(O)NH2, v=0
  354546.8141  0.0011 -5.0923 3  328.7797105  71510 30352 646      51 645        syn-C2H3C(O)NH2, v=0
  354546.8139  0.0200 -3.0396 3  328.7797105 -71510 30352 746      51 645        syn-C2H3C(O)NH2, v=0
  354549.8470  0.0011 -5.1444 3  319.8504 95  71510 303471532      461531        syn-C2H3C(O)NH2, v=0
  354595.1384  0.0200 -3.8462 3  503.9868133 -71510 30366 561      66 462        syn-C2H3C(O)NH2, v=0
  354595.1384  0.0200 -3.8462 3  503.9868133 -71510 30366 661      66 562        syn-C2H3C(O)NH2, v=0
  354604.9637  0.0058 -5.9276 3   67.6842 49  71510 30324 520      24 223        syn-C2H3C(O)NH2, v=0
  354618.4849  0.0150 -4.3853 3 1006.5312175  71510 303871671      871572        syn-C2H3C(O)NH2, v=0
  354621.0523  0.0150 -4.3852 3 1006.5312175  71510 303871771      871672        syn-C2H3C(O)NH2, v=0
  354667.9952  0.0029 -6.1230 3   54.8454 41  71510 30320 812      20 317        syn-C2H3C(O)NH2, v=0
  354703.5412  0.0024 -6.2030 3  338.3155 93  71510 303461928      471631        syn-C2H3C(O)NH2, v=0
  354748.7059  0.0175 -4.9584 3  919.6627163  71510 303812161      802258        syn-C2H3C(O)NH2, v=0
  354787.5672  0.0024 -6.2028 3  338.3127 93  71510 303461927      471632        syn-C2H3C(O)NH2, v=0
  354788.0264  0.0200 -3.5379 3  484.2024105 -71510 303522626      522527        syn-C2H3C(O)NH2, v=0
  354788.0264  0.0200 -3.5379 3  484.2024105 -71510 303522627      522528        syn-C2H3C(O)NH2, v=0
  354791.1667  0.0383 -5.2563 3 1138.6750179  71510 303892663      882762        syn-C2H3C(O)NH2, v=0
  354795.7420  0.0200 -3.0831 3  324.9852103 -71510 30351 744      50 843        syn-C2H3C(O)NH2, v=0
  354796.3824  0.0010 -5.0949 3  324.9852103  71510 30351 844      50 843        syn-C2H3C(O)NH2, v=0
  354796.9257  0.0010 -5.0949 3  324.9852103  71510 30351 744      50 743        syn-C2H3C(O)NH2, v=0
  354797.5695  0.0200 -3.0831 3  324.9852103 -71510 30351 844      50 743        syn-C2H3C(O)NH2, v=0
  354860.2849  0.0200 -3.9168 3  660.2087147 -71510 30373 964      73 865        syn-C2H3C(O)NH2, v=0
  354860.2849  0.0200 -3.9168 3  660.2087147 -71510 303731064      73 965        syn-C2H3C(O)NH2, v=0
  354878.1321  0.0027 -4.3013 3  338.7899 99  71510 303491435      491138        syn-C2H3C(O)NH2, v=0
  354893.0502  0.0025 -6.0607 3   49.1227 35  71510 3031710 7      17 710        syn-C2H3C(O)NH2, v=0
  354905.6359  0.0300 -5.0739 3 1422.2669199  71510 303993070      992971        syn-C2H3C(O)NH2, v=0
  355043.8112  0.0011 -5.3053 3  380.1092 97  71510 303482128      472127        syn-C2H3C(O)NH2, v=0
  355043.8113  0.0011 -5.3053 3  380.1092 97  71510 303482127      472126        syn-C2H3C(O)NH2, v=0
  355071.7695  0.0778 -5.2201 3 1487.9020209  71510 303A42481      A42382        syn-C2H3C(O)NH2, v=0
  355110.5919  0.0025 -6.0603 3   49.1154 35  71510 3031710 8      17 711        syn-C2H3C(O)NH2, v=0
  355167.1318  0.0034 -6.2662 3  536.9950119  71510 303592238      601941        syn-C2H3C(O)NH2, v=0
  355186.3158  0.0729 -5.7766 3 1795.0376225  71510 303B23281      B23182        syn-C2H3C(O)NH2, v=0
  355223.5098  0.0200 -3.1348 3  320.5538101 -71510 30350 842      49 941        syn-C2H3C(O)NH2, v=0
  355239.6548  0.0010 -5.0957 3  320.5538101  71510 30350 942      49 941        syn-C2H3C(O)NH2, v=0
  355252.2790  0.0010 -5.0956 3  320.5528101  71510 30350 842      49 841        syn-C2H3C(O)NH2, v=0
  355252.4577  0.0200 -3.5251 3  471.4187103 -71510 303512625      512526        syn-C2H3C(O)NH2, v=0
  355252.4577  0.0200 -3.5251 3  471.4187103 -71510 303512626      512527        syn-C2H3C(O)NH2, v=0
  355268.4317  0.0010 -3.1346 3  320.5528101  71510 30350 942      49 841        syn-C2H3C(O)NH2, v=0
  355308.0444  0.0054 -4.5252 3  243.1369 85  71510 303421131      42 834        syn-C2H3C(O)NH2, v=0
  355328.6151  0.0200 -3.9553 3  787.0619143 -71510 303712744      712645        syn-C2H3C(O)NH2, v=0
  355328.6151  0.0200 -3.9553 3  787.0619143 -71510 303712745      712646        syn-C2H3C(O)NH2, v=0
  355409.3134  0.0317 -4.6998 3 1195.8780189  71510 303941975      941876        syn-C2H3C(O)NH2, v=0
  355413.4986  0.0200 -3.5850 3  357.3541103 -71510 303511239      501338        syn-C2H3C(O)NH2, v=0
  355445.1749  0.0011 -5.0920 3  303.0426 95  71510 303471236      461235        syn-C2H3C(O)NH2, v=0
  355454.7581  0.0316 -4.6997 3 1195.8782189  71510 303942075      941976        syn-C2H3C(O)NH2, v=0
  355465.7900  0.0034 -6.2655 3  536.9851119  71510 303592237      601942        syn-C2H3C(O)NH2, v=0
  355493.5519  0.0312 -5.1513 3 1083.7281175  71510 303872563      862660        syn-C2H3C(O)NH2, v=0
  355508.5315  0.0749 -5.8777 3 1459.9282201  71510 303A03170      993267        syn-C2H3C(O)NH2, v=0
  355510.8040  0.0012 -5.0925 3  296.9400 93  71510 303461333      451332        syn-C2H3C(O)NH2, v=0
  355534.8259  0.0750 -5.8776 3 1459.9281201  71510 303A03169      993268        syn-C2H3C(O)NH2, v=0
  355675.9416  0.0200 -3.2013 3  315.4233 99 -71510 30349 940      481039        syn-C2H3C(O)NH2, v=0
  355689.9717  0.0200 -3.5134 3  458.8875101 -71510 303502624      502525        syn-C2H3C(O)NH2, v=0
  355689.9717  0.0200 -3.5134 3  458.8875101 -71510 303502625      502526        syn-C2H3C(O)NH2, v=0
  355747.6657  0.0118 -4.3008 3  953.3931171  71510 303851570      851471        syn-C2H3C(O)NH2, v=0
  355748.4196  0.0118 -4.3008 3  953.3931171  71510 303851670      851571        syn-C2H3C(O)NH2, v=0
  355752.1220  0.0541 -5.3866 3 1589.6489211  71510 303A53174      A53075        syn-C2H3C(O)NH2, v=0
  355758.8797  0.0011 -5.2745 3  370.6882 97  71510 303482029      472028        syn-C2H3C(O)NH2, v=0
  355758.8828  0.0011 -5.2745 3  370.6882 97  71510 303482028      472027        syn-C2H3C(O)NH2, v=0
  355794.1814  0.0200 -3.9640 3  705.9792151 -71510 303751065      75 966        syn-C2H3C(O)NH2, v=0
  355794.1814  0.0200 -3.9640 3  705.9792151 -71510 303751165      751066        syn-C2H3C(O)NH2, v=0
  355840.7587  0.3550 -6.3229 3 2071.1986245  71510 303C22993      C22894        syn-C2H3C(O)NH2, v=0
  355976.3416  0.0513 -4.9488 3 1338.2445199  71510 303992178      992079        syn-C2H3C(O)NH2, v=0
  355978.5777  0.0010 -5.0942 3  315.4233 99  71510 303491040      481039        syn-C2H3C(O)NH2, v=0
  356014.3548  0.0024 -4.3438 3  313.9139 95  71510 303471433      471136        syn-C2H3C(O)NH2, v=0
  356039.7167  0.0200 -3.9266 3  438.4485127 -71510 30363 360      63 261        syn-C2H3C(O)NH2, v=0
  356039.7167  0.0200 -3.9266 3  438.4485127 -71510 30363 460      63 361        syn-C2H3C(O)NH2, v=0
  356087.8763  0.1652 -5.8698 3 1837.6005231  71510 303B52888      B52789        syn-C2H3C(O)NH2, v=0
  356101.7641  0.0200 -3.5029 3  446.6086 99 -71510 303492623      492524        syn-C2H3C(O)NH2, v=0
  356101.7641  0.0200 -3.5029 3  446.6086 99 -71510 303492624      492525        syn-C2H3C(O)NH2, v=0
  356167.5205  0.0011 -5.1215 3  313.7318 95  71510 303471434      461433        syn-C2H3C(O)NH2, v=0
  356186.8093  0.0010 -5.0936 3  315.4063 99  71510 30349 940      48 939        syn-C2H3C(O)NH2, v=0
  356191.6739  0.0957 -6.1360 3 1983.2218237  71510 303B83386      B83287        syn-C2H3C(O)NH2, v=0
  356195.4431  0.0507 -4.9483 3 1338.2456199  71510 303992278      992179        syn-C2H3C(O)NH2, v=0
  356242.7778  0.0156 -4.6967 3 1217.9771183  71510 303912962      912863        syn-C2H3C(O)NH2, v=0
  356282.9294  0.1504 -6.0245 3 1923.6152233  71510 303B63383      B63284        syn-C2H3C(O)NH2, v=0
  356314.7799  0.1041 -5.3863 3 1578.7117215  71510 303A72483      A72384        syn-C2H3C(O)NH2, v=0
  356315.2145  0.0155 -4.6965 3 1217.9744183  71510 303912963      912864        syn-C2H3C(O)NH2, v=0
  356355.5758  0.0070 -4.3269 3 1009.9004165  71510 303822854      822755        syn-C2H3C(O)NH2, v=0
  356358.9857  0.0070 -4.3269 3 1009.9003165  71510 303822855      822756        syn-C2H3C(O)NH2, v=0
  356360.5593  0.0025 -6.2326 3   44.9084 33  71510 3031610 6      16 7 9        syn-C2H3C(O)NH2, v=0
  356436.6100  0.2336 -6.3418 3 2087.2961243  71510 303C13487      C13388        syn-C2H3C(O)NH2, v=0
  356440.6481  0.0049 -4.0187 3  752.9975155  71510 303771166      771067        syn-C2H3C(O)NH2, v=0
  356440.6513  0.0049 -4.0187 3  752.9975155  71510 303771266      771167        syn-C2H3C(O)NH2, v=0
  356454.5972  0.0025 -6.2324 3   44.9052 33  71510 3031610 7      16 710        syn-C2H3C(O)NH2, v=0
  356462.1331  0.0094 -4.2217 3  901.4621167  71510 303831469      831370        syn-C2H3C(O)NH2, v=0
  356462.3431  0.0094 -4.2217 3  901.4621167  71510 303831569      831470        syn-C2H3C(O)NH2, v=0
  356483.3413  0.0023 -3.9256 3  769.4205141  71510 303702743      702644        syn-C2H3C(O)NH2, v=0
  356483.3538  0.0023 -3.9256 3  769.4205141  71510 303702744      702645        syn-C2H3C(O)NH2, v=0
  356489.0738  0.0013 -3.4936 3  434.5814 97  71510 303482622      482523        syn-C2H3C(O)NH2, v=0
  356489.0738  0.0013 -3.4936 3  434.5814 97  71510 303482623      482524        syn-C2H3C(O)NH2, v=0
  356489.4348  0.0011 -3.1992 3  315.4063 99  71510 303491040      48 939        syn-C2H3C(O)NH2, v=0
  356562.8812  0.0200 -3.8488 3  545.2994137 -71510 30368 662      68 563        syn-C2H3C(O)NH2, v=0
  356562.8812  0.0200 -3.8488 3  545.2994137 -71510 30368 762      68 663        syn-C2H3C(O)NH2, v=0
  356606.0129  0.0011 -5.2451 3  361.7833 97  71510 303481930      471929        syn-C2H3C(O)NH2, v=0
  356606.0616  0.0011 -5.2451 3  361.7833 97  71510 303481929      471928        syn-C2H3C(O)NH2, v=0
  356632.0320  0.0066 -4.2699 3  375.8804121  71510 30360 159      60 060        syn-C2H3C(O)NH2, v=0
  356632.0320  0.0066 -4.2699 3  375.8804121  71510 30360 259      60 160        syn-C2H3C(O)NH2, v=0
  356660.1096  0.0163 -4.8791 3  927.7257163  71510 303812260      802357        syn-C2H3C(O)NH2, v=0
  356728.3649  0.0011 -5.0909 3  309.5377 97  71510 303481138      471137        syn-C2H3C(O)NH2, v=0
  356781.8744  0.0060 -4.0803 3  801.2559159  71510 303791267      791168        syn-C2H3C(O)NH2, v=0
  356781.8881  0.0060 -4.0803 3  801.2559159  71510 303791367      791268        syn-C2H3C(O)NH2, v=0
  356785.0851  0.0200 -3.1395 3  123.5638 59 -71510 303291119      281018        syn-C2H3C(O)NH2, v=0
  356797.1695  0.0075 -4.1481 3  850.7468163  71510 303811368      811269        syn-C2H3C(O)NH2, v=0
  356797.2247  0.0075 -4.1481 3  850.7468163  71510 303811468      811369        syn-C2H3C(O)NH2, v=0
  356842.2818  0.0667 -5.7510 3 1397.2772197  71510 303983069      973166        syn-C2H3C(O)NH2, v=0
  356853.0019  0.0200 -3.4856 3  422.8056 95 -71510 303472621      472522        syn-C2H3C(O)NH2, v=0
  356853.0019  0.0200 -3.4856 3  422.8056 95 -71510 303472622      472523        syn-C2H3C(O)NH2, v=0
  356880.4460  0.0045 -4.1604 3   70.3792 49  71510 30324 519      23 420        syn-C2H3C(O)NH2, v=0
  356910.7699  0.0669 -5.7509 3 1397.2771197  71510 303983068      973167        syn-C2H3C(O)NH2, v=0
  357144.8537  0.0067 -5.0824 3  125.5785 63  71510 30331 724      31 427        syn-C2H3C(O)NH2, v=0
  357160.2447  0.0011 -5.1022 3  308.2071 95  71510 303471335      461334        syn-C2H3C(O)NH2, v=0
  357194.6607  0.0200 -3.4790 3  411.2809 93 -71510 303462620      462521        syn-C2H3C(O)NH2, v=0
  357194.6607  0.0200 -3.4790 3  411.2809 93 -71510 303462621      462522        syn-C2H3C(O)NH2, v=0
  357229.5433  0.0200 -3.1386 3  123.5512 59 -71510 303291118      281019        syn-C2H3C(O)NH2, v=0
  357234.2163  0.2536 -6.2813 3 1446.7138205  71510 303A22578      A12675        syn-C2H3C(O)NH2, v=0
  357235.2441  0.0036 -6.2654 3  663.3295 99  71510 3034940 9      4840 8        syn-C2H3C(O)NH2, v=0
  357235.2441  0.0036 -6.2654 3  663.3295 99  71510 303494010      4840 9        syn-C2H3C(O)NH2, v=0
  357260.1251  0.0034 -5.0427 3  116.3395 57  71510 303281117      28 820        syn-C2H3C(O)NH2, v=0
  357365.6868  0.0032 -6.1856 3  644.7523 99  71510 303493910      4839 9        syn-C2H3C(O)NH2, v=0
  357365.6868  0.0032 -6.1856 3  644.7523 99  71510 303493911      483910        syn-C2H3C(O)NH2, v=0
  357427.4768  0.0028 -4.7813 3  142.2176 65  71510 303321023      32 726        syn-C2H3C(O)NH2, v=0
  357458.1929  0.0261 -5.0483 3 1030.2415171  71510 303852462      842559        syn-C2H3C(O)NH2, v=0
  357502.8771  0.0029 -6.1111 3  626.6473 99  71510 303493811      483810        syn-C2H3C(O)NH2, v=0
  357502.8771  0.0029 -6.1111 3  626.6473 99  71510 303493812      483811        syn-C2H3C(O)NH2, v=0
  357515.1337  0.0200 -3.4737 3  400.0068 91 -71510 303452619      452520        syn-C2H3C(O)NH2, v=0
  357515.1337  0.0200 -3.4737 3  400.0068 91 -71510 303452620      452521        syn-C2H3C(O)NH2, v=0
  357579.4734  0.0200 -3.8967 3  752.0409139 -71510 303692742      692643        syn-C2H3C(O)NH2, v=0
  357579.4734  0.0200 -3.8967 3  752.0409139 -71510 303692743      692644        syn-C2H3C(O)NH2, v=0
  357595.0319  0.0467 -5.3822 3 1589.5757211  71510 303A53175      A53076        syn-C2H3C(O)NH2, v=0
  357627.2616  0.0011 -5.2170 3  353.4066 97  71510 303481831      471830        syn-C2H3C(O)NH2, v=0
  357627.9245  0.0011 -5.2170 3  353.4066 97  71510 303481830      471829        syn-C2H3C(O)NH2, v=0
  357647.4121  0.0200 -2.8671 3   93.5756 35 -71510 3031717 0      1616 1        syn-C2H3C(O)NH2, v=0
  357647.4121  0.0200 -2.8671 3   93.5756 35 -71510 3031717 1      1616 0        syn-C2H3C(O)NH2, v=0
  357647.6692  0.0025 -6.0413 3  609.0153 99  71510 303493712      483711        syn-C2H3C(O)NH2, v=0
  357647.6692  0.0025 -6.0413 3  609.0153 99  71510 303493713      483712        syn-C2H3C(O)NH2, v=0
  357682.6452  0.0284 -5.0227 3 1397.2513197  71510 303983068      982969        syn-C2H3C(O)NH2, v=0
  357737.7897  0.0048 -3.9870 3  485.5710119  71510 303591544      581643        syn-C2H3C(O)NH2, v=0
  357801.0407  0.0023 -5.9755 3  591.8566 99  71510 303493613      483612        syn-C2H3C(O)NH2, v=0
  357801.0407  0.0023 -5.9755 3  591.8566 99  71510 303493614      483613        syn-C2H3C(O)NH2, v=0
  357804.8255  0.0970 -5.3828 3 1578.7208215  71510 303A72583      A72484        syn-C2H3C(O)NH2, v=0
  357815.3610  0.0200 -3.4700 3  388.9829 89 -71510 303442618      442519        syn-C2H3C(O)NH2, v=0
  357815.3610  0.0200 -3.4700 3  388.9829 89 -71510 303442619      442520        syn-C2H3C(O)NH2, v=0
  357828.0656  0.0056 -5.5476 3   83.3162 53  71510 30326 621      26 324        syn-C2H3C(O)NH2, v=0
  357872.6542  0.1941 -6.0570 3 1937.8471237  71510 303B82990      B82891        syn-C2H3C(O)NH2, v=0
  357902.8802  0.0255 -4.5992 3 1138.5570185  71510 303921874      921775        syn-C2H3C(O)NH2, v=0
  357913.0931  0.1326 -5.5578 3 1672.0986221  71510 303B02585      B02486        syn-C2H3C(O)NH2, v=0
  357918.0969  0.0254 -4.5992 3 1138.5571185  71510 303921974      921875        syn-C2H3C(O)NH2, v=0
  357964.1160  0.0021 -5.9133 3  575.1718 99  71510 303493514      483513        syn-C2H3C(O)NH2, v=0
  357964.1160  0.0021 -5.9133 3  575.1718 99  71510 303493515      483514        syn-C2H3C(O)NH2, v=0
  357978.6564  0.2760 -6.1191 3 1967.6094239  71510 303B92891      B92792        syn-C2H3C(O)NH2, v=0
  358076.3729  0.0200 -2.8994 3   94.7858 39 -71510 3031916 3      1815 4        syn-C2H3C(O)NH2, v=0
  358076.3729  0.0200 -2.8994 3   94.7858 39 -71510 3031916 4      1815 3        syn-C2H3C(O)NH2, v=0
  358077.3552  0.0275 -5.0218 3 1397.2360197  71510 303983069      982970        syn-C2H3C(O)NH2, v=0
  358096.3509  0.0200 -3.4678 3  378.2090 87 -71510 303432617      432518        syn-C2H3C(O)NH2, v=0
  358096.3509  0.0200 -3.4678 3  378.2090 87 -71510 303432618      432519        syn-C2H3C(O)NH2, v=0
  358097.2155  0.0019 -3.3359 3  274.4117 91  71510 303451135      441034        syn-C2H3C(O)NH2, v=0
  358130.0993  0.0064 -4.2885 3  989.3898163  71510 303812853      812754        syn-C2H3C(O)NH2, v=0
  358131.9385  0.0064 -4.2885 3  989.3898163  71510 303812854      812755        syn-C2H3C(O)NH2, v=0
  358138.1938  0.0019 -5.8544 3  558.9615 99  71510 303493415      483414        syn-C2H3C(O)NH2, v=0
  358138.1938  0.0019 -5.8544 3  558.9615 99  71510 303493416      483415        syn-C2H3C(O)NH2, v=0
  358200.5144  0.0010 -3.2544 3  134.2277 63  71510 303311021      30 922        syn-C2H3C(O)NH2, v=0
  358266.1295  0.0040 -6.3304 3  608.1061127  71510 303632341      642044        syn-C2H3C(O)NH2, v=0
  358267.9480  0.0011 -5.1165 3  313.8388 95  71510 303471433      461432        syn-C2H3C(O)NH2, v=0
  358294.4788  0.0200 -3.3175 3  285.8915 93 -71510 303461136      451035        syn-C2H3C(O)NH2, v=0
  358298.5245  0.0200 -3.8668 3  587.8886141 -71510 30370 763      70 664        syn-C2H3C(O)NH2, v=0
  358298.5245  0.0200 -3.8668 3  587.8886141 -71510 30370 863      70 764        syn-C2H3C(O)NH2, v=0
  358324.7812  0.0017 -5.7984 3  543.2265 99  71510 303493316      483315        syn-C2H3C(O)NH2, v=0
  358324.7812  0.0017 -5.7984 3  543.2265 99  71510 303493317      483316        syn-C2H3C(O)NH2, v=0
  358335.2779  0.0210 -4.9552 3  978.2329167  71510 303832361      822458        syn-C2H3C(O)NH2, v=0
  358359.0417  0.0200 -3.4675 3  367.6846 85 -71510 303422616      422517        syn-C2H3C(O)NH2, v=0
  358359.0417  0.0200 -3.4675 3  367.6846 85 -71510 303422617      422518        syn-C2H3C(O)NH2, v=0
  358433.0755  0.0592 -5.6273 3 1336.0660193  71510 303962968      953065        syn-C2H3C(O)NH2, v=0
  358456.0309  0.0200 -3.8786 3  477.7922131 -71510 30365 461      65 362        syn-C2H3C(O)NH2, v=0
  358456.0309  0.0200 -3.8786 3  477.7922131 -71510 30365 561      65 462        syn-C2H3C(O)NH2, v=0
  358472.0332  0.0200 -2.9330 3   97.4702 43 -71510 3032115 6      2014 7        syn-C2H3C(O)NH2, v=0
  358472.0332  0.0200 -2.9330 3   97.4702 43 -71510 3032115 7      2014 6        syn-C2H3C(O)NH2, v=0
  358496.7988  0.0200 -3.0662 3  114.6181 55 -71510 303271216      261115        syn-C2H3C(O)NH2, v=0
  358503.6917  0.0200 -3.0662 3  114.6179 55 -71510 303271215      261116        syn-C2H3C(O)NH2, v=0
  358525.6370  0.0016 -5.7451 3  527.9675 99  71510 303493217      483216        syn-C2H3C(O)NH2, v=0
  358525.6370  0.0016 -5.7451 3  527.9675 99  71510 303493218      483217        syn-C2H3C(O)NH2, v=0
  358604.2782  0.0200 -3.4690 3  357.4095 83 -71510 303412615      412516        syn-C2H3C(O)NH2, v=0
  358604.2782  0.0200 -3.4690 3  357.4095 83 -71510 303412616      412517        syn-C2H3C(O)NH2, v=0
  358607.9821  0.0596 -5.6268 3 1336.0656193  71510 303962967      953066        syn-C2H3C(O)NH2, v=0
  358619.9622  0.0020 -3.8687 3  734.9224137  71510 303682741      682642        syn-C2H3C(O)NH2, v=0
  358619.9651  0.0020 -3.8687 3  734.9224137  71510 303682742      682643        syn-C2H3C(O)NH2, v=0
  358624.5338  0.0040 -6.3296 3  608.0941127  71510 303632340      642045        syn-C2H3C(O)NH2, v=0
  358720.5560  0.0143 -4.6510 3 1195.0856181  71510 303902961      902862        syn-C2H3C(O)NH2, v=0
  358742.8245  0.0015 -5.6944 3  513.1855 99  71510 303493118      483117        syn-C2H3C(O)NH2, v=0
  358742.8245  0.0015 -5.6944 3  513.1855 99  71510 303493119      483118        syn-C2H3C(O)NH2, v=0
  358762.4053  0.0142 -4.6509 3 1195.0841181  71510 303902962      902863        syn-C2H3C(O)NH2, v=0
  358777.3984  0.0200 -2.9700 3  101.6472 47 -71510 303231410      2213 9        syn-C2H3C(O)NH2, v=0
  358777.3984  0.0200 -2.9700 3  101.6472 47 -71510 3032314 9      221310        syn-C2H3C(O)NH2, v=0
  358822.2645  0.1688 -5.7370 3 1768.0496227  71510 303B32687      B32588        syn-C2H3C(O)NH2, v=0
  358832.9736  0.0200 -3.4726 3  347.3833 81 -71510 303402614      402515        syn-C2H3C(O)NH2, v=0
  358832.9736  0.0200 -3.4726 3  347.3833 81 -71510 303402615      402516        syn-C2H3C(O)NH2, v=0
  358845.9102  0.0019 -5.2121 3   37.1529 35  71510 30317 710      16 413        syn-C2H3C(O)NH2, v=0
  358873.4430  0.0200 -3.0129 3  107.3463 51 -71510 303251313      241212        syn-C2H3C(O)NH2, v=0
  358873.4430  0.0200 -3.0129 3  107.3463 51 -71510 303251312      241213        syn-C2H3C(O)NH2, v=0
  358884.9173  0.0011 -5.1900 3  345.5750 97  71510 303481732      471731        syn-C2H3C(O)NH2, v=0
  358892.5740  0.0011 -5.1900 3  345.5752 97  71510 303481731      471730        syn-C2H3C(O)NH2, v=0
  358902.5987  0.2154 -5.9240 3 1866.5563233  71510 303B62789      B62690        syn-C2H3C(O)NH2, v=0
  358930.5085  0.0011 -5.0849 3  309.3331 97  71510 303481038      471037        syn-C2H3C(O)NH2, v=0
  358969.7642  0.0261 -4.9080 3  957.4077165  71510 303822359      812458        syn-C2H3C(O)NH2, v=0
  358978.7805  0.0014 -5.6460 3  498.8815 99  71510 303493019      483018        syn-C2H3C(O)NH2, v=0
  358978.7805  0.0014 -5.6460 3  498.8815 99  71510 303493020      483019        syn-C2H3C(O)NH2, v=0
  359045.9542  0.0200 -3.4785 3  337.6056 79 -71510 303392613      392514        syn-C2H3C(O)NH2, v=0
  359045.9542  0.0200 -3.4785 3  337.6056 79 -71510 303392614      392515        syn-C2H3C(O)NH2, v=0
  359113.1191  0.0348 -5.1420 3 1083.7177175  71510 303872562      862661        syn-C2H3C(O)NH2, v=0
  359190.6914  0.0692 -5.7148 3 1766.5253223  71510 303B13280      B13181        syn-C2H3C(O)NH2, v=0
  359236.4020  0.0014 -5.5999 3  485.0567 99  71510 303492920      482919        syn-C2H3C(O)NH2, v=0
  359236.4020  0.0014 -5.5999 3  485.0567 99  71510 303492921      482920        syn-C2H3C(O)NH2, v=0
  359243.9662  0.0200 -3.4869 3  328.0763 77 -71510 303382612      382513        syn-C2H3C(O)NH2, v=0
  359243.9662  0.0200 -3.4869 3  328.0763 77 -71510 303382613      382514        syn-C2H3C(O)NH2, v=0
  359326.8560  0.0659 -5.0995 3 1424.7163205  71510 303A22280      A22181        syn-C2H3C(O)NH2, v=0
  359427.8663  0.0200 -3.4983 3  318.7950 75 -71510 303372611      372512        syn-C2H3C(O)NH2, v=0
  359427.8663  0.0200 -3.4983 3  318.7950 75 -71510 303372612      372513        syn-C2H3C(O)NH2, v=0
  359455.0447  0.0056 -4.0410 3  413.2285125  71510 30362 260      62 161        syn-C2H3C(O)NH2, v=0
  359455.0447  0.0056 -4.0410 3  413.2285125  71510 30362 360      62 261        syn-C2H3C(O)NH2, v=0
  359493.5141  0.0200 -3.3530 3  263.0918 89 -71510 303441134      431033        syn-C2H3C(O)NH2, v=0
  359519.1603  0.0013 -5.5558 3  471.7124 99  71510 303492821      482820        syn-C2H3C(O)NH2, v=0
  359519.1603  0.0013 -5.5558 3  471.7124 99  71510 303492822      482821        syn-C2H3C(O)NH2, v=0
  359598.3110  0.0200 -3.5131 3  309.7613 73 -71510 303362610      362511        syn-C2H3C(O)NH2, v=0
  359598.3110  0.0200 -3.5131 3  309.7613 73 -71510 303362611      362512        syn-C2H3C(O)NH2, v=0
  359598.5499  0.0416 -4.8375 3 1277.9736195  71510 303972077      971978        syn-C2H3C(O)NH2, v=0
  359607.7104  0.0019 -3.8415 3  718.0642135  71510 303672740      672641        syn-C2H3C(O)NH2, v=0
  359607.7117  0.0019 -3.8415 3  718.0642135  71510 303672741      672642        syn-C2H3C(O)NH2, v=0
  359629.0194  0.2242 -6.2503 3 2040.6416243  71510 303C13092      C12993        syn-C2H3C(O)NH2, v=0
  359677.6790  0.0413 -4.8373 3 1277.9740195  71510 303972177      972078        syn-C2H3C(O)NH2, v=0
  359691.1850  0.0646 -5.0987 3 1424.7183205  71510 303A22380      A22281        syn-C2H3C(O)NH2, v=0
  359693.0637  0.0027 -6.2000 3  395.0644101  71510 303502031      511734        syn-C2H3C(O)NH2, v=0
  359756.0363  0.0200 -3.5317 3  300.9751 71 -71510 3033526 9      352510        syn-C2H3C(O)NH2, v=0
  359756.0363  0.0200 -3.5317 3  300.9751 71 -71510 303352610      352511        syn-C2H3C(O)NH2, v=0
  359792.3950  0.0200 -3.8968 3  631.7475145 -71510 30372 864      72 765        syn-C2H3C(O)NH2, v=0
  359792.3950  0.0200 -3.8968 3  631.7475145 -71510 30372 964      72 865        syn-C2H3C(O)NH2, v=0
  359800.9257  0.0027 -6.1998 3  395.0608101  71510 303502030      511735        syn-C2H3C(O)NH2, v=0
  359812.3082  0.0059 -4.2510 3  969.1481161  71510 303802852      802753        syn-C2H3C(O)NH2, v=0
  359813.2883  0.0059 -4.2510 3  969.1481161  71510 303802853      802754        syn-C2H3C(O)NH2, v=0
  359831.2495  0.0013 -5.5137 3  458.8504 99  71510 303492722      482721        syn-C2H3C(O)NH2, v=0
  359831.2495  0.0013 -5.5137 3  458.8504 99  71510 303492723      482722        syn-C2H3C(O)NH2, v=0
  359843.5804  0.0203 -4.5037 3 1082.4153181  71510 303901773      901674        syn-C2H3C(O)NH2, v=0
  359848.4394  0.0203 -4.5037 3 1082.4154181  71510 303901873      901774        syn-C2H3C(O)NH2, v=0
  359901.7981  0.0200 -3.5550 3  292.4360 69 -71510 3033426 8      3425 9        syn-C2H3C(O)NH2, v=0
  359901.7981  0.0200 -3.5550 3  292.4360 69 -71510 3033426 9      342510        syn-C2H3C(O)NH2, v=0
  359964.7398  0.0200 -3.2995 3  297.5305 95 -71510 303471137      461036        syn-C2H3C(O)NH2, v=0
  359989.6088  0.0050 -4.4441 3  280.9151 91  71510 303451233      45 936        syn-C2H3C(O)NH2, v=0
  359997.4096  0.0821 -5.6612 3 1738.4284221  71510 303B03278      B03179        syn-C2H3C(O)NH2, v=0
  360036.1775  0.0200 -3.5840 3  284.1439 67 -71510 3033326 7      3325 8        syn-C2H3C(O)NH2, v=0
  360036.1775  0.0200 -3.5840 3  284.1439 67 -71510 3033326 8      3325 9        syn-C2H3C(O)NH2, v=0
  360043.8149  0.0474 -5.3282 3 1562.9973209  71510 303A43173      A43074        syn-C2H3C(O)NH2, v=0
  360086.5999  0.0022 -6.2597 3  275.2766 83  71510 303411824      421527        syn-C2H3C(O)NH2, v=0
  360117.1990  0.0949 -6.0706 3 1953.1134235  71510 303B73385      B73286        syn-C2H3C(O)NH2, v=0
  360119.1264  0.0022 -6.2596 3  275.2755 83  71510 303411823      421528        syn-C2H3C(O)NH2, v=0
  360159.8581  0.0200 -3.6201 3  276.0983 65 -71510 3033226 6      3225 7        syn-C2H3C(O)NH2, v=0
  360159.8581  0.0200 -3.6201 3  276.0983 65 -71510 3033226 7      3225 8        syn-C2H3C(O)NH2, v=0
  360177.7876  0.0012 -5.4736 3  446.4726 99  71510 303492623      482622        syn-C2H3C(O)NH2, v=0
  360177.7876  0.0012 -5.4736 3  446.4726 99  71510 303492624      482623        syn-C2H3C(O)NH2, v=0
  360216.4649  0.0012 -5.0566 3  289.7024 93  71510 303461135      451134        syn-C2H3C(O)NH2, v=0
  360246.0254  0.1195 -5.5524 3 1672.1137221  71510 303B02685      B02586        syn-C2H3C(O)NH2, v=0
  360253.8990  0.0200 -3.4296 3  130.5079 63 -71510 30331 922      30 823        syn-C2H3C(O)NH2, v=0
  360262.0680  0.0053 -5.2683 3  100.2253 57  71510 30328 722      28 425        syn-C2H3C(O)NH2, v=0
  360273.4341  0.0200 -3.6653 3  268.2992 63 -71510 3033126 5      3125 6        syn-C2H3C(O)NH2, v=0
  360273.4341  0.0200 -3.6653 3  268.2992 63 -71510 3033126 6      3125 7        syn-C2H3C(O)NH2, v=0
  360291.5810  0.0055 -4.1022 3  537.8347125  71510 303621646      611745        syn-C2H3C(O)NH2, v=0
  360298.1100  0.0200 -3.2839 3  321.4369 99 -71510 303491039      481138        syn-C2H3C(O)NH2, v=0
  360305.0297  0.0523 -5.5064 3 1276.2979189  71510 303942867      932964        syn-C2H3C(O)NH2, v=0
  360350.6593  0.0014 -5.0711 3  350.0737115  71510 30357 255      56 254        syn-C2H3C(O)NH2, v=0
  360350.6295  0.0200 -2.9073 3  350.0737115 -71510 30357 255      56 354        syn-C2H3C(O)NH2, v=0
  360350.6295  0.0200 -2.9073 3  350.0737115 -71510 30357 355      56 254        syn-C2H3C(O)NH2, v=0
  360350.6593  0.0014 -5.0711 3  350.0737115  71510 30357 355      56 354        syn-C2H3C(O)NH2, v=0
  360356.3601  0.0013 -5.0784 3  348.5178113  71510 30356 353      55 352        syn-C2H3C(O)NH2, v=0
  360356.4324  0.0200 -2.9363 3  348.5178113 -71510 30356 353      55 452        syn-C2H3C(O)NH2, v=0
  360356.4324  0.0200 -2.9363 3  348.5178113 -71510 30356 453      55 352        syn-C2H3C(O)NH2, v=0
  360356.3601  0.0013 -5.0784 3  348.5178113  71510 30356 453      55 452        syn-C2H3C(O)NH2, v=0
  360356.5187  0.0016 -5.0628 3  351.1107117  71510 30358 157      57 156        syn-C2H3C(O)NH2, v=0
  360356.4324  0.0200 -2.8797 3  351.1107117 -71510 30358 157      57 256        syn-C2H3C(O)NH2, v=0
  360356.4324  0.0200 -2.8797 3  351.1107117 -71510 30358 257      57 156        syn-C2H3C(O)NH2, v=0
  360356.5187  0.0016 -5.0628 3  351.1107117  71510 30358 257      57 256        syn-C2H3C(O)NH2, v=0
  360367.0401  0.0019 -5.0535 3  351.6376119  71510 30359 059      58 058        syn-C2H3C(O)NH2, v=0
  360367.0310  0.0200 -2.8531 3  351.6376119 -71510 30359 059      58 158        syn-C2H3C(O)NH2, v=0
  360367.0310  0.0200 -2.8531 3  351.6376119 -71510 30359 159      58 058        syn-C2H3C(O)NH2, v=0
  360367.0401  0.0019 -5.0535 3  351.6376119  71510 30359 159      58 158        syn-C2H3C(O)NH2, v=0
  360377.6611  0.0200 -3.7230 3  260.7461 61 -71510 3033026 4      3025 5        syn-C2H3C(O)NH2, v=0
  360377.6611  0.0200 -3.7230 3  260.7461 61 -71510 3033026 5      3025 6        syn-C2H3C(O)NH2, v=0
  360383.8997  0.0012 -5.0847 3  346.4317111  71510 30355 451      54 450        syn-C2H3C(O)NH2, v=0
  360383.8837  0.0200 -2.9671 3  346.4317111 -71510 30355 451      54 550        syn-C2H3C(O)NH2, v=0
  360383.8837  0.0200 -2.9671 3  346.4317111 -71510 30355 551      54 450        syn-C2H3C(O)NH2, v=0
  360383.8997  0.0012 -5.0847 3  346.4317111  71510 30355 551      54 550        syn-C2H3C(O)NH2, v=0
  360449.0251  0.0200 -3.0004 3  343.8010109 -71510 30354 549      53 648        syn-C2H3C(O)NH2, v=0
  360449.0208  0.0011 -5.0899 3  343.8010109  71510 30354 649      53 648        syn-C2H3C(O)NH2, v=0
  360449.0210  0.0011 -5.0899 3  343.8010109  71510 30354 549      53 548        syn-C2H3C(O)NH2, v=0
  360449.0251  0.0200 -3.0004 3  343.8010109 -71510 30354 649      53 548        syn-C2H3C(O)NH2, v=0
  360462.6856  0.0011 -5.1641 3  338.3127 97  71510 303481633      471632        syn-C2H3C(O)NH2, v=0
  360472.8250  0.0200 -3.7986 3  253.4390 59 -71510 3032926 3      2925 4        syn-C2H3C(O)NH2, v=0
  360472.8250  0.0200 -3.7986 3  253.4390 59 -71510 3032926 4      2925 5        syn-C2H3C(O)NH2, v=0
  360536.2679  0.0011 -5.1639 3  338.3155 97  71510 303481632      471631        syn-C2H3C(O)NH2, v=0
  360545.3434  0.0018 -3.8152 3  701.4657133  71510 303662739      662640        syn-C2H3C(O)NH2, v=0
  360545.3440  0.0018 -3.8152 3  701.4657133  71510 303662740      662641        syn-C2H3C(O)NH2, v=0
  360559.7369  0.0200 -3.9024 3  246.3776 57 -71510 3032826 2      2825 3        syn-C2H3C(O)NH2, v=0
  360559.7369  0.0200 -3.9024 3  246.3776 57 -71510 3032826 3      2825 4        syn-C2H3C(O)NH2, v=0
  360565.0879  0.0012 -5.4352 3  434.5814 99  71510 303492524      482523        syn-C2H3C(O)NH2, v=0
  360565.0879  0.0012 -5.4352 3  434.5814 99  71510 303492525      482524        syn-C2H3C(O)NH2, v=0
  360576.7502  0.0200 -3.0372 3  340.6061107 -71510 30353 647      52 746        syn-C2H3C(O)NH2, v=0
  360576.7660  0.0011 -5.0939 3  340.6061107  71510 30353 747      52 746        syn-C2H3C(O)NH2, v=0
  360576.7749  0.0011 -5.0939 3  340.6061107  71510 30353 647      52 646        syn-C2H3C(O)NH2, v=0
  360576.7502  0.0200 -3.0372 3  340.6061107 -71510 30353 747      52 646        syn-C2H3C(O)NH2, v=0
  360638.7571  0.0020 -4.0574 3  239.5617 55  71510 3032726 1      2725 2        syn-C2H3C(O)NH2, v=0
  360638.7571  0.0020 -4.0574 3  239.5617 55  71510 3032726 2      2725 3        syn-C2H3C(O)NH2, v=0
  360660.4150  0.0200 -3.8617 3  518.4261135 -71510 30367 562      67 463        syn-C2H3C(O)NH2, v=0
  360660.4150  0.0200 -3.8617 3  518.4261135 -71510 30367 662      67 563        syn-C2H3C(O)NH2, v=0
  360710.4953  0.0021 -4.3375 3  232.9910 53  71510 3032626 0      2625 1        syn-C2H3C(O)NH2, v=0
  360710.4953  0.0021 -4.3375 3  232.9910 53  71510 3032626 1      2625 2        syn-C2H3C(O)NH2, v=0
  360741.9563  0.0532 -5.5053 3 1276.2968189  71510 303942866      932965        syn-C2H3C(O)NH2, v=0
  360808.6935  0.0200 -3.0789 3  336.8200105 -71510 30352 745      51 844        syn-C2H3C(O)NH2, v=0
  360809.0685  0.0010 -5.0964 3  336.8200105  71510 30352 845      51 844        syn-C2H3C(O)NH2, v=0
  360809.3625  0.0010 -5.0964 3  336.8199105  71510 30352 745      51 744        syn-C2H3C(O)NH2, v=0
  360809.7342  0.0200 -3.0789 3  336.8199105 -71510 30352 845      51 744        syn-C2H3C(O)NH2, v=0
  360849.5095  0.0257 -4.9712 3 1372.4974195  71510 303973067      972968        syn-C2H3C(O)NH2, v=0
  361001.0388  0.0012 -5.3986 3  423.1797 99  71510 303492425      482424        syn-C2H3C(O)NH2, v=0
  361001.0388  0.0012 -5.3986 3  423.1797 99  71510 303492426      482425        syn-C2H3C(O)NH2, v=0
  361033.4247  0.0038 -3.9367 3  676.8693149  71510 30374 965      74 866        syn-C2H3C(O)NH2, v=0
  361033.4248  0.0038 -3.9367 3  676.8693149  71510 303741065      74 966        syn-C2H3C(O)NH2, v=0
  361054.2339  0.0131 -4.6063 3 1172.4706179  71510 303892960      892861        syn-C2H3C(O)NH2, v=0
  361078.1322  0.0130 -4.6063 3 1172.4697179  71510 303892961      892862        syn-C2H3C(O)NH2, v=0
  361087.4852  0.0252 -4.9707 3 1372.4883195  71510 303973068      972969        syn-C2H3C(O)NH2, v=0
  361204.0388  0.0431 -5.3255 3 1562.9516209  71510 303A43174      A43075        syn-C2H3C(O)NH2, v=0
  361210.3976  0.0200 -3.1281 3  332.4033103 -71510 30351 843      50 942        syn-C2H3C(O)NH2, v=0
  361219.4320  0.0010 -5.0971 3  332.4033103  71510 30351 943      50 942        syn-C2H3C(O)NH2, v=0
  361226.5829  0.0010 -5.0971 3  332.4028103  71510 30351 843      50 842        syn-C2H3C(O)NH2, v=0
  361235.5965  0.0200 -3.1280 3  332.4028103 -71510 30351 943      50 842        syn-C2H3C(O)NH2, v=0
  361297.4825  0.0162 -4.4131 3 1027.4635177  71510 303881672      881573        syn-C2H3C(O)NH2, v=0
  361298.9603  0.0162 -4.4131 3 1027.4635177  71510 303881772      881673        syn-C2H3C(O)NH2, v=0
  361309.2197  0.0051 -5.8469 3   32.1003 35  71510 30317 512      16 215        syn-C2H3C(O)NH2, v=0
  361391.5235  0.0021 -6.2288 3   22.0836 25  71510 30312 8 5      11 5 6        syn-C2H3C(O)NH2, v=0
  361408.2031  0.0054 -4.2143 3  949.1742159  71510 303792851      792752        syn-C2H3C(O)NH2, v=0
  361408.7191  0.0054 -4.2143 3  949.1742159  71510 303792852      792753        syn-C2H3C(O)NH2, v=0
  361435.3558  0.0200 -3.7897 3  685.1263131 -71510 303652738      652639        syn-C2H3C(O)NH2, v=0
  361435.3558  0.0200 -3.7897 3  685.1263131 -71510 303652739      652640        syn-C2H3C(O)NH2, v=0
  361495.6452  0.0012 -5.3637 3  412.2711 99  71510 303492326      482325        syn-C2H3C(O)NH2, v=0
  361495.6452  0.0012 -5.3637 3  412.2711 99  71510 303492327      482326        syn-C2H3C(O)NH2, v=0
  361704.4813  0.0065 -4.2173 3  592.7563131  71510 303651748      641847        syn-C2H3C(O)NH2, v=0
  361717.9120  0.0021 -6.2284 3   22.0728 25  71510 30312 8 4      11 5 7        syn-C2H3C(O)NH2, v=0
  361738.2744  0.0200 -3.1901 3  327.2975101 -71510 30350 941      491040        syn-C2H3C(O)NH2, v=0
  361802.7000  0.0037 -5.0818 3   44.4504 43  71510 30321 219      20 120        syn-C2H3C(O)NH2, v=0
  361860.7986  0.0036 -5.0817 3   44.4504 43  71510 30321 319      20 020        syn-C2H3C(O)NH2, v=0
  361915.6926  0.0011 -5.0956 3  327.2975101  71510 303501041      491040        syn-C2H3C(O)NH2, v=0
  362009.0890  0.0200 -3.9852 3  723.2469153 -71510 303761066      76 967        syn-C2H3C(O)NH2, v=0
  362009.0890  0.0200 -3.9852 3  723.2469153 -71510 303761166      761067        syn-C2H3C(O)NH2, v=0
  362018.1277  0.0034 -4.3149 3  351.4617101  71510 303501436      501139        syn-C2H3C(O)NH2, v=0
  362040.8881  0.0011 -5.0953 3  327.2874101  71510 30350 941      49 940        syn-C2H3C(O)NH2, v=0
  362061.8234  0.0012 -5.3304 3  401.8600 99  71510 303492228      482227        syn-C2H3C(O)NH2, v=0
  362061.8235  0.0012 -5.3304 3  401.8600 99  71510 303492227      482226        syn-C2H3C(O)NH2, v=0
  362071.6988  0.0032 -6.0348 3   59.8241 43  71510 30321 813      21 318        syn-C2H3C(O)NH2, v=0
  362081.7699  0.0200 -3.9401 3  451.8799129 -71510 30364 361      64 262        syn-C2H3C(O)NH2, v=0
  362081.7699  0.0200 -3.9401 3  451.8799129 -71510 30364 461      64 362        syn-C2H3C(O)NH2, v=0
  362189.9642  0.0011 -5.0908 3  314.8990 97  71510 303481237      471236        syn-C2H3C(O)NH2, v=0
  362218.3322  0.0200 -3.1889 3  327.2874101 -71510 303501041      49 940        syn-C2H3C(O)NH2, v=0
  362279.9908  0.0200 -3.7651 3  669.0454129 -71510 303642737      642638        syn-C2H3C(O)NH2, v=0
  362279.9908  0.0200 -3.7651 3  669.0454129 -71510 303642738      642639        syn-C2H3C(O)NH2, v=0
  362285.8778  0.0839 -5.2574 3 1513.7757211  71510 303A52382      A52283        syn-C2H3C(O)NH2, v=0
  362314.4940  0.0129 -4.3277 3  973.7111173  71510 303861571      861472        syn-C2H3C(O)NH2, v=0
  362314.9213  0.0129 -4.3277 3  973.7111173  71510 303861671      861572        syn-C2H3C(O)NH2, v=0
  362391.5795  0.0035 -5.2789 3   38.7210 37  71510 30318 612      17 315        syn-C2H3C(O)NH2, v=0
  362391.7840  0.0011 -5.1391 3  331.6517 97  71510 303481534      471533        syn-C2H3C(O)NH2, v=0
  362401.0022  0.0025 -3.3666 3  251.9405 87  71510 303431133      421032        syn-C2H3C(O)NH2, v=0
  362416.7394  0.1453 -5.7287 3 1768.0742227  71510 303B32787      B32688        syn-C2H3C(O)NH2, v=0
  362451.5369  0.0460 -5.3888 3 1217.9771185  71510 303922766      912863        syn-C2H3C(O)NH2, v=0
  362507.4773  0.0336 -4.7312 3 1218.8615191  71510 303951976      951877        syn-C2H3C(O)NH2, v=0
  362534.7732  0.0336 -4.7311 3 1218.8617191  71510 303952076      951977        syn-C2H3C(O)NH2, v=0
  362608.8143  0.0084 -4.3314 3  650.3377137  71510 303681850      671949        syn-C2H3C(O)NH2, v=0
  362620.4565  0.0460 -5.3044 3 1056.8142175  71510 303872266      862363        syn-C2H3C(O)NH2, v=0
  362645.5592  0.0200 -3.8657 3  560.3437139 -71510 30369 663      69 564        syn-C2H3C(O)NH2, v=0
  362645.5592  0.0200 -3.8657 3  560.3437139 -71510 30369 763      69 664        syn-C2H3C(O)NH2, v=0
  362667.0200  0.0070 -4.2814 3  388.3044123  71510 30361 160      61 061        syn-C2H3C(O)NH2, v=0
  362667.0200  0.0070 -4.2814 3  388.3044123  71510 30361 260      61 161        syn-C2H3C(O)NH2, v=0
  362674.0364  0.0012 -5.0588 3  292.9230 93  71510 303461234      451233        syn-C2H3C(O)NH2, v=0
  362705.0867  0.0055 -4.0411 3  770.8730157  71510 303781167      781068        syn-C2H3C(O)NH2, v=0
  362705.0884  0.0055 -4.0411 3  770.8730157  71510 303781267      781168        syn-C2H3C(O)NH2, v=0
  362716.6147  0.0011 -5.2985 3  391.9522 99  71510 303492129      482128        syn-C2H3C(O)NH2, v=0
  362716.6151  0.0011 -5.2985 3  391.9522 99  71510 303492128      482127        syn-C2H3C(O)NH2, v=0
  362772.6646  0.0011 -5.0920 3  321.4369 99  71510 303491139      481138        syn-C2H3C(O)NH2, v=0
  362858.4873  0.0035 -4.5573 3  230.2171 81  71510 303401327      401030        syn-C2H3C(O)NH2, v=0
  362862.1622  0.0200 -3.2827 3  309.3331 97 -71510 303481138      471037        syn-C2H3C(O)NH2, v=0
  362881.7542  0.0813 -5.2561 3 1513.7790211  71510 303A52482      A52383        syn-C2H3C(O)NH2, v=0
  362884.3591  0.1123 -6.2994 3 1682.9323215  71510 303A73474      A63571        syn-C2H3C(O)NH2, v=0
  362886.7856  0.1123 -6.2994 3 1682.9323215  71510 303A73473      A63572        syn-C2H3C(O)NH2, v=0
  362923.1544  0.0049 -4.1785 3  929.4670157  71510 303782850      782751        syn-C2H3C(O)NH2, v=0
  362923.4226  0.0049 -4.1785 3  929.4670157  71510 303782851      782752        syn-C2H3C(O)NH2, v=0
  362934.1119  0.0103 -4.2475 3  921.1674169  71510 303841470      841371        syn-C2H3C(O)NH2, v=0
  362934.2291  0.0103 -4.2475 3  921.1674169  71510 303841570      841471        syn-C2H3C(O)NH2, v=0
  362959.4294  0.0011 -5.1378 3  331.6769 97  71510 303481533      471532        syn-C2H3C(O)NH2, v=0
  363045.9557  0.1253 -5.9539 3 1893.9685231  71510 303B53382      B53283        syn-C2H3C(O)NH2, v=0
  363081.4739  0.0200 -3.7414 3  653.2223127 -71510 303632736      632637        syn-C2H3C(O)NH2, v=0
  363081.4739  0.0200 -3.7414 3  653.2223127 -71510 303632737      632638        syn-C2H3C(O)NH2, v=0
  363104.6711  0.0067 -4.1038 3  819.7403161  71510 303801268      801169        syn-C2H3C(O)NH2, v=0
  363104.6785  0.0067 -4.1038 3  819.7403161  71510 303801368      801269        syn-C2H3C(O)NH2, v=0
  363119.7814  0.0200 -3.1444 3  130.8244 61 -71510 303301120      291019        syn-C2H3C(O)NH2, v=0
  363150.4910  0.0650 -5.6537 3 1738.3017221  71510 303B03279      B03180        syn-C2H3C(O)NH2, v=0
  363154.2387  0.0048 -5.0534 3  118.3943 61  71510 30330 823      30 526        syn-C2H3C(O)NH2, v=0
  363188.5620  0.0083 -4.1728 3  869.8411165  71510 303821369      821270        syn-C2H3C(O)NH2, v=0
  363188.5924  0.0083 -4.1728 3  869.8411165  71510 303821469      821370        syn-C2H3C(O)NH2, v=0
  363257.2719  0.0120 -4.5626 3 1150.1304177  71510 303882959      882860        syn-C2H3C(O)NH2, v=0
  363270.7623  0.0120 -4.5626 3 1150.1299177  71510 303882960      882861        syn-C2H3C(O)NH2, v=0
  363374.8085  0.0027 -4.3941 3  301.7179 93  71510 303461432      461135        syn-C2H3C(O)NH2, v=0
  363479.4614  0.0537 -4.9824 3 1362.6707201  71510 303A02179      A02080        syn-C2H3C(O)NH2, v=0
  363483.1142  0.0011 -5.2682 3  382.5550 99  71510 303492030      482029        syn-C2H3C(O)NH2, v=0
  363483.1212  0.0011 -5.2682 3  382.5550 99  71510 303492029      482028        syn-C2H3C(O)NH2, v=0
  363515.9572  0.0477 -5.3862 3 1217.9744185  71510 303922765      912864        syn-C2H3C(O)NH2, v=0
  363603.3196  0.0113 -4.4448 3  710.5804143  71510 303711952      702051        syn-C2H3C(O)NH2, v=0
  363614.7675  0.0532 -4.9821 3 1362.6714201  71510 303A02279      A02180        syn-C2H3C(O)NH2, v=0
  363741.9997  0.0038 -4.7743 3  168.3537 69  71510 303341222      34 925        syn-C2H3C(O)NH2, v=0
  363753.5201  0.0048 -3.9934 3   85.4868 53  71510 30326 620      25 521        syn-C2H3C(O)NH2, v=0
  363778.0257  0.1009 -6.1630 3 1615.5081211  71510 303A53373      A43470        syn-C2H3C(O)NH2, v=0
  363784.5897  0.1010 -6.1630 3 1615.5081211  71510 303A53372      A43471        syn-C2H3C(O)NH2, v=0
  363798.1489  0.0234 -4.9209 3 1348.0275193  71510 303963066      962967        syn-C2H3C(O)NH2, v=0
  363841.7977  0.0200 -3.7185 3  637.6565125 -71510 303622735      622636        syn-C2H3C(O)NH2, v=0
  363841.7977  0.0200 -3.7185 3  637.6565125 -71510 303622736      622637        syn-C2H3C(O)NH2, v=0
  363938.0786  0.0422 -5.2715 3 1536.6426207  71510 303A33172      A33073        syn-C2H3C(O)NH2, v=0
  363939.9488  0.0231 -4.9206 3 1348.0220193  71510 303963067      962968        syn-C2H3C(O)NH2, v=0
  363957.8976  0.0051 -6.2499 3   56.5188 43  71510 30321 714      21 219        syn-C2H3C(O)NH2, v=0
  363985.2119  0.0200 -3.1427 3  130.8001 61 -71510 303301119      291020        syn-C2H3C(O)NH2, v=0
  364165.2339  0.0030 -6.2195 3  456.2613109  71510 303542134      551837        syn-C2H3C(O)NH2, v=0
  364184.4053  0.0920 -6.0057 3 1923.2903233  71510 303B63384      B63285        syn-C2H3C(O)NH2, v=0
  364229.7431  0.0011 -5.0882 3  321.3057 99  71510 303491039      481038        syn-C2H3C(O)NH2, v=0
  364282.8700  0.0011 -5.1161 3  325.6123 97  71510 303481435      471434        syn-C2H3C(O)NH2, v=0
  364300.7913  0.0030 -6.2192 3  456.2567109  71510 303542133      551838        syn-C2H3C(O)NH2, v=0
  364351.2412  0.1744 -5.9115 3 1866.5957233  71510 303B62889      B62790        syn-C2H3C(O)NH2, v=0
  364362.0072  0.0045 -4.1436 3  910.0258155  71510 303772849      772750        syn-C2H3C(O)NH2, v=0
  364362.1449  0.0045 -4.1436 3  910.0258155  71510 303772850      772751        syn-C2H3C(O)NH2, v=0
  364393.6948  0.0011 -5.2391 3  373.6784 99  71510 303491931      481930        syn-C2H3C(O)NH2, v=0
  364393.7995  0.0011 -5.2391 3  373.6784 99  71510 303491930      481929        syn-C2H3C(O)NH2, v=0
  364403.4099  0.0200 -3.8849 3  603.5381143 -71510 30371 764      71 665        syn-C2H3C(O)NH2, v=0
  364403.4099  0.0200 -3.8849 3  603.5381143 -71510 30371 864      71 765        syn-C2H3C(O)NH2, v=0
  364458.3480  0.0040 -6.3119 3  694.2907101  71510 3035041 9      4941 8        syn-C2H3C(O)NH2, v=0
  364458.3480  0.0040 -6.3119 3  694.2907101  71510 303504110      4941 9        syn-C2H3C(O)NH2, v=0
  364506.5526  0.0040 -3.8935 3  491.8282133  71510 30366 462      66 363        syn-C2H3C(O)NH2, v=0
  364506.5526  0.0040 -3.8935 3  491.8282133  71510 30366 562      66 463        syn-C2H3C(O)NH2, v=0
  364534.2901  0.0171 -4.9120 3  948.3928165  71510 303822261      812358        syn-C2H3C(O)NH2, v=0
  364562.9301  0.0200 -3.6965 3  622.3474123 -71510 303612734      612635        syn-C2H3C(O)NH2, v=0
  364562.9301  0.0200 -3.6965 3  622.3474123 -71510 303612735      612636        syn-C2H3C(O)NH2, v=0
  364566.3815  0.0039 -4.3484 3   61.4762 47  71510 30323 419      22 320        syn-C2H3C(O)NH2, v=0
  364589.0642  0.0036 -6.2310 3  675.2456101  71510 303504010      4940 9        syn-C2H3C(O)NH2, v=0
  364589.0642  0.0036 -6.2310 3  675.2456101  71510 303504011      494010        syn-C2H3C(O)NH2, v=0
  364614.5025  0.1922 -6.2650 3 2056.2784241  71510 303C03486      C03387        syn-C2H3C(O)NH2, v=0
  364659.2713  0.0397 -5.2698 3 1536.6143207  71510 303A33173      A33074        syn-C2H3C(O)NH2, v=0
  364726.1990  0.0032 -6.1554 3  656.6727101  71510 303503911      493910        syn-C2H3C(O)NH2, v=0
  364726.1990  0.0032 -6.1554 3  656.6727101  71510 303503912      493911        syn-C2H3C(O)NH2, v=0
  364757.1709  0.0011 -5.0987 3  320.1207 97  71510 303481336      471335        syn-C2H3C(O)NH2, v=0
  364786.5555  0.0400 -5.2750 3 1161.1090181  71510 303902665      892762        syn-C2H3C(O)NH2, v=0
  364806.8787  0.1062 -5.4226 3 1605.4160217  71510 303A82484      A82385        syn-C2H3C(O)NH2, v=0
  364818.5197  0.0272 -4.6298 3 1160.9203187  71510 303931875      931776        syn-C2H3C(O)NH2, v=0
  364827.5115  0.0271 -4.6298 3 1160.9204187  71510 303931975      931876        syn-C2H3C(O)NH2, v=0
  364857.1437  0.0906 -6.0295 3 1549.5163207  71510 303A33272      A23369        syn-C2H3C(O)NH2, v=0
  364870.5496  0.0028 -6.0845 3  638.5724101  71510 303503812      493811        syn-C2H3C(O)NH2, v=0
  364870.5496  0.0028 -6.0845 3  638.5724101  71510 303503813      493812        syn-C2H3C(O)NH2, v=0
  364874.6263  0.0906 -6.0294 3 1549.5162207  71510 303A33271      A23370        syn-C2H3C(O)NH2, v=0
  364935.9574  0.0200 -2.8601 3   97.7148 37 -71510 3031817 1      1716 2        syn-C2H3C(O)NH2, v=0
  364935.9574  0.0200 -2.8601 3   97.7148 37 -71510 3031817 2      1716 1        syn-C2H3C(O)NH2, v=0
  364943.0039  0.0037 -4.6235 3   52.8249 45  71510 30322 319      21 220        syn-C2H3C(O)NH2, v=0
  364990.0835  0.0709 -5.5984 3 1710.4477219  71510 303A93277      A93178        syn-C2H3C(O)NH2, v=0
  365000.3214  0.1559 -5.9268 3 1309.8762195  71510 303972474      962571        syn-C2H3C(O)NH2, v=0
  365023.0258  0.0025 -6.0176 3  620.9451101  71510 303503713      493712        syn-C2H3C(O)NH2, v=0
  365023.0258  0.0025 -6.0176 3  620.9451101  71510 303503714      493713        syn-C2H3C(O)NH2, v=0
  365033.3765  0.0021 -4.0906 3   73.6368 49  71510 30324 718      23 419        syn-C2H3C(O)NH2, v=0
  365177.0655  0.0152 -4.5581 3  773.4852149  71510 303742054      732153        syn-C2H3C(O)NH2, v=0
  365184.6695  0.0022 -5.9544 3  603.7915101  71510 303503614      493613        syn-C2H3C(O)NH2, v=0
  365184.6695  0.0022 -5.9544 3  603.7915101  71510 303503615      493614        syn-C2H3C(O)NH2, v=0
  365198.3802  0.0200 -3.3941 3  339.2800101 -71510 303501139      491238        syn-C2H3C(O)NH2, v=0
  365246.6277  0.0200 -3.6754 3  607.2946121 -71510 303602733      602634        syn-C2H3C(O)NH2, v=0
  365246.6277  0.0200 -3.6754 3  607.2946121 -71510 303602734      602635        syn-C2H3C(O)NH2, v=0
  365340.7747  0.0110 -4.5199 3 1128.0636175  71510 303872958      872859        syn-C2H3C(O)NH2, v=0
  365348.3025  0.0110 -4.5198 3 1128.0634175  71510 303872959      872860        syn-C2H3C(O)NH2, v=0
  365356.6792  0.0020 -5.8943 3  587.1122101  71510 303503515      493514        syn-C2H3C(O)NH2, v=0
  365356.6792  0.0020 -5.8943 3  587.1122101  71510 303503516      493515        syn-C2H3C(O)NH2, v=0
  365358.5489  0.0200 -2.8921 3   99.4195 41 -71510 3032016 4      1915 5        syn-C2H3C(O)NH2, v=0
  365358.5489  0.0200 -2.8921 3   99.4195 41 -71510 3032016 5      1915 4        syn-C2H3C(O)NH2, v=0
  365452.4371  0.0200 -3.0649 3  121.3074 57 -71510 303281217      271116        syn-C2H3C(O)NH2, v=0
  365465.2075  0.0036 -4.6226 3   52.8248 45  71510 30322 419      21 120        syn-C2H3C(O)NH2, v=0
  365468.3788  0.0200 -3.0648 3  121.3069 57 -71510 303281216      271117        syn-C2H3C(O)NH2, v=0
  365491.3166  0.0060 -4.0539 3  426.2570127  71510 30363 261      63 162        syn-C2H3C(O)NH2, v=0
  365491.3166  0.0060 -4.0539 3  426.2570127  71510 30363 361      63 262        syn-C2H3C(O)NH2, v=0
  365495.4861  0.0011 -5.2114 3  365.3358 99  71510 303491832      481831        syn-C2H3C(O)NH2, v=0
  365496.8311  0.0011 -5.2114 3  365.3358 99  71510 303491831      481830        syn-C2H3C(O)NH2, v=0
  365503.1797  0.0012 -5.0820 3  308.7985 95  71510 303471334      461333        syn-C2H3C(O)NH2, v=0
  365540.4401  0.0018 -5.8373 3  570.9077101  71510 303503416      493415        syn-C2H3C(O)NH2, v=0
  365540.4401  0.0018 -5.8373 3  570.9077101  71510 303503417      493416        syn-C2H3C(O)NH2, v=0
  365595.6561  0.0326 -5.0273 3 1030.2160171  71510 303852461      842560        syn-C2H3C(O)NH2, v=0
  365628.4017  0.0012 -5.0605 3  301.7179 95  71510 303471136      461135        syn-C2H3C(O)NH2, v=0
  365729.1619  0.0041 -4.1095 3  890.8494153  71510 303762848      762749        syn-C2H3C(O)NH2, v=0
  365729.2317  0.0041 -4.1095 3  890.8494153  71510 303762849      762750        syn-C2H3C(O)NH2, v=0
  365735.6962  0.0200 -2.9261 3  102.6031 45 -71510 3032215 7      2114 8        syn-C2H3C(O)NH2, v=0
  365735.6962  0.0200 -2.9261 3  102.6031 45 -71510 3032215 8      2114 7        syn-C2H3C(O)NH2, v=0
  365737.5604  0.0017 -5.7829 3  555.1789101  71510 303503317      493316        syn-C2H3C(O)NH2, v=0
  365737.5604  0.0017 -5.7829 3  555.1789101  71510 303503318      493317        syn-C2H3C(O)NH2, v=0
  365765.9747  0.1013 -5.4204 3 1605.4216217  71510 303A82584      A82485        syn-C2H3C(O)NH2, v=0
  365894.5740  0.0200 -3.6552 3  592.4974119 -71510 303592732      592633        syn-C2H3C(O)NH2, v=0
  365894.5740  0.0200 -3.6552 3  592.4974119 -71510 303592733      592634        syn-C2H3C(O)NH2, v=0
  365924.6611  0.0036 -3.9161 3  648.0028147  71510 30373 865      73 766        syn-C2H3C(O)NH2, v=0
  365924.6611  0.0036 -3.9161 3  648.0028147  71510 30373 965      73 866        syn-C2H3C(O)NH2, v=0
  365949.9180  0.0016 -5.7311 3  539.9267101  71510 303503218      493217        syn-C2H3C(O)NH2, v=0
  365949.9180  0.0016 -5.7311 3  539.9267101  71510 303503219      493218        syn-C2H3C(O)NH2, v=0
  365999.7164  0.0010 -2.9640 3  107.2861 49  71510 303241411      231310        syn-C2H3C(O)NH2, v=0
  365999.7168  0.0010 -2.9640 3  107.2861 49  71510 303241410      231311        syn-C2H3C(O)NH2, v=0
  366010.5384  0.0200 -3.0087 3  113.5017 53 -71510 303261314      251213        syn-C2H3C(O)NH2, v=0
  366010.5384  0.0200 -3.0087 3  113.5017 53 -71510 303261313      251214        syn-C2H3C(O)NH2, v=0
  366042.2022  0.0024 -6.2217 3  326.5592 91  71510 303451927      461630        syn-C2H3C(O)NH2, v=0
  366060.8019  0.0047 -4.3850 3  321.3057 97  71510 303481335      481038        syn-C2H3C(O)NH2, v=0
  366086.0622  0.0024 -6.2216 3  326.5577 91  71510 303451926      461631        syn-C2H3C(O)NH2, v=0
  366099.6143  0.2065 -6.1006 3 1967.6719239  71510 303B92991      B92892        syn-C2H3C(O)NH2, v=0
  366151.9363  0.0811 -5.8987 3 1484.9594203  71510 303A13171      A03268        syn-C2H3C(O)NH2, v=0
  366163.6677  0.0031 -5.1183 3  109.0935 55  71510 303271116      27 819        syn-C2H3C(O)NH2, v=0
  366171.5670  0.0066 -4.9235 3  153.6039 69  71510 30334 826      34 529        syn-C2H3C(O)NH2, v=0
  366179.7179  0.0015 -5.6816 3  525.1519101  71510 303503119      493118        syn-C2H3C(O)NH2, v=0
  366179.7179  0.0015 -5.6816 3  525.1519101  71510 303503120      493119        syn-C2H3C(O)NH2, v=0
  366197.7159  0.0813 -5.8986 3 1484.9593203  71510 303A13170      A03269        syn-C2H3C(O)NH2, v=0
  366324.7904  0.0031 -4.7705 3  150.2305 67  71510 303331024      33 727        syn-C2H3C(O)NH2, v=0
  366396.9569  0.0014 -5.0742 3  362.0937117  71510 30358 256      57 255        syn-C2H3C(O)NH2, v=0
  366396.9627  0.0200 -2.9096 3  362.0937117 -71510 30358 256      57 355        syn-C2H3C(O)NH2, v=0
  366396.9627  0.0200 -2.9096 3  362.0937117 -71510 30358 356      57 255        syn-C2H3C(O)NH2, v=0
  366396.9569  0.0014 -5.0742 3  362.0937117  71510 30358 356      57 355        syn-C2H3C(O)NH2, v=0
  366401.6778  0.0013 -5.0814 3  360.5380115  71510 30357 354      56 353        syn-C2H3C(O)NH2, v=0
  366401.6605  0.0200 -2.9379 3  360.5380115 -71510 30357 354      56 453        syn-C2H3C(O)NH2, v=0
  366401.6605  0.0200 -2.9379 3  360.5380115 -71510 30357 454      56 353        syn-C2H3C(O)NH2, v=0
  366401.6778  0.0013 -5.0814 3  360.5380115  71510 30357 454      56 453        syn-C2H3C(O)NH2, v=0
  366403.1958  0.0016 -5.0661 3  363.1309119  71510 30359 158      58 157        syn-C2H3C(O)NH2, v=0
  366403.1852  0.0200 -2.8825 3  363.1309119 -71510 30359 158      58 257        syn-C2H3C(O)NH2, v=0
  366403.1852  0.0200 -2.8825 3  363.1309119 -71510 30359 258      58 157        syn-C2H3C(O)NH2, v=0
  366403.1958  0.0016 -5.0661 3  363.1309119  71510 30359 258      58 257        syn-C2H3C(O)NH2, v=0
  366413.8095  0.0020 -5.0570 3  363.6582121  71510 30360 060      59 059        syn-C2H3C(O)NH2, v=0
  366413.7999  0.0200 -2.8564 3  363.6582121 -71510 30360 060      59 159        syn-C2H3C(O)NH2, v=0
  366413.7999  0.0200 -2.8564 3  363.6582121 -71510 30360 160      59 059        syn-C2H3C(O)NH2, v=0
  366413.8095  0.0020 -5.0570 3  363.6582121  71510 30360 160      59 159        syn-C2H3C(O)NH2, v=0
  366427.0920  0.0012 -5.0875 3  358.4528113  71510 30356 452      55 451        syn-C2H3C(O)NH2, v=0
  366427.0666  0.0200 -2.9679 3  358.4528113 -71510 30356 452      55 551        syn-C2H3C(O)NH2, v=0
  366427.0666  0.0200 -2.9679 3  358.4528113 -71510 30356 552      55 451        syn-C2H3C(O)NH2, v=0
  366427.0920  0.0012 -5.0875 3  358.4528113  71510 30356 552      55 551        syn-C2H3C(O)NH2, v=0
  366429.5662  0.0014 -5.6344 3  510.8557101  71510 303503020      493019        syn-C2H3C(O)NH2, v=0
  366429.5662  0.0014 -5.6344 3  510.8557101  71510 303503021      493020        syn-C2H3C(O)NH2, v=0
  366487.9688  0.0200 -3.0003 3  355.8243111 -71510 30355 550      54 649        syn-C2H3C(O)NH2, v=0
  366487.9676  0.0012 -5.0925 3  355.8243111  71510 30355 650      54 649        syn-C2H3C(O)NH2, v=0
  366487.9677  0.0012 -5.0925 3  355.8243111  71510 30355 550      54 549        syn-C2H3C(O)NH2, v=0
  366487.9688  0.0200 -3.0003 3  355.8243111 -71510 30355 650      54 549        syn-C2H3C(O)NH2, v=0
  366508.5275  0.0015 -3.6360 3  577.9555117  71510 303582731      582632        syn-C2H3C(O)NH2, v=0
  366508.5275  0.0015 -3.6360 3  577.9555117  71510 303582732      582633        syn-C2H3C(O)NH2, v=0
  366514.1144  0.0028 -3.3739 3  240.9746 85  71510 303421132      411031        syn-C2H3C(O)NH2, v=0
  366557.7699  0.0213 -4.8717 3 1323.8389191  71510 303953065      952966        syn-C2H3C(O)NH2, v=0
  366607.5404  0.0200 -3.0358 3  352.6336109 -71510 30354 648      53 747        syn-C2H3C(O)NH2, v=0
  366607.5287  0.0011 -5.0963 3  352.6336109  71510 30354 748      53 747        syn-C2H3C(O)NH2, v=0
  366607.5334  0.0011 -5.0963 3  352.6336109  71510 30354 648      53 647        syn-C2H3C(O)NH2, v=0
  366607.5404  0.0200 -3.0358 3  352.6336109 -71510 30354 748      53 647        syn-C2H3C(O)NH2, v=0
  366610.1056  0.0219 -4.5333 3 1104.1610183  71510 303911774      911675        syn-C2H3C(O)NH2, v=0
  366612.9319  0.0219 -4.5333 3 1104.1610183  71510 303911874      911775        syn-C2H3C(O)NH2, v=0
  366641.2928  0.0212 -4.8715 3 1323.8358191  71510 303953066      952967        syn-C2H3C(O)NH2, v=0
  366702.5647  0.0013 -5.5893 3  497.0395101  71510 303502921      492920        syn-C2H3C(O)NH2, v=0
  366702.5647  0.0013 -5.5893 3  497.0395101  71510 303502922      492921        syn-C2H3C(O)NH2, v=0
  366704.3376  0.0200 -3.2675 3  321.3057 99 -71510 303491139      481038        syn-C2H3C(O)NH2, v=0
  366723.2926  0.0035 -3.8779 3  533.0668137  71510 30368 563      68 464        syn-C2H3C(O)NH2, v=0
  366723.2926  0.0035 -3.8779 3  533.0668137  71510 30368 663      68 564        syn-C2H3C(O)NH2, v=0
  366823.9452  0.0011 -3.0759 3  348.8553107  71510 30353 746      52 845        syn-C2H3C(O)NH2, v=0
  366824.1251  0.0011 -5.0987 3  348.8553107  71510 30353 846      52 845        syn-C2H3C(O)NH2, v=0
  366824.2833  0.0011 -5.0987 3  348.8552107  71510 30353 746      52 745        syn-C2H3C(O)NH2, v=0
  366824.4632  0.0011 -3.0759 3  348.8552107  71510 30353 846      52 745        syn-C2H3C(O)NH2, v=0
  366827.9582  0.1338 -5.5950 3 1699.6302223  71510 303B12586      B12487        syn-C2H3C(O)NH2, v=0
  366834.1390  0.0438 -4.8705 3 1301.7744197  71510 303982078      981979        syn-C2H3C(O)NH2, v=0
  366857.8766  0.0011 -5.1847 3  357.5461 99  71510 303491733      481732        syn-C2H3C(O)NH2, v=0
  366868.3542  0.0047 -3.8260 3  101.8325 57  71510 30328 721      27 622        syn-C2H3C(O)NH2, v=0
  366872.5203  0.0011 -5.1846 3  357.5466 99  71510 303491732      481731        syn-C2H3C(O)NH2, v=0
  366882.1655  0.0436 -4.8703 3 1301.7747197  71510 303982178      982079        syn-C2H3C(O)NH2, v=0
  366995.5342  0.0031 -3.6836 3  402.4502109  71510 303541341      531440        syn-C2H3C(O)NH2, v=0
  367001.1148  0.0881 -5.5986 3 1179.8972185  71510 303922370      912467        syn-C2H3C(O)NH2, v=0
  367002.4341  0.0013 -5.5461 3  483.7047101  71510 303502822      492821        syn-C2H3C(O)NH2, v=0
  367002.4341  0.0013 -5.5461 3  483.7047101  71510 303502823      492822        syn-C2H3C(O)NH2, v=0
  367012.6167  0.0605 -5.5936 3 1710.3671219  71510 303A93278      A93179        syn-C2H3C(O)NH2, v=0
  367028.6363  0.0038 -4.0762 3  871.9373151  71510 303752847      752748        syn-C2H3C(O)NH2, v=0
  367028.6712  0.0038 -4.0762 3  871.9373151  71510 303752848      752749        syn-C2H3C(O)NH2, v=0
  367031.2906  0.0685 -5.1346 3 1449.9630207  71510 303A32281      A32182        syn-C2H3C(O)NH2, v=0
  367051.4811  0.0341 -5.1662 3 1105.7011177  71510 303882564      872661        syn-C2H3C(O)NH2, v=0
  367089.8904  0.0200 -3.6177 3  563.6682115 -71510 303572730      572631        syn-C2H3C(O)NH2, v=0
  367089.8904  0.0200 -3.6177 3  563.6682115 -71510 303572731      572632        syn-C2H3C(O)NH2, v=0
  367198.9143  0.0042 -3.9573 3  693.7308151  71510 30375 966      75 867        syn-C2H3C(O)NH2, v=0
  367198.9143  0.0042 -3.9573 3  693.7308151  71510 303751066      75 967        syn-C2H3C(O)NH2, v=0
  367199.5224  0.0200 -3.1228 3  344.4523105 -71510 30352 844      51 943        syn-C2H3C(O)NH2, v=0
  367204.4736  0.0011 -5.0994 3  344.4523105  71510 30352 944      51 943        syn-C2H3C(O)NH2, v=0
  367208.4924  0.0011 -5.0994 3  344.4520105  71510 30352 844      51 843        syn-C2H3C(O)NH2, v=0
  367213.4714  0.0200 -3.1228 3  344.4520105 -71510 30352 944      51 843        syn-C2H3C(O)NH2, v=0
  367224.8929  0.0200 -3.2641 3  333.5377101 -71510 303501040      491139        syn-C2H3C(O)NH2, v=0
  367256.3070  0.0012 -3.2732 3  142.0310 65  71510 303321022      31 923        syn-C2H3C(O)NH2, v=0
  367258.7109  0.0676 -5.1341 3 1449.9642207  71510 303A32381      A32282        syn-C2H3C(O)NH2, v=0
  367305.2582  0.0433 -5.2687 3 1161.1020181  71510 303902664      892763        syn-C2H3C(O)NH2, v=0
  367314.1022  0.0101 -4.4780 3 1106.2689173  71510 303862957      862858        syn-C2H3C(O)NH2, v=0
  367318.2546  0.0101 -4.4780 3 1106.2688173  71510 303862958      862859        syn-C2H3C(O)NH2, v=0
  367333.6774  0.0013 -5.5049 3  470.8531101  71510 303502723      492722        syn-C2H3C(O)NH2, v=0
  367333.6774  0.0013 -5.5049 3  470.8531101  71510 303502724      492723        syn-C2H3C(O)NH2, v=0
  367447.7880  0.0020 -6.0148 3   25.0646 27  71510 30313 8 6      12 5 7        syn-C2H3C(O)NH2, v=0
  367509.2866  0.0379 -5.2162 3 1510.5798205  71510 303A23171      A23072        syn-C2H3C(O)NH2, v=0
  367515.6622  0.0012 -5.1086 3  325.7893 97  71510 303481434      471433        syn-C2H3C(O)NH2, v=0
  367640.1543  0.0015 -3.6003 3  549.6352113  71510 303562729      562630        syn-C2H3C(O)NH2, v=0
  367640.1543  0.0015 -3.6003 3  549.6352113  71510 303562730      562631        syn-C2H3C(O)NH2, v=0
  367653.5928  0.0200 -4.6726 3  839.0524155  71510 303772156      762255        syn-C2H3C(O)NH2, v=0
  367695.4822  0.0725 -5.7709 3 1421.8403199  71510 303993070      983167        syn-C2H3C(O)NH2, v=0
  367701.7987  0.0013 -5.4654 3  458.4868101  71510 303502624      492623        syn-C2H3C(O)NH2, v=0
  367701.7987  0.0013 -5.4654 3  458.4868101  71510 303502625      492624        syn-C2H3C(O)NH2, v=0
  367730.2247  0.2407 -6.2960 3 2071.2964245  71510 303C23093      C22994        syn-C2H3C(O)NH2, v=0
  367752.0637  0.0011 -3.1809 3  339.3697103  71510 30351 942      501041        syn-C2H3C(O)NH2, v=0
  367797.7174  0.0035 -4.3439 3   61.4752 47  71510 30323 519      22 220        syn-C2H3C(O)NH2, v=0
  367813.1347  0.0728 -5.7706 3 1421.8401199  71510 303993069      983168        syn-C2H3C(O)NH2, v=0
  367855.1106  0.0011 -5.0979 3  339.3697103  71510 303511042      501041        syn-C2H3C(O)NH2, v=0
  367929.4938  0.0011 -5.0977 3  339.3637103  71510 30351 942      50 941        syn-C2H3C(O)NH2, v=0
  367939.6951  0.0175 -4.4418 3 1048.5936179  71510 303891673      891574        syn-C2H3C(O)NH2, v=0
  367940.5416  0.0175 -4.4418 3 1048.5936179  71510 303891773      891674        syn-C2H3C(O)NH2, v=0
  367952.1431  0.0365 -5.2152 3 1510.5626205  71510 303A23172      A23073        syn-C2H3C(O)NH2, v=0
  368032.5407  0.0011 -3.1802 3  339.3637103  71510 303511042      50 941        syn-C2H3C(O)NH2, v=0
  368066.2853  0.0064 -5.2971 3  106.7988 59  71510 30329 623      29 326        syn-C2H3C(O)NH2, v=0
  368113.6031  0.0012 -5.4278 3  446.6086101  71510 303502525      492524        syn-C2H3C(O)NH2, v=0
  368113.6031  0.0012 -5.4278 3  446.6086101  71510 303502526      492525        syn-C2H3C(O)NH2, v=0
  368122.5497  0.0051 -3.9543 3  465.5130131  71510 30365 362      65 263        syn-C2H3C(O)NH2, v=0
  368122.5497  0.0051 -3.9543 3  465.5130131  71510 30365 462      65 363        syn-C2H3C(O)NH2, v=0
  368145.8775  0.0041 -4.8884 3  137.8065 65  71510 30332 924      32 627        syn-C2H3C(O)NH2, v=0
  368149.5508  0.0033 -6.2592 3  521.9047117  71510 303582237      591940        syn-C2H3C(O)NH2, v=0
  368160.7154  0.0014 -3.5839 3  535.8560111  71510 303552728      552629        syn-C2H3C(O)NH2, v=0
  368160.7154  0.0014 -3.5839 3  535.8560111  71510 303552729      552630        syn-C2H3C(O)NH2, v=0
  368208.4885  0.0020 -6.0141 3   25.0392 27  71510 30313 8 5      12 5 8        syn-C2H3C(O)NH2, v=0
  368214.2943  0.0051 -4.0070 3  740.7152155  71510 303771067      77 968        syn-C2H3C(O)NH2, v=0
  368214.2945  0.0051 -4.0070 3  740.7152155  71510 303771167      771068        syn-C2H3C(O)NH2, v=0
  368264.1160  0.0035 -4.0437 3  853.2884149  71510 303742846      742747        syn-C2H3C(O)NH2, v=0
  368264.1333  0.0035 -4.0437 3  853.2884149  71510 303742847      742748        syn-C2H3C(O)NH2, v=0
  368266.9368  0.1685 -5.7748 3 1796.4109229  71510 303B42688      B42589        syn-C2H3C(O)NH2, v=0
  368292.3074  0.0878 -5.9415 3 1893.7550231  71510 303B53383      B53284        syn-C2H3C(O)NH2, v=0
  368316.9008  0.0033 -6.2588 3  521.8991117  71510 303582236      591941        syn-C2H3C(O)NH2, v=0
  368347.6888  0.1246 -5.5916 3 1699.6396223  71510 303B12686      B12587        syn-C2H3C(O)NH2, v=0
  368469.2761  0.0223 -4.9770 3  999.3181169  71510 303842362      832459        syn-C2H3C(O)NH2, v=0
  368565.1966  0.0011 -5.1589 3  350.3364 99  71510 303491634      481633        syn-C2H3C(O)NH2, v=0
  368577.6166  0.0012 -5.3918 3  435.2214101  71510 303502426      492425        syn-C2H3C(O)NH2, v=0
  368577.6166  0.0012 -5.3918 3  435.2214101  71510 303502427      492426        syn-C2H3C(O)NH2, v=0
  368652.9054  0.0200 -3.5686 3  522.3302109 -71510 303542727      542628        syn-C2H3C(O)NH2, v=0
  368652.9054  0.0200 -3.5686 3  522.3302109 -71510 303542728      542629        syn-C2H3C(O)NH2, v=0
  368658.9675  0.0282 -5.0651 3 1051.7645173  71510 303862463      852560        syn-C2H3C(O)NH2, v=0
  368697.1533  0.0011 -5.1586 3  350.3417 99  71510 303491633      481632        syn-C2H3C(O)NH2, v=0
  368701.4185  0.0075 -4.2935 3  400.9300125  71510 30362 161      62 062        syn-C2H3C(O)NH2, v=0
  368701.4185  0.0075 -4.2935 3  400.9300125  71510 30362 261      62 162        syn-C2H3C(O)NH2, v=0
  368725.0160  0.0033 -3.8831 3  575.5892141  71510 30370 664      70 565        syn-C2H3C(O)NH2, v=0
  368725.0160  0.0033 -3.8831 3  575.5892141  71510 30370 764      70 665        syn-C2H3C(O)NH2, v=0
  368733.6032  0.0011 -5.0912 3  326.9804 99  71510 303491238      481237        syn-C2H3C(O)NH2, v=0
  368758.1249  0.0011 -5.0942 3  333.5377101  71510 303501140      491139        syn-C2H3C(O)NH2, v=0
  368851.8228  0.0141 -4.3553 3  994.2276175  71510 303871572      871473        syn-C2H3C(O)NH2, v=0
  368852.0639  0.0141 -4.3553 3  994.2276175  71510 303871672      871573        syn-C2H3C(O)NH2, v=0
  368933.2365  0.1062 -5.8861 3 1864.6472229  71510 303B43381      B43282        syn-C2H3C(O)NH2, v=0
  368934.0815  0.2685 -6.1571 3 1997.6398241  71510 303C02892      C02793        syn-C2H3C(O)NH2, v=0
  368946.2541  0.1180 -6.3124 3 2086.7736243  71510 303C13488      C13389        syn-C2H3C(O)NH2, v=0
  368957.2236  0.0061 -4.0642 3  788.9489159  71510 303791168      791069        syn-C2H3C(O)NH2, v=0
  368957.2245  0.0061 -4.0642 3  788.9489159  71510 303791268      791169        syn-C2H3C(O)NH2, v=0
  369015.6392  0.2124 -5.9621 3 1895.7503235  71510 303B72790      B72691        syn-C2H3C(O)NH2, v=0
  369104.6891  0.0012 -5.3574 3  424.3293101  71510 303502328      492327        syn-C2H3C(O)NH2, v=0
  369104.6892  0.0012 -5.3574 3  424.3293101  71510 303502327      492326        syn-C2H3C(O)NH2, v=0
  369117.9979  0.0200 -3.5543 3  509.0573107 -71510 303532726      532627        syn-C2H3C(O)NH2, v=0
  369117.9979  0.0200 -3.5543 3  509.0573107 -71510 303532727      532628        syn-C2H3C(O)NH2, v=0
  369133.4090  0.0200 -3.1521 3  138.3597 63 -71510 303311121      301020        syn-C2H3C(O)NH2, v=0
  369150.7947  0.0196 -4.8235 3 1299.9297189  71510 303943064      942965        syn-C2H3C(O)NH2, v=0
  369185.2938  0.0093 -4.4370 3 1084.7450171  71510 303852956      852857        syn-C2H3C(O)NH2, v=0
  369187.5580  0.0093 -4.4370 3 1084.7449171  71510 303852957      852858        syn-C2H3C(O)NH2, v=0
  369199.4347  0.0195 -4.8234 3 1299.9279189  71510 303943065      942966        syn-C2H3C(O)NH2, v=0
  369382.3378  0.0113 -4.2740 3  941.0719171  71510 303851471      851372        syn-C2H3C(O)NH2, v=0
  369382.4029  0.0113 -4.2740 3  941.0719171  71510 303851571      851472        syn-C2H3C(O)NH2, v=0
  369412.0892  0.0074 -4.1281 3  838.4246163  71510 303811269      811170        syn-C2H3C(O)NH2, v=0
  369412.0932  0.0074 -4.1281 3  838.4246163  71510 303811369      811270        syn-C2H3C(O)NH2, v=0
  369438.9953  0.0032 -4.0121 3  834.9021147  71510 303732845      732746        syn-C2H3C(O)NH2, v=0
  369439.0037  0.0032 -4.0121 3  834.9021147  71510 303732846      732747        syn-C2H3C(O)NH2, v=0
  369461.7363  0.0621 -5.5375 3 1682.7718217  71510 303A83276      A83177        syn-C2H3C(O)NH2, v=0
  369517.9319  0.0645 -5.6459 3 1360.1625195  71510 303972969      963066        syn-C2H3C(O)NH2, v=0
  369536.2417  0.0357 -4.7634 3 1242.0404193  71510 303961977      961878        syn-C2H3C(O)NH2, v=0
  369552.5381  0.0356 -4.7634 3 1242.0405193  71510 303962077      961978        syn-C2H3C(O)NH2, v=0
  369557.0688  0.0200 -3.5411 3  496.0369105 -71510 303522725      522626        syn-C2H3C(O)NH2, v=0
  369557.0688  0.0200 -3.5411 3  496.0369105 -71510 303522726      522627        syn-C2H3C(O)NH2, v=0
  369560.8201  0.0091 -4.1982 3  889.1348167  71510 303831370      831271        syn-C2H3C(O)NH2, v=0
  369560.8368  0.0091 -4.1982 3  889.1348167  71510 303831470      831371        syn-C2H3C(O)NH2, v=0
  369635.9072  0.0021 -5.1179 3   41.2697 37  71510 30318 711      17 414        syn-C2H3C(O)NH2, v=0
  369699.4772  0.0011 -5.0917 3  333.4551101  71510 303501040      491039        syn-C2H3C(O)NH2, v=0
  369708.8895  0.0012 -5.3245 3  413.9371101  71510 303502229      492228        syn-C2H3C(O)NH2, v=0
  369708.8896  0.0012 -5.3245 3  413.9371101  71510 303502228      492227        syn-C2H3C(O)NH2, v=0
  369814.0548  0.0652 -5.6452 3 1360.1618195  71510 303972968      963067        syn-C2H3C(O)NH2, v=0
  369849.6045  0.0040 -3.6472 3  119.4174 61  71510 30330 822      29 723        syn-C2H3C(O)NH2, v=0
  369971.4789  0.0200 -3.5289 3  483.2686103 -71510 303512724      512625        syn-C2H3C(O)NH2, v=0
  369971.4789  0.0200 -3.5289 3  483.2686103 -71510 303512725      512626        syn-C2H3C(O)NH2, v=0
  370227.0464  0.0867 -5.2939 3 1539.8443213  71510 303A62383      A62284        syn-C2H3C(O)NH2, v=0
  370362.1846  0.0200 -3.5180 3  470.7521101 -71510 303502723      502624        syn-C2H3C(O)NH2, v=0
  370362.1846  0.0200 -3.5180 3  470.7521101 -71510 303502724      502625        syn-C2H3C(O)NH2, v=0
  370408.8822  0.0012 -5.2931 3  404.0511101  71510 303502130      492129        syn-C2H3C(O)NH2, v=0
  370408.8831  0.0012 -5.2931 3  404.0511101  71510 303502129      492128        syn-C2H3C(O)NH2, v=0
  370503.9322  0.0035 -3.9037 3  619.3888145  71510 30372 765      72 666        syn-C2H3C(O)NH2, v=0
  370503.9322  0.0035 -3.9037 3  619.3888145  71510 30372 865      72 766        syn-C2H3C(O)NH2, v=0
  370508.8165  0.0181 -4.9562 3  969.3817167  71510 303832262      822359        syn-C2H3C(O)NH2, v=0
  370540.6913  0.0032 -4.1543 3   70.3695 49  71510 30324 619      23 320        syn-C2H3C(O)NH2, v=0
  370543.3263  0.0013 -5.0663 3  313.9139 97  71510 303481137      471136        syn-C2H3C(O)NH2, v=0
  370555.3752  0.0043 -3.9090 3  506.0657135  71510 30367 463      67 364        syn-C2H3C(O)NH2, v=0
  370555.3752  0.0043 -3.9090 3  506.0657135  71510 30367 563      67 464        syn-C2H3C(O)NH2, v=0
  370556.4111  0.0029 -3.9813 3  816.7777145  71510 303722844      722745        syn-C2H3C(O)NH2, v=0
  370556.4151  0.0029 -3.9813 3  816.7777145  71510 303722845      722746        syn-C2H3C(O)NH2, v=0
  370568.0573  0.0338 -5.1867 3 1034.4118173  71510 303862265      852362        syn-C2H3C(O)NH2, v=0
  370591.3759  0.0011 -5.1342 3  343.7398 99  71510 303491535      481534        syn-C2H3C(O)NH2, v=0
  370603.0586  0.0849 -5.2930 3 1539.8463213  71510 303A62483      A62384        syn-C2H3C(O)NH2, v=0
  370638.0118  0.1518 -5.7694 3 1796.4264229  71510 303B42788      B42689        syn-C2H3C(O)NH2, v=0
  370709.7930  0.0022 -6.2923 3  264.8036 81  71510 303401823      411526        syn-C2H3C(O)NH2, v=0
  370725.9896  0.0022 -6.2922 3  264.8030 81  71510 303401822      411527        syn-C2H3C(O)NH2, v=0
  370730.3228  0.0200 -3.5082 3  458.4868 99 -71510 303492722      492623        syn-C2H3C(O)NH2, v=0
  370730.3228  0.0200 -3.5082 3  458.4868 99 -71510 303492723      492624        syn-C2H3C(O)NH2, v=0
  370742.0131  0.0560 -5.5345 3 1682.7211217  71510 303A83277      A83178        syn-C2H3C(O)NH2, v=0
  370761.7038  0.0200 -3.1491 3  138.3144 63 -71510 303311120      301021        syn-C2H3C(O)NH2, v=0
  370812.5104  0.0343 -5.1623 3 1484.8053203  71510 303A13170      A13071        syn-C2H3C(O)NH2, v=0
  370853.2211  0.0200 -3.5178 3  370.2386105 -71510 303521240      511339        syn-C2H3C(O)NH2, v=0
  370869.8316  0.0562 -5.0170 3 1387.2898203  71510 303A12180      A12081        syn-C2H3C(O)NH2, v=0
  370952.8118  0.0559 -5.0168 3 1387.2901203  71510 303A12280      A12181        syn-C2H3C(O)NH2, v=0
  370961.3645  0.0085 -4.3969 3 1063.4908169  71510 303842955      842856        syn-C2H3C(O)NH2, v=0
  370962.5849  0.0085 -4.3969 3 1063.4907169  71510 303842956      842857        syn-C2H3C(O)NH2, v=0
  371076.8696  0.0200 -3.4998 3  446.4726 97 -71510 303482721      482622        syn-C2H3C(O)NH2, v=0
  371076.8696  0.0200 -3.4998 3  446.4726 97 -71510 303482722      482623        syn-C2H3C(O)NH2, v=0
  371081.2633  0.0335 -5.1616 3 1484.7949203  71510 303A13171      A13072        syn-C2H3C(O)NH2, v=0
  371177.4342  0.0255 -4.7893 3  907.2815161  71510 303802258      792357        syn-C2H3C(O)NH2, v=0
  371183.9551  0.0012 -5.0534 3  305.0206 95  71510 303471235      461234        syn-C2H3C(O)NH2, v=0
  371230.1468  0.0011 -5.2632 3  394.6795101  71510 303502031      492030        syn-C2H3C(O)NH2, v=0
  371230.1623  0.0011 -5.2632 3  394.6795101  71510 303502030      492029        syn-C2H3C(O)NH2, v=0
  371232.7205  0.0200 -3.2541 3  333.4551101 -71510 303501140      491039        syn-C2H3C(O)NH2, v=0
  371354.4811  0.0200 -3.3726 3  230.2171 83 -71510 303411131      401030        syn-C2H3C(O)NH2, v=0
  371402.7860  0.0200 -3.4926 3  434.7090 95 -71510 303472720      472621        syn-C2H3C(O)NH2, v=0
  371402.7860  0.0200 -3.4926 3  434.7090 95 -71510 303472721      472622        syn-C2H3C(O)NH2, v=0
  371444.8205  0.0026 -6.2104 3  382.2895 99  71510 303492030      501733        syn-C2H3C(O)NH2, v=0
  371502.2802  0.0026 -6.2103 3  382.2876 99  71510 303492029      501734        syn-C2H3C(O)NH2, v=0
  371526.7747  0.0064 -4.0674 3  439.4871129  71510 30364 262      64 163        syn-C2H3C(O)NH2, v=0
  371526.7747  0.0064 -4.0674 3  439.4871129  71510 30364 362      64 263        syn-C2H3C(O)NH2, v=0
  371534.3102  0.0012 -5.1321 3  343.7839 99  71510 303491534      481533        syn-C2H3C(O)NH2, v=0
  371594.8146  0.0180 -4.7764 3 1276.2979187  71510 303933063      932964        syn-C2H3C(O)NH2, v=0
  371616.5284  0.0036 -5.9765 3   64.9981 45  71510 30322 814      22 319        syn-C2H3C(O)NH2, v=0
  371619.2715  0.0027 -3.9514 3  798.9144143  71510 303712843      712744        syn-C2H3C(O)NH2, v=0
  371619.2734  0.0027 -3.9514 3  798.9144143  71510 303712844      712745        syn-C2H3C(O)NH2, v=0
  371622.8233  0.0179 -4.7763 3 1276.2968187  71510 303933064      932965        syn-C2H3C(O)NH2, v=0
  371631.0650  0.0572 -5.5241 3 1299.9297191  71510 303952868      942965        syn-C2H3C(O)NH2, v=0
  371650.1348  0.1602 -6.1917 3 2025.6019239  71510 303B93485      B93386        syn-C2H3C(O)NH2, v=0
  371680.5988  0.0290 -4.6612 3 1183.4801189  71510 303941876      941777        syn-C2H3C(O)NH2, v=0
  371685.8829  0.0290 -4.6612 3 1183.4801189  71510 303941976      941877        syn-C2H3C(O)NH2, v=0
  371709.0955  0.0200 -3.4869 3  423.1956 93 -71510 303462719      462620        syn-C2H3C(O)NH2, v=0
  371709.0955  0.0200 -3.4869 3  423.1956 93 -71510 303462720      462621        syn-C2H3C(O)NH2, v=0
  371809.5119  0.0040 -6.2782 3  706.4477103  71510 303514110      5041 9        syn-C2H3C(O)NH2, v=0
  371809.5119  0.0040 -6.2782 3  706.4477103  71510 303514111      504110        syn-C2H3C(O)NH2, v=0
  371945.5224  0.0061 -5.9432 3   73.0413 51  71510 30325 421      25 124        syn-C2H3C(O)NH2, v=0
  371946.7309  0.0036 -6.2016 3  687.4070103  71510 303514011      504010        syn-C2H3C(O)NH2, v=0
  371946.7309  0.0036 -6.2016 3  687.4070103  71510 303514012      504011        syn-C2H3C(O)NH2, v=0
  371996.5364  0.0013 -3.4827 3  411.9322 91  71510 303452718      452619        syn-C2H3C(O)NH2, v=0
  371996.5364  0.0013 -3.4827 3  411.9322 91  71510 303452719      452620        syn-C2H3C(O)NH2, v=0
  372051.2689  0.0040 -3.9362 3  664.4590149  71510 30374 866      74 767        syn-C2H3C(O)NH2, v=0
  372051.2689  0.0040 -3.9362 3  664.4590149  71510 30374 966      74 867        syn-C2H3C(O)NH2, v=0
  372090.8071  0.0032 -6.1296 3  668.8386103  71510 303513912      503911        syn-C2H3C(O)NH2, v=0
  372090.8071  0.0032 -6.1296 3  668.8386103  71510 303513913      503912        syn-C2H3C(O)NH2, v=0
  372150.5912  0.0011 -5.0969 3  332.2877 99  71510 303491337      481336        syn-C2H3C(O)NH2, v=0
  372166.2295  0.0020 -4.8445 3  138.2585 63  71510 303311121      31 824        syn-C2H3C(O)NH2, v=0
  372208.7207  0.0011 -5.2345 3  385.8333101  71510 303501932      491931        syn-C2H3C(O)NH2, v=0
  372208.9407  0.0011 -5.2345 3  385.8333101  71510 303501931      491930        syn-C2H3C(O)NH2, v=0
  372222.9477  0.0200 -2.8535 3  102.0995 39 -71510 3031917 2      1816 3        syn-C2H3C(O)NH2, v=0
  372222.9477  0.0200 -2.8535 3  102.0995 39 -71510 3031917 3      1816 2        syn-C2H3C(O)NH2, v=0
  372242.5888  0.0028 -6.0617 3  650.7431103  71510 303513813      503812        syn-C2H3C(O)NH2, v=0
  372242.5888  0.0028 -6.0617 3  650.7431103  71510 303513814      503813        syn-C2H3C(O)NH2, v=0
  372266.1332  0.0013 -3.4801 3  400.9183 89  71510 303442717      442618        syn-C2H3C(O)NH2, v=0
  372266.1332  0.0013 -3.4801 3  400.9183 89  71510 303442718      442619        syn-C2H3C(O)NH2, v=0
  372324.4072  0.0011 -5.1122 3  337.7635 99  71510 303491436      481435        syn-C2H3C(O)NH2, v=0
  372340.5844  0.0010 -3.0651 3  128.2565 59  71510 303291218      281117        syn-C2H3C(O)NH2, v=0
  372359.0658  0.0587 -5.5223 3 1299.9279191  71510 303952867      942966        syn-C2H3C(O)NH2, v=0
  372363.3239  0.0827 -5.8781 3 1864.5089229  71510 303B43382      B43283        syn-C2H3C(O)NH2, v=0
  372376.0840  0.0010 -3.0650 3  128.2554 59  71510 303291217      281118        syn-C2H3C(O)NH2, v=0
  372403.0438  0.0025 -5.9973 3  633.1210103  71510 303513714      503713        syn-C2H3C(O)NH2, v=0
  372403.0438  0.0025 -5.9973 3  633.1210103  71510 303513715      503714        syn-C2H3C(O)NH2, v=0
  372442.7840  0.0014 -5.0781 3  374.3154119  71510 30359 257      58 256        syn-C2H3C(O)NH2, v=0
  372442.7840  0.0014 -2.9127 3  374.3154119  71510 30359 257      58 356        syn-C2H3C(O)NH2, v=0
  372442.7840  0.0014 -2.9127 3  374.3154119  71510 30359 357      58 256        syn-C2H3C(O)NH2, v=0
  372442.7840  0.0014 -5.0781 3  374.3154119  71510 30359 357      58 356        syn-C2H3C(O)NH2, v=0
  372446.5803  0.0013 -5.0851 3  372.7598117  71510 30358 355      57 354        syn-C2H3C(O)NH2, v=0
  372446.5803  0.0013 -2.9404 3  372.7598117  71510 30358 355      57 454        syn-C2H3C(O)NH2, v=0
  372446.5803  0.0013 -2.9404 3  372.7598117  71510 30358 455      57 354        syn-C2H3C(O)NH2, v=0
  372446.5803  0.0013 -5.0851 3  372.7598117  71510 30358 455      57 454        syn-C2H3C(O)NH2, v=0
  372449.3831  0.0016 -5.0702 3  375.3528121  71510 30360 159      59 158        syn-C2H3C(O)NH2, v=0
  372449.3445  0.0200 -2.8862 3  375.3528121 -71510 30360 159      59 258        syn-C2H3C(O)NH2, v=0
  372449.3445  0.0200 -2.8862 3  375.3528121 -71510 30360 259      59 158        syn-C2H3C(O)NH2, v=0
  372449.3831  0.0016 -5.0702 3  375.3528121  71510 30360 259      59 258        syn-C2H3C(O)NH2, v=0
  372460.0839  0.0020 -5.0613 3  375.8804123  71510 30361 061      60 060        syn-C2H3C(O)NH2, v=0
  372460.0839  0.0020 -2.8606 3  375.8804123  71510 30361 061      60 160        syn-C2H3C(O)NH2, v=0
  372460.0839  0.0020 -2.8606 3  375.8804123  71510 30361 161      60 060        syn-C2H3C(O)NH2, v=0
  372460.0839  0.0020 -5.0613 3  375.8804123  71510 30361 161      60 160        syn-C2H3C(O)NH2, v=0
  372470.0019  0.0012 -5.0911 3  370.6755115  71510 30357 453      56 452        syn-C2H3C(O)NH2, v=0
  372470.0019  0.0012 -2.9696 3  370.6755115  71510 30357 453      56 552        syn-C2H3C(O)NH2, v=0
  372470.0019  0.0012 -2.9696 3  370.6755115  71510 30357 553      56 452        syn-C2H3C(O)NH2, v=0
  372470.0019  0.0012 -5.0911 3  370.6755115  71510 30357 553      56 552        syn-C2H3C(O)NH2, v=0
  372514.3885  0.0062 -5.5688 3   89.2808 55  71510 30327 522      27 225        syn-C2H3C(O)NH2, v=0
  372518.6692  0.0014 -3.4793 3  390.1538 87  71510 303432716      432617        syn-C2H3C(O)NH2, v=0
  372518.6692  0.0014 -3.4793 3  390.1538 87  71510 303432717      432618        syn-C2H3C(O)NH2, v=0
  372526.9280  0.0012 -3.0011 3  368.0490113  71510 30356 551      55 650        syn-C2H3C(O)NH2, v=0
  372526.9281  0.0012 -5.0959 3  368.0490113  71510 30356 551      55 550        syn-C2H3C(O)NH2, v=0
  372526.9281  0.0012 -5.0959 3  368.0490113  71510 30356 651      55 650        syn-C2H3C(O)NH2, v=0
  372526.9282  0.0012 -3.0011 3  368.0490113  71510 30356 651      55 550        syn-C2H3C(O)NH2, v=0
  372573.2815  0.0022 -5.9362 3  615.9728103  71510 303513615      503614        syn-C2H3C(O)NH2, v=0
  372573.2815  0.0022 -5.9362 3  615.9728103  71510 303513616      503615        syn-C2H3C(O)NH2, v=0
  372609.8193  0.0021 -4.9003 3  130.5079 61  71510 303301120      30 823        syn-C2H3C(O)NH2, v=0
  372630.2808  0.0025 -3.9222 3  781.3115141  71510 303702842      702743        syn-C2H3C(O)NH2, v=0
  372630.2817  0.0025 -3.9222 3  781.3115141  71510 303702843      702744        syn-C2H3C(O)NH2, v=0
  372636.3937  0.0200 -2.8854 3  104.3000 43 -71510 3032116 5      2015 6        syn-C2H3C(O)NH2, v=0
  372636.3937  0.0200 -2.8854 3  104.3000 43 -71510 3032116 6      2015 5        syn-C2H3C(O)NH2, v=0
  372638.9451  0.0011 -3.0355 3  364.8624111  71510 30355 649      54 748        syn-C2H3C(O)NH2, v=0
  372638.9477  0.0011 -5.0996 3  364.8624111  71510 30355 749      54 748        syn-C2H3C(O)NH2, v=0
  372638.9501  0.0011 -5.0996 3  364.8623111  71510 30355 649      54 648        syn-C2H3C(O)NH2, v=0
  372638.9526  0.0011 -3.0355 3  364.8623111  71510 30355 749      54 648        syn-C2H3C(O)NH2, v=0
  372648.5149  0.0078 -4.3577 3 1042.5052167  71510 303832954      832855        syn-C2H3C(O)NH2, v=0
  372649.1650  0.0078 -4.3577 3 1042.5051167  71510 303832955      832856        syn-C2H3C(O)NH2, v=0
  372657.9938  0.1827 -5.9539 3 1895.7754235  71510 303B72890      B72791        syn-C2H3C(O)NH2, v=0
  372735.9139  0.0064 -4.7925 3  184.2909 75  71510 30337 928      37 631        syn-C2H3C(O)NH2, v=0
  372754.5784  0.0020 -5.8781 3  599.2991103  71510 303513516      503515        syn-C2H3C(O)NH2, v=0
  372754.5784  0.0020 -5.8781 3  599.2991103  71510 303513517      503516        syn-C2H3C(O)NH2, v=0
  372754.9513  0.0014 -3.4804 3  379.6382 85  71510 303422715      422616        syn-C2H3C(O)NH2, v=0
  372754.9513  0.0014 -3.4804 3  379.6382 85  71510 303422716      422617        syn-C2H3C(O)NH2, v=0
  372783.8394  0.0038 -3.8948 3  547.9089139  71510 30369 564      69 465        syn-C2H3C(O)NH2, v=0
  372783.8394  0.0038 -3.8948 3  547.9089139  71510 30369 664      69 565        syn-C2H3C(O)NH2, v=0
  372807.4123  0.0403 -5.1518 3 1105.6836177  71510 303882563      872662        syn-C2H3C(O)NH2, v=0
  372841.1386  0.0011 -3.0741 3  361.0912109  71510 30354 747      53 846        syn-C2H3C(O)NH2, v=0
  372841.2339  0.0011 -5.1018 3  361.0912109  71510 30354 847      53 846        syn-C2H3C(O)NH2, v=0
  372841.3185  0.0011 -5.1018 3  361.0912109  71510 30354 747      53 746        syn-C2H3C(O)NH2, v=0
  372841.4138  0.0011 -3.0741 3  361.0912109  71510 30354 847      53 746        syn-C2H3C(O)NH2, v=0
  372878.2096  0.0020 -4.7963 3  146.2361 65  71510 303321122      32 825        syn-C2H3C(O)NH2, v=0
  372948.4102  0.0018 -5.8226 3  583.1008103  71510 303513417      503416        syn-C2H3C(O)NH2, v=0
  372948.4102  0.0018 -5.8226 3  583.1008103  71510 303513418      503417        syn-C2H3C(O)NH2, v=0
  372960.1259  0.0020 -5.8249 3   28.3135 29  71510 30314 8 7      13 5 8        syn-C2H3C(O)NH2, v=0
  372975.7576  0.0014 -3.4835 3  369.3712 83  71510 303412714      412615        syn-C2H3C(O)NH2, v=0
  372975.7576  0.0014 -3.4835 3  369.3712 83  71510 303412715      412616        syn-C2H3C(O)NH2, v=0
  372990.2941  0.0200 -2.9199 3  107.9844 47 -71510 3032315 8      2214 9        syn-C2H3C(O)NH2, v=0
  372990.2941  0.0200 -2.9199 3  107.9844 47 -71510 3032315 9      2214 8        syn-C2H3C(O)NH2, v=0
  373031.2858  0.1088 -5.4603 3 1632.3079219  71510 303A92485      A92386        syn-C2H3C(O)NH2, v=0
  373103.3139  0.1150 -6.2453 3 2055.9281241  71510 303C03487      C03388        syn-C2H3C(O)NH2, v=0
  373105.4032  0.0059 -5.9412 3   73.0413 51  71510 30325 521      25 224        syn-C2H3C(O)NH2, v=0
  373115.5644  0.0010 -3.0056 3  119.9114 55  71510 303271315      261214        syn-C2H3C(O)NH2, v=0
  373115.9166  0.0010 -3.0056 3  119.9114 55  71510 303271314      261215        syn-C2H3C(O)NH2, v=0
  373156.4917  0.0017 -5.7697 3  567.3786103  71510 303513318      503317        syn-C2H3C(O)NH2, v=0
  373156.4917  0.0017 -5.7697 3  567.3786103  71510 303513319      503318        syn-C2H3C(O)NH2, v=0
  373181.8388  0.0014 -3.4889 3  359.3526 81  71510 303402713      402614        syn-C2H3C(O)NH2, v=0
  373181.8388  0.0014 -3.4889 3  359.3526 81  71510 303402714      402615        syn-C2H3C(O)NH2, v=0
  373191.5747  0.0011 -3.1188 3  356.7009107  71510 30353 845      52 944        syn-C2H3C(O)NH2, v=0
  373194.3157  0.0011 -5.1024 3  356.7009107  71510 30353 945      52 944        syn-C2H3C(O)NH2, v=0
  373196.5577  0.0011 -5.1024 3  356.7007107  71510 30353 845      52 844        syn-C2H3C(O)NH2, v=0
  373199.2986  0.0011 -3.1188 3  356.7007107  71510 30353 945      52 844        syn-C2H3C(O)NH2, v=0
  373204.8143  0.0010 -2.9590 3  113.1758 51  71510 303251412      241311        syn-C2H3C(O)NH2, v=0
  373204.8158  0.0010 -2.9590 3  113.1758 51  71510 303251411      241312        syn-C2H3C(O)NH2, v=0
  373334.2828  0.0235 -4.5638 3 1126.1039185  71510 303921775      921676        syn-C2H3C(O)NH2, v=0
  373335.9184  0.0235 -4.5638 3 1126.1039185  71510 303921875      921776        syn-C2H3C(O)NH2, v=0
  373357.1128  0.0047 -3.9786 3  710.7930153  71510 30376 967      76 868        syn-C2H3C(O)NH2, v=0
  373357.1128  0.0047 -3.9786 3  710.7930153  71510 303761067      76 968        syn-C2H3C(O)NH2, v=0
  373373.9197  0.0015 -3.4970 3  349.5821 79  71510 303392712      392613        syn-C2H3C(O)NH2, v=0
  373373.9197  0.0015 -3.4970 3  349.5821 79  71510 303392713      392614        syn-C2H3C(O)NH2, v=0
  373380.8263  0.0016 -5.7192 3  552.1334103  71510 303513219      503218        syn-C2H3C(O)NH2, v=0
  373380.8263  0.0016 -5.7192 3  552.1334103  71510 303513220      503219        syn-C2H3C(O)NH2, v=0
  373397.4441  0.0011 -5.2070 3  377.5274101  71510 303501833      491832        syn-C2H3C(O)NH2, v=0
  373400.1181  0.0011 -5.2070 3  377.5275101  71510 303501832      491831        syn-C2H3C(O)NH2, v=0
  373504.6587  0.0029 -5.1966 3  102.1594 53  71510 303261115      26 818        syn-C2H3C(O)NH2, v=0
  373517.6261  0.0552 -5.4783 3 1655.3942215  71510 303A73275      A73176        syn-C2H3C(O)NH2, v=0
  373552.6997  0.0015 -3.5079 3  340.0594 77  71510 303382711      382612        syn-C2H3C(O)NH2, v=0
  373552.6997  0.0015 -3.5079 3  340.0594 77  71510 303382712      382613        syn-C2H3C(O)NH2, v=0
  373591.9602  0.0024 -3.8939 3  763.9685139  71510 303692841      692742        syn-C2H3C(O)NH2, v=0
  373591.9606  0.0024 -3.8939 3  763.9685139  71510 303692842      692743        syn-C2H3C(O)NH2, v=0
  373623.7685  0.0015 -5.6708 3  537.3663103  71510 303513120      503119        syn-C2H3C(O)NH2, v=0
  373623.7685  0.0015 -5.6708 3  537.3663103  71510 303513121      503120        syn-C2H3C(O)NH2, v=0
  373643.2111  0.1055 -5.4589 3 1632.3113219  71510 303A92585      A92486        syn-C2H3C(O)NH2, v=0
  373718.8544  0.0015 -3.5222 3  330.7842 75  71510 303372710      372611        syn-C2H3C(O)NH2, v=0
  373718.8544  0.0015 -3.5222 3  330.7842 75  71510 303372711      372612        syn-C2H3C(O)NH2, v=0
  373740.1756  0.0011 -3.1735 3  351.6400105  71510 30352 943      511042        syn-C2H3C(O)NH2, v=0
  373769.1718  0.0011 -3.2486 3  345.8381103  71510 303511041      501140        syn-C2H3C(O)NH2, v=0
  373799.5013  0.0011 -5.1010 3  351.6400105  71510 303521043      511042        syn-C2H3C(O)NH2, v=0
  373843.2224  0.0011 -5.1009 3  351.6366105  71510 30352 943      51 942        syn-C2H3C(O)NH2, v=0
  373873.0361  0.0016 -3.5405 3  321.7562 73  71510 3033627 9      362610        syn-C2H3C(O)NH2, v=0
  373873.0361  0.0016 -3.5405 3  321.7562 73  71510 303362710      362611        syn-C2H3C(O)NH2, v=0
  373888.1034  0.0014 -5.6246 3  523.0785103  71510 303513021      503020        syn-C2H3C(O)NH2, v=0
  373888.1034  0.0014 -5.6246 3  523.0785103  71510 303513022      503021        syn-C2H3C(O)NH2, v=0
  373888.7410  0.0312 -5.1095 3 1459.3159201  71510 303A03169      A03070        syn-C2H3C(O)NH2, v=0
  373902.5482  0.0011 -3.1731 3  351.6366105  71510 303521043      51 942        syn-C2H3C(O)NH2, v=0
  373903.9564  0.0165 -4.7301 3 1252.9419185  71510 303923062      922963        syn-C2H3C(O)NH2, v=0
  373919.9055  0.0165 -4.7301 3 1252.9413185  71510 303923063      922964        syn-C2H3C(O)NH2, v=0
  373951.8260  0.0204 -5.0147 3  990.7054169  71510 303842263      832360        syn-C2H3C(O)NH2, v=0
  373968.4589  0.0021 -4.9630 3  122.9906 59  71510 303291119      29 822        syn-C2H3C(O)NH2, v=0
  373988.0583  0.0461 -4.9044 3 1325.7696199  71510 303992079      991980        syn-C2H3C(O)NH2, v=0
  373993.1086  0.0503 -5.4057 3 1241.1469187  71510 303932767      922864        syn-C2H3C(O)NH2, v=0
  374015.8750  0.0017 -3.5633 3  312.9753 71  71510 3033527 8      3526 9        syn-C2H3C(O)NH2, v=0
  374015.8750  0.0017 -3.5633 3  312.9753 71  71510 3033527 9      352610        syn-C2H3C(O)NH2, v=0
  374017.0251  0.0460 -4.9043 3 1325.7698199  71510 303992179      992080        syn-C2H3C(O)NH2, v=0
  374049.9751  0.0308 -5.1091 3 1459.3097201  71510 303A03170      A03071        syn-C2H3C(O)NH2, v=0
  374130.2445  0.0916 -5.8207 3 1835.6409227  71510 303B33380      B33281        syn-C2H3C(O)NH2, v=0
  374147.9795  0.0017 -3.5919 3  304.4411 69  71510 3033427 7      3426 8        syn-C2H3C(O)NH2, v=0
  374147.9795  0.0017 -3.5919 3  304.4411 69  71510 3033427 8      3426 9        syn-C2H3C(O)NH2, v=0
  374162.2066  0.0055 -3.9692 3  479.3475133  71510 30366 363      66 264        syn-C2H3C(O)NH2, v=0
  374162.2066  0.0055 -3.9692 3  479.3475133  71510 30366 463      66 364        syn-C2H3C(O)NH2, v=0
  374177.1497  0.0013 -5.5804 3  509.2714103  71510 303512922      502921        syn-C2H3C(O)NH2, v=0
  374177.1497  0.0013 -5.5804 3  509.2714103  71510 303512923      502922        syn-C2H3C(O)NH2, v=0
  374185.1663  0.0253 -5.0906 3 1012.3780171  71510 303852264      842361        syn-C2H3C(O)NH2, v=0
  374206.3430  0.1086 -6.1877 3 1641.7476213  71510 303A63374      A53471        syn-C2H3C(O)NH2, v=0
  374217.9398  0.1086 -6.1876 3 1641.7476213  71510 303A63373      A53472        syn-C2H3C(O)NH2, v=0
  374252.2834  0.0072 -4.3192 3 1021.7871165  71510 303822953      822854        syn-C2H3C(O)NH2, v=0
  374252.6256  0.0072 -4.3192 3 1021.7871165  71510 303822954      822855        syn-C2H3C(O)NH2, v=0
  374259.2367  0.0032 -4.4558 3  289.7024 91  71510 303451431      451134        syn-C2H3C(O)NH2, v=0
  374269.9375  0.0018 -3.6276 3  296.1534 67  71510 3033327 6      3326 7        syn-C2H3C(O)NH2, v=0
  374269.9375  0.0018 -3.6276 3  296.1534 67  71510 3033327 7      3326 8        syn-C2H3C(O)NH2, v=0
  374317.9674  0.0516 -5.4764 3 1655.3628215  71510 303A73276      A73177        syn-C2H3C(O)NH2, v=0
  374382.3164  0.0019 -3.6725 3  288.1120 65  71510 3033227 5      3226 6        syn-C2H3C(O)NH2, v=0
  374382.3164  0.0019 -3.6725 3  288.1120 65  71510 3033227 6      3226 7        syn-C2H3C(O)NH2, v=0
  374410.2167  0.0056 -4.0296 3  758.3840157  71510 303781068      78 969        syn-C2H3C(O)NH2, v=0
  374410.2168  0.0056 -4.0296 3  758.3840157  71510 303781168      781069        syn-C2H3C(O)NH2, v=0
  374441.5458  0.2174 -6.1448 3 1997.6802241  71510 303C02992      C02893        syn-C2H3C(O)NH2, v=0
  374464.7595  0.0043 -4.3506 3  364.2943103  71510 303511437      511140        syn-C2H3C(O)NH2, v=0
  374485.6640  0.0019 -3.7298 3  280.3166 63  71510 3033127 4      3126 5        syn-C2H3C(O)NH2, v=0
  374485.6640  0.0019 -3.7298 3  280.3166 63  71510 3033127 5      3126 6        syn-C2H3C(O)NH2, v=0
  374494.8937  0.0013 -5.5381 3  495.9466103  71510 303512823      502822        syn-C2H3C(O)NH2, v=0
  374494.8937  0.0013 -5.5381 3  495.9466103  71510 303512824      502823        syn-C2H3C(O)NH2, v=0
  374506.6658  0.0022 -3.8664 3  746.8847137  71510 303682840      682741        syn-C2H3C(O)NH2, v=0
  374506.6660  0.0022 -3.8664 3  746.8847137  71510 303682841      682742        syn-C2H3C(O)NH2, v=0
  374547.9679  0.0190 -4.4712 3 1069.9218181  71510 303901674      901575        syn-C2H3C(O)NH2, v=0
  374548.4505  0.0190 -4.4712 3 1069.9218181  71510 303901774      901675        syn-C2H3C(O)NH2, v=0
  374579.8839  0.0020 -5.8238 3   28.2595 29  71510 30314 8 6      13 5 9        syn-C2H3C(O)NH2, v=0
  374580.5087  0.0020 -3.8051 3  272.7670 61  71510 3033027 3      3026 4        syn-C2H3C(O)NH2, v=0
  374580.5087  0.0020 -3.8051 3  272.7670 61  71510 3033027 4      3026 5        syn-C2H3C(O)NH2, v=0
  374598.0639  0.0713 -5.1707 3 1475.4014209  71510 303A42282      A42183        syn-C2H3C(O)NH2, v=0
  374667.3604  0.0021 -3.9085 3  265.4631 59  71510 3032927 2      2926 3        syn-C2H3C(O)NH2, v=0
  374667.3604  0.0021 -3.9085 3  265.4631 59  71510 3032927 3      2926 4        syn-C2H3C(O)NH2, v=0
  374679.3924  0.0010 -3.1630 3  146.1760 65  71510 303321122      311021        syn-C2H3C(O)NH2, v=0
  374706.1547  0.0011 -5.0972 3  345.8381103  71510 303511141      501140        syn-C2H3C(O)NH2, v=0
  374735.2235  0.0080 -4.3064 3  413.7572127  71510 30363 162      63 063        syn-C2H3C(O)NH2, v=0
  374735.2235  0.0080 -4.3064 3  413.7572127  71510 30363 262      63 163        syn-C2H3C(O)NH2, v=0
  374738.9932  0.0708 -5.1704 3 1475.4021209  71510 303A42382      A42283        syn-C2H3C(O)NH2, v=0
  374746.7105  0.0022 -4.0633 3  258.4046 57  71510 3032827 1      2826 2        syn-C2H3C(O)NH2, v=0
  374746.7105  0.0022 -4.0633 3  258.4046 57  71510 3032827 2      2826 3        syn-C2H3C(O)NH2, v=0
  374801.2927  0.0037 -3.9013 3  591.0361143  71510 30371 665      71 566        syn-C2H3C(O)NH2, v=0
  374801.2927  0.0037 -3.9013 3  591.0361143  71510 30371 765      71 666        syn-C2H3C(O)NH2, v=0
  374809.0385  0.0012 -3.3576 3  351.7920103  71510 303511140      501239        syn-C2H3C(O)NH2, v=0
  374819.0325  0.0023 -4.3431 3  251.5913 55  71510 3032727 0      2726 1        syn-C2H3C(O)NH2, v=0
  374819.0325  0.0023 -4.3431 3  251.5913 55  71510 3032727 1      2726 2        syn-C2H3C(O)NH2, v=0
  374846.1672  0.0013 -5.4976 3  483.1060103  71510 303512724      502723        syn-C2H3C(O)NH2, v=0
  374846.1672  0.0013 -5.4976 3  483.1060103  71510 303512725      502724        syn-C2H3C(O)NH2, v=0
  374872.7418  0.0011 -5.1805 3  369.7831101  71510 303501734      491733        syn-C2H3C(O)NH2, v=0
  374900.1813  0.0011 -5.1805 3  369.7841101  71510 303501733      491732        syn-C2H3C(O)NH2, v=0
  374969.0612  0.0021 -4.7565 3  154.4342 67  71510 303331123      33 826        syn-C2H3C(O)NH2, v=0
  375100.6131  0.0011 -5.0929 3  339.2800101  71510 303501239      491238        syn-C2H3C(O)NH2, v=0
  375197.7601  0.0068 -4.0879 3  807.2250161  71510 303801169      801070        syn-C2H3C(O)NH2, v=0
  375197.7606  0.0068 -4.0879 3  807.2250161  71510 303801269      801170        syn-C2H3C(O)NH2, v=0
  375219.1621  0.0013 -5.0730 3  326.2739 99  71510 303491138      481137        syn-C2H3C(O)NH2, v=0
  375236.8878  0.0013 -5.4588 3  470.7521103  71510 303512625      502624        syn-C2H3C(O)NH2, v=0
  375236.8878  0.0013 -5.4588 3  470.7521103  71510 303512626      502625        syn-C2H3C(O)NH2, v=0
  375302.3942  0.0011 -5.0957 3  345.7870103  71510 303511041      501040        syn-C2H3C(O)NH2, v=0
  375361.7633  0.0153 -4.3836 3 1014.9427177  71510 303881573      881474        syn-C2H3C(O)NH2, v=0
  375361.8987  0.0153 -4.3836 3 1014.9427177  71510 303881673      881574        syn-C2H3C(O)NH2, v=0
  375376.6054  0.0021 -3.8398 3  730.0594135  71510 303672839      672740        syn-C2H3C(O)NH2, v=0
  375376.6055  0.0021 -3.8398 3  730.0594135  71510 303672840      672741        syn-C2H3C(O)NH2, v=0
  375397.1281  0.1361 -5.6338 3 1727.3472225  71510 303B22587      B22488        syn-C2H3C(O)NH2, v=0
  375463.7173  0.0977 -6.0529 3 1575.2868209  71510 303A43273      A33370        syn-C2H3C(O)NH2, v=0
  375494.2372  0.0978 -6.0528 3 1575.2868209  71510 303A43272      A33371        syn-C2H3C(O)NH2, v=0
  375513.3897  0.0013 -5.0729 3  320.9904 97  71510 303481335      471334        syn-C2H3C(O)NH2, v=0
  375674.3891  0.0012 -5.4218 3  458.8875103  71510 303512526      502525        syn-C2H3C(O)NH2, v=0
  375674.3891  0.0012 -5.4218 3  458.8875103  71510 303512527      502526        syn-C2H3C(O)NH2, v=0
  375705.0524  0.0082 -4.1530 3  857.3089165  71510 303821270      821171        syn-C2H3C(O)NH2, v=0
  375705.0546  0.0082 -4.1530 3  857.3089165  71510 303821370      821271        syn-C2H3C(O)NH2, v=0
  375725.6341  0.0039 -3.7944 3  450.1897115  71510 303571443      561542        syn-C2H3C(O)NH2, v=0
  375735.2462  0.0533 -5.4015 3 1241.1422187  71510 303932766      922865        syn-C2H3C(O)NH2, v=0
  375743.8597  0.0318 -4.9092 3  978.1720167  71510 303832360      822459        syn-C2H3C(O)NH2, v=0
  375777.6584  0.0066 -4.2817 3 1001.3358163  71510 303812952      812853        syn-C2H3C(O)NH2, v=0
  375777.8365  0.0066 -4.2817 3 1001.3358163  71510 303812953      812854        syn-C2H3C(O)NH2, v=0
  375808.4044  0.0124 -4.3013 3  961.1755173  71510 303861472      861373        syn-C2H3C(O)NH2, v=0
  375808.4404  0.0124 -4.3013 3  961.1755173  71510 303861572      861473        syn-C2H3C(O)NH2, v=0
  375915.1562  0.0101 -4.2243 3  908.6282169  71510 303841371      841272        syn-C2H3C(O)NH2, v=0
  375915.1653  0.0101 -4.2243 3  908.6282169  71510 303841471      841372        syn-C2H3C(O)NH2, v=0
  375999.5803  0.0022 -5.0320 3  115.7134 57  71510 303281118      28 821        syn-C2H3C(O)NH2, v=0
  376068.4601  0.0026 -4.3272 3  382.6089105  71510 303521537      521240        syn-C2H3C(O)NH2, v=0
  376089.8312  0.0152 -4.6848 3 1229.8601183  71510 303913061      912962        syn-C2H3C(O)NH2, v=0
  376098.8127  0.0152 -4.6848 3 1229.8598183  71510 303913062      912963        syn-C2H3C(O)NH2, v=0
  376167.8862  0.0012 -5.3863 3  447.5158103  71510 303512427      502426        syn-C2H3C(O)NH2, v=0
  376167.8862  0.0012 -5.3863 3  447.5158103  71510 303512428      502427        syn-C2H3C(O)NH2, v=0
  376203.8516  0.0020 -3.8139 3  713.4922133  71510 303662838      662739        syn-C2H3C(O)NH2, v=0
  376203.8516  0.0020 -3.8139 3  713.4922133  71510 303662839      662740        syn-C2H3C(O)NH2, v=0
  376239.3771  0.0011 -3.2425 3  345.7870103  71510 303511141      501040        syn-C2H3C(O)NH2, v=0
  376288.3091  0.0057 -5.5630 3   89.2809 55  71510 30327 622      27 325        syn-C2H3C(O)NH2, v=0
  376326.9766  0.0029 -6.2225 3  442.4667107  71510 303532133      541836        syn-C2H3C(O)NH2, v=0
  376341.5019  0.0772 -5.8157 3 1835.5525227  71510 303B33381      B33282        syn-C2H3C(O)NH2, v=0
  376353.5121  0.0029 -3.3617 3  219.6943 81  71510 303401130      391029        syn-C2H3C(O)NH2, v=0
  376377.7798  0.1297 -5.6316 3 1727.3530225  71510 303B22687      B22588        syn-C2H3C(O)NH2, v=0
  376400.4836  0.0029 -6.2224 3  442.4642107  71510 303532132      541837        syn-C2H3C(O)NH2, v=0
  376437.8033  0.0436 -5.2916 3 1183.8206183  71510 303912666      902763        syn-C2H3C(O)NH2, v=0
  376502.9123  0.0378 -4.7965 3 1265.4148195  71510 303971978      971879        syn-C2H3C(O)NH2, v=0
  376512.5861  0.0378 -4.7965 3 1265.4149195  71510 303972078      971979        syn-C2H3C(O)NH2, v=0
  376534.3105  0.0037 -4.8430 3  159.4369 67  71510 303331221      33 924        syn-C2H3C(O)NH2, v=0
  376600.2884  0.0039 -3.9231 3  635.4407147  71510 30373 766      73 667        syn-C2H3C(O)NH2, v=0
  376600.2884  0.0039 -3.9231 3  635.4407147  71510 30373 866      73 767        syn-C2H3C(O)NH2, v=0
  376602.5682  0.0047 -3.9252 3  520.5047137  71510 30368 464      68 365        syn-C2H3C(O)NH2, v=0
  376602.5682  0.0047 -3.9252 3  520.5047137  71510 30368 564      68 465        syn-C2H3C(O)NH2, v=0
  376689.4843  0.0030 -3.4742 3  138.2585 65  71510 30332 923      31 824        syn-C2H3C(O)NH2, v=0
  376712.2144  0.0011 -5.1550 3  362.6304101  71510 303501635      491634        syn-C2H3C(O)NH2, v=0
  376729.1491  0.0012 -5.3524 3  436.6413103  71510 303512328      502327        syn-C2H3C(O)NH2, v=0
  376729.1491  0.0012 -5.3524 3  436.6413103  71510 303512329      502328        syn-C2H3C(O)NH2, v=0
  376768.8531  0.0286 -5.0578 3 1434.1090199  71510 303993168      993069        syn-C2H3C(O)NH2, v=0
  376864.5018  0.0284 -5.0575 3 1434.1053199  71510 303993169      993070        syn-C2H3C(O)NH2, v=0
  376896.8624  0.0037 -4.6292 3  219.6943 79  71510 303391326      391029        syn-C2H3C(O)NH2, v=0
  376943.7773  0.0012 -5.1545 3  362.6401101  71510 303501634      491633        syn-C2H3C(O)NH2, v=0
  376960.4395  0.0878 -5.9210 3 1510.2621205  71510 303A23172      A13269        syn-C2H3C(O)NH2, v=0
  376990.3547  0.0019 -3.7890 3  697.1825131  71510 303652837      652738        syn-C2H3C(O)NH2, v=0
  376990.3547  0.0019 -3.7890 3  697.1825131  71510 303652838      652739        syn-C2H3C(O)NH2, v=0
  376991.4737  0.0034 -4.7683 3  158.4459 69  71510 303341025      34 728        syn-C2H3C(O)NH2, v=0
  377039.3391  0.0880 -5.9208 3 1510.2620205  71510 303A23171      A13270        syn-C2H3C(O)NH2, v=0
  377063.6575  0.0023 -6.2442 3  315.0707 89  71510 303441926      451629        syn-C2H3C(O)NH2, v=0
  377086.0677  0.0023 -6.2442 3  315.0700 89  71510 303441925      451630        syn-C2H3C(O)NH2, v=0
  377110.6036  0.0013 -5.1013 3  338.0483 99  71510 303491435      481434        syn-C2H3C(O)NH2, v=0
  377229.1642  0.0061 -4.2449 3  981.1502161  71510 303802951      802852        syn-C2H3C(O)NH2, v=0
  377229.2557  0.0061 -4.2449 3  981.1502161  71510 303802952      802853        syn-C2H3C(O)NH2, v=0
  377236.1543  0.0497 -5.4205 3 1628.3101213  71510 303A63274      A63175        syn-C2H3C(O)NH2, v=0
  377262.3491  0.1696 -5.8145 3 1824.9550231  71510 303B52689      B52590        syn-C2H3C(O)NH2, v=0
  377312.1521  0.1101 -6.1787 3 2025.3708239  71510 303B93486      B93387        syn-C2H3C(O)NH2, v=0
  377360.2516  0.0060 -4.6817 3  217.6297 81  71510 303401030      40 733        syn-C2H3C(O)NH2, v=0
  377373.5106  0.0012 -5.3200 3  426.2692103  71510 303512230      502229        syn-C2H3C(O)NH2, v=0
  377373.5107  0.0012 -5.3200 3  426.2692103  71510 303512229      502228        syn-C2H3C(O)NH2, v=0
  377561.4234  0.0069 -4.0816 3  452.9189131  71510 30365 263      65 164        syn-C2H3C(O)NH2, v=0
  377561.4234  0.0069 -4.0816 3  452.9189131  71510 30365 363      65 264        syn-C2H3C(O)NH2, v=0
  377611.5054  0.0232 -5.0056 3 1020.7076171  71510 303852363      842460        syn-C2H3C(O)NH2, v=0
  377640.2146  0.0200 -3.1578 3  146.0945 65 -71510 303321121      311022        syn-C2H3C(O)NH2, v=0
  377709.2753  0.0015 -3.2986 3  150.0866 67  71510 303331023      32 924        syn-C2H3C(O)NH2, v=0
  377714.4046  0.0020 -5.6535 3   31.8388 31  71510 30315 8 8      14 5 9        syn-C2H3C(O)NH2, v=0
  377730.5204  0.0476 -5.4194 3 1628.2908213  71510 303A63275      A63176        syn-C2H3C(O)NH2, v=0
  377737.9481  0.0200 -3.7649 3  681.1297129 -71510 303642836      642737        syn-C2H3C(O)NH2, v=0
  377737.9481  0.0200 -3.7649 3  681.1297129 -71510 303642837      642738        syn-C2H3C(O)NH2, v=0
  377772.9698  0.1358 -6.1215 3 1995.2535237  71510 303B83484      B83385        syn-C2H3C(O)NH2, v=0
  377997.7269  0.0897 -5.3314 3 1566.1031215  71510 303A72384      A72285        syn-C2H3C(O)NH2, v=0
  378121.4346  0.0012 -5.2890 3  416.4066103  71510 303512131      502130        syn-C2H3C(O)NH2, v=0
  378121.4368  0.0012 -5.2890 3  416.4066103  71510 303512130      502129        syn-C2H3C(O)NH2, v=0
  378162.1911  0.0141 -4.6404 3 1207.0513181  71510 303903060      902961        syn-C2H3C(O)NH2, v=0
  378163.2403  0.0589 -5.0525 3 1412.1022205  71510 303A22181      A22082        syn-C2H3C(O)NH2, v=0
  378167.1931  0.0141 -4.6404 3 1207.0511181  71510 303903061      902962        syn-C2H3C(O)NH2, v=0
  378172.4610  0.0045 -3.9569 3  681.1163151  71510 30375 867      75 768        syn-C2H3C(O)NH2, v=0
  378172.4610  0.0045 -3.9569 3  681.1163151  71510 30375 967      75 868        syn-C2H3C(O)NH2, v=0
  378213.7982  0.0587 -5.0524 3 1412.1024205  71510 303A22281      A22182        syn-C2H3C(O)NH2, v=0
  378233.1856  0.0885 -5.3309 3 1566.1043215  71510 303A72484      A72385        syn-C2H3C(O)NH2, v=0
  378286.9419  0.0054 -5.2848 3  106.7991 59  71510 30329 723      29 426        syn-C2H3C(O)NH2, v=0
  378319.1019  0.0031 -4.3237 3  396.1605107  71510 303531538      531241        syn-C2H3C(O)NH2, v=0
  378327.1092  0.0024 -4.0458 3   79.4475 51  71510 30325 719      24 420        syn-C2H3C(O)NH2, v=0
  378448.3796  0.0200 -3.7416 3  665.3334127 -71510 303632835      632736        syn-C2H3C(O)NH2, v=0
  378448.3796  0.0200 -3.7416 3  665.3334127 -71510 303632836      632737        syn-C2H3C(O)NH2, v=0
  378473.0016  0.0023 -5.1069 3  108.6824 55  71510 303271117      27 820        syn-C2H3C(O)NH2, v=0
  378488.1308  0.0014 -5.0828 3  386.7387121  71510 30360 258      59 257        syn-C2H3C(O)NH2, v=0
  378488.1185  0.0200 -2.9166 3  386.7387121 -71510 30360 258      59 357        syn-C2H3C(O)NH2, v=0
  378488.1185  0.0200 -2.9166 3  386.7387121 -71510 30360 358      59 257        syn-C2H3C(O)NH2, v=0
  378488.1308  0.0014 -5.0828 3  386.7387121  71510 30360 358      59 357        syn-C2H3C(O)NH2, v=0
  378491.0532  0.0013 -5.0896 3  385.1833119  71510 30359 356      58 355        syn-C2H3C(O)NH2, v=0
  378491.0477  0.0200 -2.9436 3  385.1833119 -71510 30359 356      58 455        syn-C2H3C(O)NH2, v=0
  378491.0477  0.0200 -2.9436 3  385.1833119 -71510 30359 456      58 355        syn-C2H3C(O)NH2, v=0
  378491.0532  0.0013 -5.0896 3  385.1833119  71510 30359 456      58 455        syn-C2H3C(O)NH2, v=0
  378493.9627  0.0309 -4.6934 3 1206.2363191  71510 303951877      951778        syn-C2H3C(O)NH2, v=0
  378495.0718  0.0017 -5.0750 3  387.7764123  71510 30361 160      60 159        syn-C2H3C(O)NH2, v=0
  378495.0791  0.0200 -2.8906 3  387.7764123 -71510 30361 160      60 259        syn-C2H3C(O)NH2, v=0
  378495.0791  0.0200 -2.8906 3  387.7764123 -71510 30361 260      60 159        syn-C2H3C(O)NH2, v=0
  378495.0718  0.0017 -5.0750 3  387.7764123  71510 30361 260      60 259        syn-C2H3C(O)NH2, v=0
  378497.0515  0.0309 -4.6933 3 1206.2364191  71510 303951977      951878        syn-C2H3C(O)NH2, v=0
  378505.8551  0.0021 -5.0663 3  388.3044125  71510 30362 062      61 061        syn-C2H3C(O)NH2, v=0
  378505.8551  0.0021 -2.8654 3  388.3044125  71510 30362 062      61 161        syn-C2H3C(O)NH2, v=0
  378505.8551  0.0021 -2.8654 3  388.3044125  71510 30362 162      61 061        syn-C2H3C(O)NH2, v=0
  378505.8551  0.0021 -5.0663 3  388.3044125  71510 30362 162      61 161        syn-C2H3C(O)NH2, v=0
  378512.6037  0.0013 -5.0954 3  383.0998117  71510 30358 454      57 453        syn-C2H3C(O)NH2, v=0
  378512.6050  0.0200 -2.9722 3  383.0998117 -71510 30358 454      57 553        syn-C2H3C(O)NH2, v=0
  378512.6050  0.0200 -2.9722 3  383.0998117 -71510 30358 554      57 453        syn-C2H3C(O)NH2, v=0
  378512.6037  0.0013 -5.0954 3  383.0998117  71510 30358 554      57 553        syn-C2H3C(O)NH2, v=0
  378544.4834  0.2115 -6.0024 3 1925.1240237  71510 303B82791      B82692        syn-C2H3C(O)NH2, v=0
  378547.9519  0.0369 -5.1837 3 1127.9602179  71510 303892565      882662        syn-C2H3C(O)NH2, v=0
  378565.8410  0.0200 -3.0028 3  380.4752115 -71510 30357 552      56 651        syn-C2H3C(O)NH2, v=0
  378565.8483  0.0012 -5.1001 3  380.4752115  71510 30357 552      56 551        syn-C2H3C(O)NH2, v=0
  378565.8410  0.0200 -3.0028 3  380.4752115 -71510 30357 652      56 551        syn-C2H3C(O)NH2, v=0
  378565.8483  0.0012 -5.1001 3  380.4752115  71510 30357 652      56 651        syn-C2H3C(O)NH2, v=0
  378610.9267  0.0056 -4.2090 3  961.2295159  71510 303792950      792851        syn-C2H3C(O)NH2, v=0
  378610.9732  0.0056 -4.2090 3  961.2295159  71510 303792951      792852        syn-C2H3C(O)NH2, v=0
  378630.3392  0.0023 -4.7254 3  162.8473 69  71510 303341124      34 827        syn-C2H3C(O)NH2, v=0
  378670.9069  0.0200 -3.0361 3  377.2922113 -71510 30356 650      55 749        syn-C2H3C(O)NH2, v=0
  378670.9014  0.0012 -5.1036 3  377.2922113  71510 30356 750      55 749        syn-C2H3C(O)NH2, v=0
  378670.9026  0.0012 -5.1036 3  377.2922113  71510 30356 650      55 649        syn-C2H3C(O)NH2, v=0
  378670.9069  0.0200 -3.0361 3  377.2922113 -71510 30356 750      55 649        syn-C2H3C(O)NH2, v=0
  378729.7553  0.0787 -5.7920 3 1446.6766201  71510 303A03071      993168        syn-C2H3C(O)NH2, v=0
  378766.7545  0.0043 -4.1471 3   75.9452 51  71510 30325 520      24 421        syn-C2H3C(O)NH2, v=0
  378782.3971  0.0803 -5.7574 3 1806.9412225  71510 303B23379      B23280        syn-C2H3C(O)NH2, v=0
  378798.3443  0.0012 -5.1307 3  356.1014101  71510 303501536      491535        syn-C2H3C(O)NH2, v=0
  378810.3771  0.1579 -5.8111 3 1824.9647231  71510 303B52789      B52690        syn-C2H3C(O)NH2, v=0
  378842.1386  0.0042 -3.9123 3  562.9524141  71510 30370 565      70 466        syn-C2H3C(O)NH2, v=0
  378842.1386  0.0042 -3.9123 3  562.9524141  71510 30370 665      70 566        syn-C2H3C(O)NH2, v=0
  378860.1352  0.0200 -3.0733 3  373.5278111 -71510 30355 748      54 847        syn-C2H3C(O)NH2, v=0
  378860.1138  0.0011 -5.1057 3  373.5278111  71510 30355 848      54 847        syn-C2H3C(O)NH2, v=0
  378860.1589  0.0011 -5.1057 3  373.5278111  71510 30355 748      54 747        syn-C2H3C(O)NH2, v=0
  378860.1352  0.0200 -3.0733 3  373.5278111 -71510 30355 848      54 747        syn-C2H3C(O)NH2, v=0
  378871.2560  0.0012 -5.0519 3  317.4019 97  71510 303481236      471235        syn-C2H3C(O)NH2, v=0
  378929.7325  0.0793 -5.7915 3 1446.6762201  71510 303A03070      993169        syn-C2H3C(O)NH2, v=0
  379001.0759  0.0012 -5.2594 3  407.0624103  71510 303512032      502031        syn-C2H3C(O)NH2, v=0
  379001.1097  0.0012 -5.2594 3  407.0624103  71510 303512031      502030        syn-C2H3C(O)NH2, v=0
  379003.8417  0.0027 -4.3523 3  369.2094103  71510 303511536      511239        syn-C2H3C(O)NH2, v=0
  379077.6927  0.0200 -2.8165 3  105.5055 37 -71510 3031818 0      1717 1        syn-C2H3C(O)NH2, v=0
  379077.6927  0.0200 -2.8165 3  105.5055 37 -71510 3031818 1      1717 0        syn-C2H3C(O)NH2, v=0
  379123.3519  0.0200 -3.7192 3  649.7930125 -71510 303622834      622735        syn-C2H3C(O)NH2, v=0
  379123.3519  0.0200 -3.7192 3  649.7930125 -71510 303622835      622736        syn-C2H3C(O)NH2, v=0
  379135.0974  0.2642 -6.1978 3 2027.8462243  71510 303C12893      C12794        syn-C2H3C(O)NH2, v=0
  379146.2300  0.0009 -3.0669 3  135.4671 61  71510 303301219      291118        syn-C2H3C(O)NH2, v=0
  379164.3667  0.0040 -6.2497 3  718.8499105  71510 303524111      514110        syn-C2H3C(O)NH2, v=0
  379164.3667  0.0040 -6.2497 3  718.8499105  71510 303524112      514111        syn-C2H3C(O)NH2, v=0
  379186.9585  0.0011 -3.1161 3  369.1493109  71510 30354 846      53 945        syn-C2H3C(O)NH2, v=0
  379188.4572  0.0011 -5.1063 3  369.1493109  71510 30354 946      53 945        syn-C2H3C(O)NH2, v=0
  379189.6994  0.0011 -5.1063 3  369.1492109  71510 30354 846      53 845        syn-C2H3C(O)NH2, v=0
  379191.1639  0.0200 -3.1161 3  369.1492109 -71510 30354 946      53 845        syn-C2H3C(O)NH2, v=0
  379222.3674  0.0200 -3.0667 3  135.4649 61 -71510 303301218      291119        syn-C2H3C(O)NH2, v=0
  379308.3242  0.0036 -6.1766 3  699.8138105  71510 303524012      514011        syn-C2H3C(O)NH2, v=0
  379308.3242  0.0036 -6.1766 3  699.8138105  71510 303524013      514012        syn-C2H3C(O)NH2, v=0
  379322.7844  0.0011 -5.0967 3  344.7013101  71510 303501338      491337        syn-C2H3C(O)NH2, v=0
  379401.0741  0.0027 -5.2801 3   95.5317 51  71510 303251114      25 817        syn-C2H3C(O)NH2, v=0
  379459.5972  0.0031 -6.1076 3  681.2503105  71510 303523913      513912        syn-C2H3C(O)NH2, v=0
  379459.5972  0.0031 -6.1076 3  681.2503105  71510 303523914      513913        syn-C2H3C(O)NH2, v=0
  379459.8866  0.0300 -5.0859 3 1073.5809175  71510 303872464      862561        syn-C2H3C(O)NH2, v=0
  379476.5043  0.0263 -5.0071 3 1409.1823197  71510 303983167      983068        syn-C2H3C(O)NH2, v=0
  379507.7217  0.0200 -2.8472 3  106.7299 41 -71510 3032017 3      1916 4        syn-C2H3C(O)NH2, v=0
  379507.7217  0.0200 -2.8472 3  106.7299 41 -71510 3032017 4      1916 3        syn-C2H3C(O)NH2, v=0
  379508.3816  0.0053 -4.0006 3  728.0561155  71510 30377 968      77 869        syn-C2H3C(O)NH2, v=0
  379508.3816  0.0053 -4.0006 3  728.0561155  71510 303771068      77 969        syn-C2H3C(O)NH2, v=0
  379532.6218  0.0261 -5.0070 3 1409.1802197  71510 303983168      983069        syn-C2H3C(O)NH2, v=0
  379550.6530  0.0200 -3.1779 3  154.2813 67 -71510 303331123      321022        syn-C2H3C(O)NH2, v=0
  379619.0871  0.0028 -6.0421 3  663.1598105  71510 303523814      513813        syn-C2H3C(O)NH2, v=0
  379619.0871  0.0028 -6.0421 3  663.1598105  71510 303523815      513814        syn-C2H3C(O)NH2, v=0
  379716.2556  0.0200 -3.1677 3  364.1086107 -71510 30353 944      521043        syn-C2H3C(O)NH2, v=0
  379750.1443  0.0011 -5.1049 3  364.1086107  71510 303531044      521043        syn-C2H3C(O)NH2, v=0
  379764.2774  0.0200 -3.6977 3  634.5079123 -71510 303612833      612734        syn-C2H3C(O)NH2, v=0
  379764.2774  0.0200 -3.6977 3  634.5079123 -71510 303612834      612735        syn-C2H3C(O)NH2, v=0
  379775.5916  0.0011 -5.1048 3  364.1066107  71510 30353 944      52 943        syn-C2H3C(O)NH2, v=0
  379787.8230  0.0025 -5.9800 3  645.5430105  71510 303523715      513714        syn-C2H3C(O)NH2, v=0
  379787.8230  0.0025 -5.9800 3  645.5430105  71510 303523716      513715        syn-C2H3C(O)NH2, v=0
  379809.4701  0.0011 -3.1675 3  364.1066107  71510 303531044      52 943        syn-C2H3C(O)NH2, v=0
  379890.7552  0.0013 -5.0800 3  338.7899101  71510 303501139      491138        syn-C2H3C(O)NH2, v=0
  379908.8346  0.0200 -2.8794 3  109.4275 45 -71510 3032216 6      2115 7        syn-C2H3C(O)NH2, v=0
  379908.8346  0.0200 -2.8794 3  109.4275 45 -71510 3032216 7      2115 6        syn-C2H3C(O)NH2, v=0
  379926.7266  0.0052 -4.1739 3  941.5729157  71510 303782949      782850        syn-C2H3C(O)NH2, v=0
  379926.7499  0.0052 -4.1739 3  941.5729157  71510 303782950      782851        syn-C2H3C(O)NH2, v=0
  379966.9847  0.0022 -5.9207 3  628.4005105  71510 303523616      513615        syn-C2H3C(O)NH2, v=0
  379966.9847  0.0022 -5.9207 3  628.4005105  71510 303523617      513616        syn-C2H3C(O)NH2, v=0
  380019.5265  0.0252 -4.5949 3 1148.2443187  71510 303931776      931677        syn-C2H3C(O)NH2, v=0
  380020.4684  0.0252 -4.5949 3 1148.2443187  71510 303931876      931777        syn-C2H3C(O)NH2, v=0
  380052.6228  0.0012 -5.2311 3  398.2488103  71510 303511933      501932        syn-C2H3C(O)NH2, v=0
  380053.0763  0.0012 -5.2310 3  398.2488103  71510 303511932      501931        syn-C2H3C(O)NH2, v=0
  380067.4448  0.0011 -3.2363 3  358.3369105  71510 303521042      511141        syn-C2H3C(O)NH2, v=0
  380084.3293  0.0038 -5.0696 3   48.7969 45  71510 30322 220      21 121        syn-C2H3C(O)NH2, v=0
  380100.1722  0.0050 -5.0693 3  125.5798 63  71510 30331 824      31 527        syn-C2H3C(O)NH2, v=0
  380114.9877  0.0038 -5.0695 3   48.7969 45  71510 30322 320      21 021        syn-C2H3C(O)NH2, v=0
  380129.3849  0.0130 -4.5969 3 1184.5141179  71510 303893059      892960        syn-C2H3C(O)NH2, v=0
  380132.1398  0.0130 -4.5969 3 1184.5140179  71510 303893060      892961        syn-C2H3C(O)NH2, v=0
  380157.9305  0.0020 -5.8642 3  611.7329105  71510 303523517      513516        syn-C2H3C(O)NH2, v=0
  380157.9305  0.0020 -5.8642 3  611.7329105  71510 303523518      513517        syn-C2H3C(O)NH2, v=0
  380184.0403  0.0200 -3.0037 3  126.5763 57 -71510 303281316      271215        syn-C2H3C(O)NH2, v=0
  380185.0356  0.0200 -3.0037 3  126.5763 57 -71510 303281315      271216        syn-C2H3C(O)NH2, v=0
  380189.3979  0.0717 -5.7542 3 1806.8853225  71510 303B23380      B23281        syn-C2H3C(O)NH2, v=0
  380200.7257  0.0059 -3.9847 3  493.3836135  71510 30367 364      67 265        syn-C2H3C(O)NH2, v=0
  380200.7257  0.0059 -3.9847 3  493.3836135  71510 30367 464      67 365        syn-C2H3C(O)NH2, v=0
  380234.0986  0.0200 -2.9146 3  113.6147 49 -71510 3032415 9      231410        syn-C2H3C(O)NH2, v=0
  380234.0986  0.0200 -2.9146 3  113.6147 49 -71510 303241510      2314 9        syn-C2H3C(O)NH2, v=0
  380254.2594  0.0012 -5.1098 3  350.1829101  71510 303501437      491436        syn-C2H3C(O)NH2, v=0
  380323.3467  0.0012 -5.1273 3  356.1770101  71510 303501535      491534        syn-C2H3C(O)NH2, v=0
  380362.2314  0.0018 -5.8102 3  595.5410105  71510 303523418      513417        syn-C2H3C(O)NH2, v=0
  380362.2314  0.0018 -5.8102 3  595.5410105  71510 303523419      513418        syn-C2H3C(O)NH2, v=0
  380372.7182  0.0200 -3.6771 3  619.4779121 -71510 303602832      602733        syn-C2H3C(O)NH2, v=0
  380372.7182  0.0200 -3.6771 3  619.4779121 -71510 303602833      602734        syn-C2H3C(O)NH2, v=0
  380390.0674  0.0200 -2.9549 3  119.3170 53 -71510 303261413      251312        syn-C2H3C(O)NH2, v=0
  380390.0674  0.0200 -2.9549 3  119.3170 53 -71510 303261412      251313        syn-C2H3C(O)NH2, v=0
  380428.5423  0.0665 -5.4570 3 1156.0708183  71510 303912369      902466        syn-C2H3C(O)NH2, v=0
  380476.6656  0.0493 -5.2818 3 1183.8087183  71510 303912665      902764        syn-C2H3C(O)NH2, v=0
  380581.7144  0.0017 -5.7586 3  579.8258105  71510 303523319      513318        syn-C2H3C(O)NH2, v=0
  380581.7144  0.0017 -5.7586 3  579.8258105  71510 303523320      513319        syn-C2H3C(O)NH2, v=0
  380597.3817  0.0063 -4.0528 3  776.2535159  71510 303791069      79 970        syn-C2H3C(O)NH2, v=0
  380597.3817  0.0063 -4.0528 3  776.2535159  71510 303791169      791070        syn-C2H3C(O)NH2, v=0
  380633.0772  0.0011 -5.1011 3  358.3369105  71510 303521142      511141        syn-C2H3C(O)NH2, v=0
  380675.4674  0.0450 -5.3641 3 1601.5155211  71510 303A53273      A53174        syn-C2H3C(O)NH2, v=0
  380718.1099  0.0032 -6.2555 3  507.0894115  71510 303572236      581939        syn-C2H3C(O)NH2, v=0
  380730.3184  0.0057 -4.5875 3  253.6105 87  71510 303431132      43 835        syn-C2H3C(O)NH2, v=0
  380760.7080  0.2132 -6.1077 3 1420.0971203  71510 303A12577      A02674        syn-C2H3C(O)NH2, v=0
  380768.4307  0.0086 -4.3198 3  426.7861129  71510 30364 163      64 064        syn-C2H3C(O)NH2, v=0
  380768.4307  0.0086 -4.3198 3  426.7861129  71510 30364 263      64 164        syn-C2H3C(O)NH2, v=0
  380795.1301  0.0703 -5.6659 3 1384.5341197  71510 303982970      973067        syn-C2H3C(O)NH2, v=0
  380810.2897  0.0032 -6.2553 3  507.0864115  71510 303572235      581940        syn-C2H3C(O)NH2, v=0
  380818.5150  0.0016 -5.7092 3  564.5881105  71510 303523220      513219        syn-C2H3C(O)NH2, v=0
  380818.5150  0.0016 -5.7092 3  564.5881105  71510 303523221      513220        syn-C2H3C(O)NH2, v=0
  380874.5412  0.0041 -3.9201 3  606.6842145  71510 30372 666      72 567        syn-C2H3C(O)NH2, v=0
  380874.5412  0.0041 -3.9201 3  606.6842145  71510 30372 766      72 667        syn-C2H3C(O)NH2, v=0
  380891.5529  0.0020 -5.6523 3   31.7329 31  71510 30315 8 7      14 510        syn-C2H3C(O)NH2, v=0
  380927.1790  0.0028 -3.3414 3  209.4324 79  71510 303391129      381028        syn-C2H3C(O)NH2, v=0
  380950.0510  0.0016 -3.6575 3  604.7024119  71510 303592831      592732        syn-C2H3C(O)NH2, v=0
  380950.0510  0.0016 -3.6575 3  604.7024119  71510 303592832      592733        syn-C2H3C(O)NH2, v=0
  380951.8581  0.1904 -5.9971 3 1925.1399237  71510 303B82891      B82792        syn-C2H3C(O)NH2, v=0
  380977.3287  0.0438 -5.3634 3 1601.5038211  71510 303A53274      A53175        syn-C2H3C(O)NH2, v=0
  381004.4277  0.0011 -5.1001 3  358.3057105  71510 303521042      511041        syn-C2H3C(O)NH2, v=0
  381041.4786  0.1120 -5.4992 3 1659.3885221  71510 303B02486      B02387        syn-C2H3C(O)NH2, v=0
  381069.6733  0.0486 -4.9391 3 1349.9596201  71510 303A02080      A01981        syn-C2H3C(O)NH2, v=0
  381075.1454  0.0015 -5.6619 3  549.8291105  71510 303523121      513120        syn-C2H3C(O)NH2, v=0
  381075.1454  0.0015 -5.6619 3  549.8291105  71510 303523122      513121        syn-C2H3C(O)NH2, v=0
  381087.0406  0.0486 -4.9391 3 1349.9597201  71510 303A02180      A02081        syn-C2H3C(O)NH2, v=0
  381124.8075  0.0205 -4.5014 3 1091.4481183  71510 303911675      911576        syn-C2H3C(O)NH2, v=0
  381125.0814  0.0205 -4.5014 3 1091.4481183  71510 303911775      911676        syn-C2H3C(O)NH2, v=0
  381180.0424  0.0048 -4.1396 3  922.1796155  71510 303772948      772849        syn-C2H3C(O)NH2, v=0
  381180.0539  0.0048 -4.1396 3  922.1796155  71510 303772949      772850        syn-C2H3C(O)NH2, v=0
  381183.2828  0.0023 -5.1875 3  101.9030 53  71510 303261116      26 819        syn-C2H3C(O)NH2, v=0
  381251.7013  0.0390 -5.0332 3 1051.7224173  71510 303862462      852561        syn-C2H3C(O)NH2, v=0
  381290.8949  0.0715 -5.6648 3 1384.5328197  71510 303982969      973068        syn-C2H3C(O)NH2, v=0
  381320.8023  0.0011 -5.0960 3  351.7920103  71510 303511240      501239        syn-C2H3C(O)NH2, v=0
  381335.2533  0.0012 -5.2038 3  389.9826103  71510 303511834      501833        syn-C2H3C(O)NH2, v=0
  381340.4650  0.0012 -5.2038 3  389.9827103  71510 303511833      501832        syn-C2H3C(O)NH2, v=0
  381354.5802  0.0014 -5.6166 3  535.5501105  71510 303523022      513021        syn-C2H3C(O)NH2, v=0
  381354.5802  0.0014 -5.6166 3  535.5501105  71510 303523023      513022        syn-C2H3C(O)NH2, v=0
  381422.1725  0.0065 -5.1021 3  132.9656 65  71510 30332 725      32 428        syn-C2H3C(O)NH2, v=0
  381427.3374  0.0075 -4.1124 3  825.7015163  71510 303811170      811071        syn-C2H3C(O)NH2, v=0
  381427.3376  0.0075 -4.1124 3  825.7015163  71510 303811270      811171        syn-C2H3C(O)NH2, v=0
  381428.7402  0.1097 -5.4984 3 1659.3906221  71510 303B02586      B02487        syn-C2H3C(O)NH2, v=0
  381475.5197  0.0021 -5.4960 3   35.6495 33  71510 30316 8 9      15 510        syn-C2H3C(O)NH2, v=0
  381492.0281  0.1041 -6.1130 3 1995.1031237  71510 303B83485      B83386        syn-C2H3C(O)NH2, v=0
  381497.6780  0.0016 -3.6387 3  590.1809117  71510 303582830      582731        syn-C2H3C(O)NH2, v=0
  381497.6780  0.0016 -3.6387 3  590.1809117  71510 303582831      582732        syn-C2H3C(O)NH2, v=0
  381570.0601  0.0011 -3.2327 3  358.3057105  71510 303521142      511041        syn-C2H3C(O)NH2, v=0
  381660.3681  0.0014 -5.5732 3  521.7526105  71510 303522923      512922        syn-C2H3C(O)NH2, v=0
  381660.3681  0.0014 -5.5732 3  521.7526105  71510 303522924      512923        syn-C2H3C(O)NH2, v=0
  381781.3468  0.0047 -3.9134 3  500.5754121  71510 303601545      591644        syn-C2H3C(O)NH2, v=0
  381846.2003  0.0166 -4.4127 3 1035.8566179  71510 303891574      891475        syn-C2H3C(O)NH2, v=0
  381846.2761  0.0166 -4.4127 3 1035.8566179  71510 303891674      891575        syn-C2H3C(O)NH2, v=0
  381975.4727  0.0024 -5.0469 3   45.6020 39  71510 30319 712      18 415        syn-C2H3C(O)NH2, v=0
  381984.4017  0.0091 -4.1787 3  876.3932167  71510 303831271      831172        syn-C2H3C(O)NH2, v=0
  381984.4029  0.0091 -4.1787 3  876.3932167  71510 303831371      831272        syn-C2H3C(O)NH2, v=0
  381996.7775  0.0013 -5.5316 3  508.4384105  71510 303522824      512823        syn-C2H3C(O)NH2, v=0
  381996.7775  0.0013 -5.5316 3  508.4384105  71510 303522825      512824        syn-C2H3C(O)NH2, v=0
  381998.6768  0.0120 -4.5543 3 1162.2474177  71510 303883058      882959        syn-C2H3C(O)NH2, v=0
  382000.1772  0.0120 -4.5543 3 1162.2473177  71510 303883059      882960        syn-C2H3C(O)NH2, v=0
  382016.8392  0.0016 -3.6209 3  575.9130115  71510 303572829      572730        syn-C2H3C(O)NH2, v=0
  382016.8392  0.0016 -3.6209 3  575.9130115  71510 303572830      572731        syn-C2H3C(O)NH2, v=0
  382030.2035  0.0242 -4.9575 3 1384.5341195  71510 303973166      973067        syn-C2H3C(O)NH2, v=0
  382048.4297  0.0744 -5.2078 3 1501.0320211  71510 303A52283      A52184        syn-C2H3C(O)NH2, v=0
  382062.7702  0.0241 -4.9574 3 1384.5328195  71510 303973167      973068        syn-C2H3C(O)NH2, v=0
  382135.1662  0.0740 -5.2076 3 1501.0324211  71510 303A52383      A52284        syn-C2H3C(O)NH2, v=0
  382213.7471  0.0136 -4.3292 3  981.4783175  71510 303871473      871374        syn-C2H3C(O)NH2, v=0
  382213.7670  0.0136 -4.3292 3  981.4783175  71510 303871573      871474        syn-C2H3C(O)NH2, v=0
  382252.6691  0.0111 -4.2511 3  928.3213171  71510 303851372      851273        syn-C2H3C(O)NH2, v=0
  382252.6740  0.0111 -4.2511 3  928.3213171  71510 303851472      851373        syn-C2H3C(O)NH2, v=0
  382368.9913  0.0013 -5.4918 3  495.6095105  71510 303522725      512724        syn-C2H3C(O)NH2, v=0
  382368.9913  0.0013 -5.4918 3  495.6095105  71510 303522726      512725        syn-C2H3C(O)NH2, v=0
  382374.0860  0.0044 -4.1061 3  903.0489153  71510 303762947      762848        syn-C2H3C(O)NH2, v=0
  382374.0917  0.0044 -4.1061 3  903.0489153  71510 303762948      762849        syn-C2H3C(O)NH2, v=0
  382508.7536  0.0015 -3.6041 3  561.8984113  71510 303562828      562729        syn-C2H3C(O)NH2, v=0
  382508.7536  0.0015 -3.6041 3  561.8984113  71510 303562829      562730        syn-C2H3C(O)NH2, v=0
  382648.1720  0.0052 -3.9421 3  535.1452139  71510 30369 465      69 366        syn-C2H3C(O)NH2, v=0
  382648.1720  0.0052 -3.9421 3  535.1452139  71510 30369 565      69 466        syn-C2H3C(O)NH2, v=0
  382692.6506  0.0044 -3.9432 3  651.6938149  71510 30374 767      74 668        syn-C2H3C(O)NH2, v=0
  382692.6506  0.0044 -3.9432 3  651.6938149  71510 30374 867      74 768        syn-C2H3C(O)NH2, v=0
  382783.3700  0.0013 -5.4537 3  483.2686105  71510 303522626      512625        syn-C2H3C(O)NH2, v=0
  382783.3700  0.0013 -5.4537 3  483.2686105  71510 303522627      512626        syn-C2H3C(O)NH2, v=0
  382822.9726  0.2273 -6.1897 3 2027.8720243  71510 303C12993      C12894        syn-C2H3C(O)NH2, v=0
  382861.8876  0.0026 -6.2243 3  369.7841 97  71510 303482029      491732        syn-C2H3C(O)NH2, v=0
  382891.9008  0.0026 -6.2242 3  369.7831 97  71510 303482028      491733        syn-C2H3C(O)NH2, v=0
  382931.5169  0.0012 -5.1776 3  382.2876103  71510 303511735      501734        syn-C2H3C(O)NH2, v=0
  382974.5869  0.0015 -3.5883 3  548.1365111  71510 303552827      552728        syn-C2H3C(O)NH2, v=0
  382974.5869  0.0015 -3.5883 3  548.1365111  71510 303552828      552729        syn-C2H3C(O)NH2, v=0
  382981.9036  0.0012 -5.1775 3  382.2895103  71510 303511734      501733        syn-C2H3C(O)NH2, v=0
  383000.1230  0.0714 -5.6957 3 1778.5415223  71510 303B13378      B13279        syn-C2H3C(O)NH2, v=0
  383145.4302  0.0624 -5.5431 3 1323.8389193  71510 303962869      952966        syn-C2H3C(O)NH2, v=0
  383175.1585  0.1171 -6.0536 3 1965.2223235  71510 303B73483      B73384        syn-C2H3C(O)NH2, v=0
  383204.3435  0.0044 -4.9007 3  145.6064 67  71510 30333 925      33 628        syn-C2H3C(O)NH2, v=0
  383231.3608  0.0012 -3.3300 3  364.5115105  71510 303521141      511240        syn-C2H3C(O)NH2, v=0
  383247.8159  0.0013 -5.4171 3  471.4187105  71510 303522527      512526        syn-C2H3C(O)NH2, v=0
  383247.8159  0.0013 -5.4171 3  471.4187105  71510 303522528      512527        syn-C2H3C(O)NH2, v=0
  383394.5999  0.0042 -5.9459 3   70.3695 47  71510 30323 815      23 320        syn-C2H3C(O)NH2, v=0
  383413.4921  0.0401 -4.8304 3 1288.9852197  71510 303981979      981880        syn-C2H3C(O)NH2, v=0
  383415.4548  0.0015 -3.5736 3  534.6271109  71510 303542826      542727        syn-C2H3C(O)NH2, v=0
  383415.4548  0.0015 -3.5736 3  534.6271109  71510 303542827      542728        syn-C2H3C(O)NH2, v=0
  383419.2033  0.0400 -4.8304 3 1288.9852197  71510 303982079      981980        syn-C2H3C(O)NH2, v=0
  383433.3644  0.0043 -5.3129 3   42.8669 39  71510 30319 613      18 316        syn-C2H3C(O)NH2, v=0
  383477.8878  0.0013 -3.1973 3  162.6856 69  71510 303341124      331023        syn-C2H3C(O)NH2, v=0
  383511.8329  0.0041 -4.0734 3  884.1800151  71510 303752946      752847        syn-C2H3C(O)NH2, v=0
  383511.8357  0.0041 -4.0734 3  884.1800151  71510 303752947      752848        syn-C2H3C(O)NH2, v=0
  383540.6191  0.0037 -4.6114 3   57.5759 47  71510 30323 320      22 221        syn-C2H3C(O)NH2, v=0
  383595.2661  0.0075 -4.0964 3  466.5521133  71510 30366 264      66 165        syn-C2H3C(O)NH2, v=0
  383595.2661  0.0075 -4.0964 3  466.5521133  71510 30366 364      66 265        syn-C2H3C(O)NH2, v=0
  383667.3823  0.0056 -4.5086 3  292.2228 93  71510 303461234      46 937        syn-C2H3C(O)NH2, v=0
  383693.5310  0.1390 -5.6740 3 1755.2510227  71510 303B32588      B32489        syn-C2H3C(O)NH2, v=0
  383772.2903  0.0012 -5.3822 3  460.0634105  71510 303522428      512427        syn-C2H3C(O)NH2, v=0
  383772.2903  0.0012 -5.3822 3  460.0634105  71510 303522429      512428        syn-C2H3C(O)NH2, v=0
  383776.4723  0.0111 -4.5125 3 1140.2501175  71510 303873057      872958        syn-C2H3C(O)NH2, v=0
  383777.2804  0.0111 -4.5125 3 1140.2501175  71510 303873058      872959        syn-C2H3C(O)NH2, v=0
  383802.2778  0.1240 -5.7661 3 1284.6394193  71510 303962473      952570        syn-C2H3C(O)NH2, v=0
  383832.4261  0.0015 -3.5599 3  521.3697107  71510 303532825      532726        syn-C2H3C(O)NH2, v=0
  383832.4261  0.0015 -3.5599 3  521.3697107  71510 303532826      532727        syn-C2H3C(O)NH2, v=0
  383834.4035  0.0037 -4.6109 3   57.5759 47  71510 30323 420      22 121        syn-C2H3C(O)NH2, v=0
  383878.8630  0.0411 -5.3088 3 1575.0071209  71510 303A43272      A43173        syn-C2H3C(O)NH2, v=0
  383884.4145  0.0663 -5.6937 3 1778.5066223  71510 303B13379      B13280        syn-C2H3C(O)NH2, v=0
  383958.8013  0.0024 -5.2739 3   95.3796 51  71510 303251115      25 818        syn-C2H3C(O)NH2, v=0
  384009.2672  0.0025 -4.7034 3  171.4707 71  71510 303351125      35 828        syn-C2H3C(O)NH2, v=0
  384060.1225  0.0022 -5.3476 3   39.7531 35  71510 30317 810      16 511        syn-C2H3C(O)NH2, v=0
  384061.1240  0.0404 -5.3084 3 1575.0001209  71510 303A43273      A43174        syn-C2H3C(O)NH2, v=0
  384086.7563  0.0026 -5.3702 3   89.2012 49  71510 303241113      24 816        syn-C2H3C(O)NH2, v=0
  384127.8313  0.0017 -3.4635 3  383.3474107  71510 303531241      521340        syn-C2H3C(O)NH2, v=0
  384154.5550  0.0039 -4.3349 3   66.6335 49  71510 30324 420      23 321        syn-C2H3C(O)NH2, v=0
  384226.5264  0.0014 -3.5473 3  508.3640105  71510 303522824      522725        syn-C2H3C(O)NH2, v=0
  384226.5264  0.0014 -3.5473 3  508.3640105  71510 303522825      522726        syn-C2H3C(O)NH2, v=0
  384288.4808  0.0050 -3.9783 3  697.9745153  71510 30376 868      76 769        syn-C2H3C(O)NH2, v=0
  384288.4808  0.0050 -3.9783 3  697.9745153  71510 30376 968      76 869        syn-C2H3C(O)NH2, v=0
  384320.8643  0.1347 -5.6726 3 1755.2546227  71510 303B32688      B32589        syn-C2H3C(O)NH2, v=0
  384343.9801  0.0650 -5.5403 3 1323.8358193  71510 303962868      952967        syn-C2H3C(O)NH2, v=0
  384369.5660  0.0012 -5.3488 3  449.2076105  71510 303522329      512328        syn-C2H3C(O)NH2, v=0
  384369.5660  0.0012 -5.3488 3  449.2076105  71510 303522330      512329        syn-C2H3C(O)NH2, v=0
  384444.7656  0.0223 -4.9087 3 1360.1625193  71510 303963165      963066        syn-C2H3C(O)NH2, v=0
  384463.4617  0.0223 -4.9087 3 1360.1618193  71510 303963166      963067        syn-C2H3C(O)NH2, v=0
  384532.9875  0.0014 -5.0883 3  399.3637123  71510 30361 259      60 258        syn-C2H3C(O)NH2, v=0
  384532.9526  0.0200 -2.9213 3  399.3637123 -71510 30361 259      60 358        syn-C2H3C(O)NH2, v=0
  384532.9526  0.0200 -2.9213 3  399.3637123 -71510 30361 359      60 258        syn-C2H3C(O)NH2, v=0
  384532.9875  0.0014 -5.0883 3  399.3637123  71510 30361 359      60 358        syn-C2H3C(O)NH2, v=0
  384535.0829  0.0013 -5.0949 3  397.8084121  71510 30360 357      59 356        syn-C2H3C(O)NH2, v=0
  384535.0829  0.0013 -2.9478 3  397.8084121  71510 30360 357      59 456        syn-C2H3C(O)NH2, v=0
  384535.0829  0.0013 -2.9478 3  397.8084121  71510 30360 457      59 356        syn-C2H3C(O)NH2, v=0
  384535.0829  0.0013 -5.0949 3  397.8084121  71510 30360 457      59 456        syn-C2H3C(O)NH2, v=0
  384535.4451  0.0026 -3.3139 3  199.4560 77  71510 303381128      371027        syn-C2H3C(O)NH2, v=0
  384540.2536  0.0017 -5.0806 3  400.4016125  71510 30362 161      61 160        syn-C2H3C(O)NH2, v=0
  384540.2626  0.0200 -2.8958 3  400.4016125 -71510 30362 161      61 260        syn-C2H3C(O)NH2, v=0
  384540.2626  0.0200 -2.8958 3  400.4016125 -71510 30362 261      61 160        syn-C2H3C(O)NH2, v=0
  384540.2536  0.0017 -5.0806 3  400.4016125  71510 30362 261      61 260        syn-C2H3C(O)NH2, v=0
  384551.1148  0.0022 -5.0720 3  400.9300127  71510 30363 063      62 062        syn-C2H3C(O)NH2, v=0
  384551.0962  0.0200 -2.8711 3  400.9300127 -71510 30363 063      62 162        syn-C2H3C(O)NH2, v=0
  384551.0962  0.0200 -2.8711 3  400.9300127 -71510 30363 163      62 062        syn-C2H3C(O)NH2, v=0
  384551.1148  0.0022 -5.0720 3  400.9300127  71510 30363 163      62 162        syn-C2H3C(O)NH2, v=0
  384554.8733  0.0013 -5.1006 3  395.7256119  71510 30359 455      58 454        syn-C2H3C(O)NH2, v=0
  384554.8961  0.0200 -2.9756 3  395.7256119 -71510 30359 455      58 554        syn-C2H3C(O)NH2, v=0
  384554.8961  0.0200 -2.9756 3  395.7256119 -71510 30359 555      58 454        syn-C2H3C(O)NH2, v=0
  384554.8733  0.0013 -5.1006 3  395.7256119  71510 30359 555      58 554        syn-C2H3C(O)NH2, v=0
  384596.0473  0.0038 -4.0416 3  865.5724149  71510 303742945      742846        syn-C2H3C(O)NH2, v=0
  384596.0486  0.0038 -4.0416 3  865.5724149  71510 303742946      742847        syn-C2H3C(O)NH2, v=0
  384598.6940  0.0200 -3.5359 3  495.6095103 -71510 303512823      512724        syn-C2H3C(O)NH2, v=0
  384598.6940  0.0200 -3.5359 3  495.6095103 -71510 303512824      512725        syn-C2H3C(O)NH2, v=0
  384604.6795  0.0012 -5.1051 3  393.1028117  71510 30358 553      57 552        syn-C2H3C(O)NH2, v=0
  384604.7303  0.0200 -3.0053 3  393.1028117 -71510 30358 553      57 652        syn-C2H3C(O)NH2, v=0
  384604.6795  0.0012 -5.1051 3  393.1028117  71510 30358 653      57 652        syn-C2H3C(O)NH2, v=0
  384604.7303  0.0200 -3.0053 3  393.1028117 -71510 30358 653      57 552        syn-C2H3C(O)NH2, v=0
  384703.2767  0.0200 -3.0376 3  389.9233115 -71510 30357 651      56 750        syn-C2H3C(O)NH2, v=0
  384703.2822  0.0012 -5.1084 3  389.9233115  71510 30357 751      56 750        syn-C2H3C(O)NH2, v=0
  384703.2829  0.0012 -5.1084 3  389.9233115  71510 30357 651      56 650        syn-C2H3C(O)NH2, v=0
  384703.2767  0.0200 -3.0376 3  389.9233115 -71510 30357 751      56 650        syn-C2H3C(O)NH2, v=0
  384711.2417  0.0012 -5.0871 3  351.4617103  71510 303511140      501139        syn-C2H3C(O)NH2, v=0
  384752.0083  0.0200 -3.1693 3  154.1401 67 -71510 303331122      321023        syn-C2H3C(O)NH2, v=0
  384764.3434  0.0023 -4.5894 3   64.5355 45  71510 30322 815      21 516        syn-C2H3C(O)NH2, v=0
  384777.6071  0.1167 -6.2134 3 1668.2568215  71510 303A73375      A63472        syn-C2H3C(O)NH2, v=0
  384797.9030  0.1168 -6.2134 3 1668.2568215  71510 303A73374      A63473        syn-C2H3C(O)NH2, v=0
  384880.5361  0.0200 -3.0735 3  386.1653113 -71510 30356 749      55 848        syn-C2H3C(O)NH2, v=0
  384880.5177  0.0011 -5.1105 3  386.1653113  71510 30356 849      55 848        syn-C2H3C(O)NH2, v=0
  384880.5416  0.0011 -5.1105 3  386.1653113  71510 30356 749      55 748        syn-C2H3C(O)NH2, v=0
  384880.5361  0.0200 -3.0735 3  386.1653113 -71510 30356 849      55 748        syn-C2H3C(O)NH2, v=0
  384892.1504  0.0025 -4.7484 3   59.0510 43  71510 30321 814      20 515        syn-C2H3C(O)NH2, v=0
  384898.2604  0.0047 -3.9304 3  578.1973143  71510 30371 566      71 467        syn-C2H3C(O)NH2, v=0
  384898.2604  0.0047 -3.9304 3  578.1973143  71510 30371 666      71 567        syn-C2H3C(O)NH2, v=0
  384900.0996  0.0012 -5.1522 3  375.1962103  71510 303511636      501635        syn-C2H3C(O)NH2, v=0
  384950.0137  0.0014 -3.5257 3  483.1060101  71510 303502822      502723        syn-C2H3C(O)NH2, v=0
  384950.0137  0.0014 -3.5257 3  483.1060101  71510 303502823      502724        syn-C2H3C(O)NH2, v=0
  385028.4869  0.0027 -3.6112 3  416.1321111  71510 303551342      541441        syn-C2H3C(O)NH2, v=0
  385056.3661  0.0012 -5.3168 3  438.8571105  71510 303522231      512230        syn-C2H3C(O)NH2, v=0
  385056.3664  0.0012 -5.3168 3  438.8571105  71510 303522230      512229        syn-C2H3C(O)NH2, v=0
  385185.5919  0.0011 -3.1145 3  381.7977111  71510 30355 847      54 946        syn-C2H3C(O)NH2, v=0
  385186.4068  0.0011 -5.1109 3  381.7977111  71510 30355 947      54 946        syn-C2H3C(O)NH2, v=0
  385187.0906  0.0011 -5.1109 3  381.7976111  71510 30355 847      54 846        syn-C2H3C(O)NH2, v=0
  385187.9061  0.0200 -3.1145 3  381.7976111 -71510 30355 947      54 846        syn-C2H3C(O)NH2, v=0
  385262.7356  0.0329 -4.7263 3 1229.1894193  71510 303961878      961779        syn-C2H3C(O)NH2, v=0
  385263.4848  0.0013 -5.0658 3  333.5162 99  71510 303491336      481335        syn-C2H3C(O)NH2, v=0
  385264.5322  0.0329 -4.7263 3 1229.1894193  71510 303961978      961879        syn-C2H3C(O)NH2, v=0
  385281.2986  0.0200 -3.5168 3  470.8531 99 -71510 303492821      492722        syn-C2H3C(O)NH2, v=0
  385281.2986  0.0200 -3.5168 3  470.8531 99 -71510 303492822      492723        syn-C2H3C(O)NH2, v=0
  385297.5852  0.0012 -5.1514 3  375.2136103  71510 303511635      501634        syn-C2H3C(O)NH2, v=0
  385299.1165  0.0239 -5.0431 3 1042.4109173  71510 303862364      852461        syn-C2H3C(O)NH2, v=0
  385371.8906  0.0618 -5.0889 3 1437.1084207  71510 303A32182      A32083        syn-C2H3C(O)NH2, v=0
  385402.5042  0.0617 -5.0889 3 1437.1085207  71510 303A32282      A32183        syn-C2H3C(O)NH2, v=0
  385417.1498  0.0025 -4.9053 3   53.8142 41  71510 30320 813      19 514        syn-C2H3C(O)NH2, v=0
  385432.3679  0.0023 -5.2029 3   44.1523 37  71510 30318 811      17 512        syn-C2H3C(O)NH2, v=0
  385468.4815  0.0103 -4.4715 3 1118.5212173  71510 303863056      862957        syn-C2H3C(O)NH2, v=0
  385468.9119  0.0103 -4.4715 3 1118.5212173  71510 303863057      862958        syn-C2H3C(O)NH2, v=0
  385526.5308  0.0057 -4.0371 3  553.6103127  71510 303631647      621746        syn-C2H3C(O)NH2, v=0
  385584.1495  0.0975 -6.0482 3 1965.1257235  71510 303B73484      B73385        syn-C2H3C(O)NH2, v=0
  385593.4020  0.0200 -3.5092 3  458.8504 97 -71510 303482820      482721        syn-C2H3C(O)NH2, v=0
  385593.4020  0.0200 -3.5092 3  458.8504 97 -71510 303482821      482722        syn-C2H3C(O)NH2, v=0
  385626.8108  0.0931 -5.3700 3 1592.5529217  71510 303A82385      A82286        syn-C2H3C(O)NH2, v=0
  385629.3042  0.0035 -4.0105 3  847.2253147  71510 303732944      732845        syn-C2H3C(O)NH2, v=0
  385629.3048  0.0035 -4.0105 3  847.2253147  71510 303732945      732846        syn-C2H3C(O)NH2, v=0
  385640.9209  0.0021 -4.4343 3   70.2480 47  71510 30323 816      22 517        syn-C2H3C(O)NH2, v=0
  385653.0528  0.0059 -4.0232 3  745.5200157  71510 30378 969      78 870        syn-C2H3C(O)NH2, v=0
  385653.0528  0.0059 -4.0232 3  745.5200157  71510 303781069      78 970        syn-C2H3C(O)NH2, v=0
  385682.2047  0.0549 -5.4242 3 1264.5970189  71510 303942768      932865        syn-C2H3C(O)NH2, v=0
  385686.6603  0.0012 -5.0541 3  330.0397 99  71510 303491237      481236        syn-C2H3C(O)NH2, v=0
  385688.2400  0.0200 -3.1634 3  376.7757109 -71510 30354 945      531044        syn-C2H3C(O)NH2, v=0
  385707.4420  0.0011 -5.1095 3  376.7757109  71510 303541045      531044        syn-C2H3C(O)NH2, v=0
  385722.1199  0.0011 -5.1095 3  376.7746109  71510 30354 945      53 944        syn-C2H3C(O)NH2, v=0
  385741.3517  0.0200 -3.1633 3  376.7746109 -71510 303541045      53 944        syn-C2H3C(O)NH2, v=0
  385763.3564  0.0024 -5.0567 3   48.8429 39  71510 30319 812      18 513        syn-C2H3C(O)NH2, v=0
  385773.2006  0.0923 -5.3697 3 1592.5536217  71510 303A82485      A82386        syn-C2H3C(O)NH2, v=0
  385847.7718  0.0009 -3.0704 3  142.9413 63  71510 303311220      301119        syn-C2H3C(O)NH2, v=0
  385855.1551  0.0012 -5.2862 3  429.0194105  71510 303522132      512131        syn-C2H3C(O)NH2, v=0
  385855.1600  0.0012 -5.2862 3  429.0194105  71510 303522131      512130        syn-C2H3C(O)NH2, v=0
  385887.1256  0.0014 -3.5030 3  447.0976 95  71510 303472819      472720        syn-C2H3C(O)NH2, v=0
  385887.1256  0.0014 -3.5030 3  447.0976 95  71510 303472820      472721        syn-C2H3C(O)NH2, v=0
  385906.6720  0.1720 -5.8558 3 1853.6838233  71510 303B62690      B62591        syn-C2H3C(O)NH2, v=0
  386005.5630  0.0009 -3.0701 3  142.9368 63  71510 303311219      301120        syn-C2H3C(O)NH2, v=0
  386061.2673  0.0039 -4.3429 3  409.8648109  71510 303541539      541242        syn-C2H3C(O)NH2, v=0
  386120.2327  0.0036 -4.3320 3   66.6329 49  71510 30324 520      23 221        syn-C2H3C(O)NH2, v=0
  386153.8764  0.0016 -3.2217 3  171.3992 71  71510 303351125      341024        syn-C2H3C(O)NH2, v=0
  386163.3736  0.0200 -3.4983 3  435.5945 93 -71510 303462818      462719        syn-C2H3C(O)NH2, v=0
  386163.3736  0.0200 -3.4983 3  435.5945 93 -71510 303462819      462720        syn-C2H3C(O)NH2, v=0
  386212.8544  0.0200 -3.2268 3  371.0335107 -71510 303531043      521142        syn-C2H3C(O)NH2, v=0
  386228.8360  0.1054 -6.0775 3 1601.3286211  71510 303A53274      A43371        syn-C2H3C(O)NH2, v=0
  386238.1241  0.0065 -4.0009 3  507.6212137  71510 30368 365      68 266        syn-C2H3C(O)NH2, v=0
  386238.1241  0.0065 -4.0009 3  507.6212137  71510 30368 465      68 366        syn-C2H3C(O)NH2, v=0
  386267.8749  0.0012 -5.0983 3  357.3541103  71510 303511339      501338        syn-C2H3C(O)NH2, v=0
  386281.5961  0.1056 -6.0774 3 1601.3285211  71510 303A53273      A43372        syn-C2H3C(O)NH2, v=0
  386365.0616  0.0200 -2.8109 3  109.8878 39 -71510 3031918 1      1817 2        syn-C2H3C(O)NH2, v=0
  386365.0616  0.0200 -2.8109 3  109.8878 39 -71510 3031918 2      1817 1        syn-C2H3C(O)NH2, v=0
  386422.9734  0.0200 -3.4953 3  424.3407 91 -71510 303452817      452718        syn-C2H3C(O)NH2, v=0
  386422.9734  0.0200 -3.4953 3  424.3407 91 -71510 303452818      452719        syn-C2H3C(O)NH2, v=0
  386522.9876  0.0040 -6.2254 3  731.4975107  71510 303534112      524111        syn-C2H3C(O)NH2, v=0
  386522.9876  0.0040 -6.2254 3  731.4975107  71510 303534113      524112        syn-C2H3C(O)NH2, v=0
  386548.7896  0.0030 -4.3951 3  355.9693101  71510 303501535      501238        syn-C2H3C(O)NH2, v=0
  386550.5539  0.0011 -5.1057 3  371.0335107  71510 303531143      521142        syn-C2H3C(O)NH2, v=0
  386614.0085  0.0032 -3.9802 3  829.1381145  71510 303722943      722844        syn-C2H3C(O)NH2, v=0
  386614.0088  0.0032 -3.9802 3  829.1381145  71510 303722944      722845        syn-C2H3C(O)NH2, v=0
  386666.5963  0.0014 -3.4940 3  413.3358 89  71510 303442816      442717        syn-C2H3C(O)NH2, v=0
  386666.5963  0.0014 -3.4940 3  413.3358 89  71510 303442817      442718        syn-C2H3C(O)NH2, v=0
  386666.6705  0.0024 -5.3664 3   89.1151 49  71510 303241114      24 817        syn-C2H3C(O)NH2, v=0
  386668.8181  0.0270 -4.6269 3 1170.5822189  71510 303941777      941678        syn-C2H3C(O)NH2, v=0
  386669.3580  0.0270 -4.6269 3 1170.5822189  71510 303941877      941778        syn-C2H3C(O)NH2, v=0
  386673.9247  0.0036 -6.1553 3  712.4662107  71510 303534013      524012        syn-C2H3C(O)NH2, v=0
  386673.9247  0.0036 -6.1553 3  712.4662107  71510 303534014      524013        syn-C2H3C(O)NH2, v=0
  386732.3245  0.0207 -4.8610 3 1336.0660191  71510 303953164      953065        syn-C2H3C(O)NH2, v=0
  386742.9427  0.0207 -4.8609 3 1336.0656191  71510 303953165      953066        syn-C2H3C(O)NH2, v=0
  386744.7319  0.0023 -3.2824 3  189.7845 75  71510 303371127      361026        syn-C2H3C(O)NH2, v=0
  386776.2340  0.0070 -4.0766 3  794.3236161  71510 303801070      80 971        syn-C2H3C(O)NH2, v=0
  386776.2340  0.0070 -4.0766 3  794.3236161  71510 303801170      801071        syn-C2H3C(O)NH2, v=0
  386778.4850  0.0011 -5.1052 3  371.0146107  71510 303531043      521042        syn-C2H3C(O)NH2, v=0
  386789.4625  0.0200 -2.8415 3  111.6066 43 -71510 3032117 4      2016 5        syn-C2H3C(O)NH2, v=0
  386789.4625  0.0200 -2.8415 3  111.6066 43 -71510 3032117 5      2016 4        syn-C2H3C(O)NH2, v=0
  386797.0981  0.0012 -5.2569 3  419.7046105  71510 303522033      512032        syn-C2H3C(O)NH2, v=0
  386797.1702  0.0012 -5.2569 3  419.7046105  71510 303522032      512031        syn-C2H3C(O)NH2, v=0
  386801.0357  0.0092 -4.3340 3  440.0166131  71510 30365 164      65 065        syn-C2H3C(O)NH2, v=0
  386801.0357  0.0092 -4.3340 3  440.0166131  71510 30365 264      65 165        syn-C2H3C(O)NH2, v=0
  386832.6557  0.0031 -6.0888 3  693.9077107  71510 303533914      523913        syn-C2H3C(O)NH2, v=0
  386832.6557  0.0031 -6.0888 3  693.9077107  71510 303533915      523914        syn-C2H3C(O)NH2, v=0
  386865.9134  0.0642 -5.6355 3 1750.4366221  71510 303B03377      B03278        syn-C2H3C(O)NH2, v=0
  386878.9312  0.0377 -5.2547 3 1548.7822207  71510 303A33271      A33172        syn-C2H3C(O)NH2, v=0
  386895.0243  0.0200 -3.4946 3  402.5797 87 -71510 303432815      432716        syn-C2H3C(O)NH2, v=0
  386895.0243  0.0200 -3.4946 3  402.5797 87 -71510 303432816      432717        syn-C2H3C(O)NH2, v=0
  386907.9715  0.1638 -5.8536 3 1853.6899233  71510 303B62790      B62691        syn-C2H3C(O)NH2, v=0
  386944.8708  0.0046 -3.9396 3  622.5336147  71510 30373 667      73 568        syn-C2H3C(O)NH2, v=0
  386944.8708  0.0046 -3.9396 3  622.5336147  71510 30373 767      73 668        syn-C2H3C(O)NH2, v=0
  386987.7786  0.0373 -5.2544 3 1548.7781207  71510 303A33272      A33173        syn-C2H3C(O)NH2, v=0
  386989.1037  0.0012 -5.1284 3  368.7368103  71510 303511537      501536        syn-C2H3C(O)NH2, v=0
  387000.1377  0.0028 -6.0256 3  675.8225107  71510 303533815      523814        syn-C2H3C(O)NH2, v=0
  387000.1377  0.0028 -6.0256 3  675.8225107  71510 303533816      523815        syn-C2H3C(O)NH2, v=0
  387030.7508  0.0014 -5.0947 3  350.6274101  71510 303501436      491435        syn-C2H3C(O)NH2, v=0
  387079.8391  0.0095 -4.4314 3 1097.0597171  71510 303853055      852956        syn-C2H3C(O)NH2, v=0
  387080.0657  0.0095 -4.4314 3 1097.0597171  71510 303853056      852957        syn-C2H3C(O)NH2, v=0
  387094.5436  0.0055 -4.4464 3  333.4551 99  71510 303491336      491039        syn-C2H3C(O)NH2, v=0
  387108.8675  0.0014 -3.4972 3  392.0719 85  71510 303422814      422715        syn-C2H3C(O)NH2, v=0
  387108.8675  0.0014 -3.4972 3  392.0719 85  71510 303422815      422716        syn-C2H3C(O)NH2, v=0
  387116.1967  0.0200 -3.2246 3  371.0146107 -71510 303531143      521042        syn-C2H3C(O)NH2, v=0
  387174.6057  0.0200 -2.8740 3  114.8027 47 -71510 3032316 7      2215 8        syn-C2H3C(O)NH2, v=0
  387174.6057  0.0200 -2.8740 3  114.8027 47 -71510 3032316 8      2215 7        syn-C2H3C(O)NH2, v=0
  387177.4640  0.0025 -5.9652 3  658.2114107  71510 303533716      523715        syn-C2H3C(O)NH2, v=0
  387177.4640  0.0025 -5.9652 3  658.2114107  71510 303533717      523716        syn-C2H3C(O)NH2, v=0
  387210.7833  0.0200 -3.0030 3  133.4977 59 -71510 303291317      281216        syn-C2H3C(O)NH2, v=0
  387212.9689  0.0200 -3.0030 3  133.4976 59 -71510 303291316      281217        syn-C2H3C(O)NH2, v=0
  387242.1674  0.0020 -5.4963 3   35.4573 33  71510 30316 8 8      15 511        syn-C2H3C(O)NH2, v=0
  387296.9262  0.0200 -3.2506 3  180.4309 73 -71510 303361126      351025        syn-C2H3C(O)NH2, v=0
  387308.9118  0.0200 -3.5022 3  381.8124 83 -71510 303412813      412714        syn-C2H3C(O)NH2, v=0
  387308.9118  0.0200 -3.5022 3  381.8124 83 -71510 303412814      412715        syn-C2H3C(O)NH2, v=0
  387365.8880  0.0022 -5.9077 3  641.0748107  71510 303533617      523616        syn-C2H3C(O)NH2, v=0
  387365.8880  0.0022 -5.9077 3  641.0748107  71510 303533618      523617        syn-C2H3C(O)NH2, v=0
  387415.1879  0.0613 -5.6343 3 1750.4151221  71510 303B03378      B03279        syn-C2H3C(O)NH2, v=0
  387425.7189  0.0012 -5.1001 3  364.5115105  71510 303521241      511240        syn-C2H3C(O)NH2, v=0
  387433.4041  0.0048 -3.9922 3   91.6646 55  71510 30327 621      26 522        syn-C2H3C(O)NH2, v=0
  387465.4014  0.0200 -2.9101 3  119.4945 51 -71510 303251510      241411        syn-C2H3C(O)NH2, v=0
  387465.4014  0.0200 -2.9101 3  119.4945 51 -71510 303251511      241410        syn-C2H3C(O)NH2, v=0
  387471.7300  0.0072 -4.1626 3  609.2973133  71510 303661749      651848        syn-C2H3C(O)NH2, v=0
  387495.7802  0.0015 -3.5098 3  371.8006 81  71510 303402812      402713        syn-C2H3C(O)NH2, v=0
  387495.7802  0.0015 -3.5098 3  371.8006 81  71510 303402813      402714        syn-C2H3C(O)NH2, v=0
  387552.4117  0.0030 -3.9508 3  811.3102143  71510 303712942      712843        syn-C2H3C(O)NH2, v=0
  387552.4118  0.0030 -3.9508 3  811.3102143  71510 303712943      712844        syn-C2H3C(O)NH2, v=0
  387552.6871  0.0010 -2.9519 3  125.7105 55  71510 303271414      261313        syn-C2H3C(O)NH2, v=0
  387552.7014  0.0010 -2.9519 3  125.7105 55  71510 303271413      261314        syn-C2H3C(O)NH2, v=0
  387555.3122  0.0473 -5.1617 3 1127.9312179  71510 303892564      882663        syn-C2H3C(O)NH2, v=0
  387566.8539  0.0020 -5.8526 3  624.4136107  71510 303533518      523517        syn-C2H3C(O)NH2, v=0
  387566.8539  0.0020 -5.8526 3  624.4136107  71510 303533519      523518        syn-C2H3C(O)NH2, v=0
  387618.3701  0.2124 -6.0446 3 1954.6798239  71510 303B92792      B92693        syn-C2H3C(O)NH2, v=0
  387646.5423  0.0083 -4.1375 3  844.3784165  71510 303821171      821072        syn-C2H3C(O)NH2, v=0
  387646.5424  0.0083 -4.1375 3  844.3784165  71510 303821271      821172        syn-C2H3C(O)NH2, v=0
  387670.1134  0.0016 -3.5203 3  362.0365 79  71510 303392811      392712        syn-C2H3C(O)NH2, v=0
  387670.1134  0.0016 -3.5203 3  362.0365 79  71510 303392812      392713        syn-C2H3C(O)NH2, v=0
  387672.4393  0.0221 -4.5322 3 1113.1726185  71510 303921676      921577        syn-C2H3C(O)NH2, v=0
  387672.5940  0.0221 -4.5322 3 1113.1726185  71510 303921776      921677        syn-C2H3C(O)NH2, v=0
  387709.8166  0.0035 -4.5215 3  277.8908 89  71510 303441430      441133        syn-C2H3C(O)NH2, v=0
  387782.0331  0.0018 -5.7999 3  608.2286107  71510 303533419      523418        syn-C2H3C(O)NH2, v=0
  387782.0331  0.0018 -5.7999 3  608.2286107  71510 303533420      523419        syn-C2H3C(O)NH2, v=0
  387797.2446  0.0023 -6.2706 3  303.8484 87  71510 303431925      441628        syn-C2H3C(O)NH2, v=0
  387808.4477  0.0023 -6.2706 3  303.8480 87  71510 303431924      441629        syn-C2H3C(O)NH2, v=0
  387818.4312  0.0025 -5.4679 3   83.1581 47  71510 303231112      23 815        syn-C2H3C(O)NH2, v=0
  387832.5273  0.0016 -3.5342 3  352.5198 77  71510 303382810      382711        syn-C2H3C(O)NH2, v=0
  387832.5273  0.0016 -3.5342 3  352.5198 77  71510 303382811      382712        syn-C2H3C(O)NH2, v=0
  387927.0830  0.0012 -5.2288 3  410.9260105  71510 303521934      511933        syn-C2H3C(O)NH2, v=0
  387927.9994  0.0012 -5.2288 3  410.9260105  71510 303521933      511932        syn-C2H3C(O)NH2, v=0
  387943.9318  0.0950 -5.9444 3 1535.8376207  71510 303A33173      A23270        syn-C2H3C(O)NH2, v=0
  387983.6185  0.0017 -3.5520 3  343.2501 75  71510 3033728 9      372710        syn-C2H3C(O)NH2, v=0
  387983.6185  0.0017 -3.5520 3  343.2501 75  71510 303372810      372711        syn-C2H3C(O)NH2, v=0
  388008.3110  0.1027 -5.9878 3 1935.4995233  71510 303B63482      B63383        syn-C2H3C(O)NH2, v=0
  388013.3700  0.0017 -5.7494 3  592.5206107  71510 303533320      523319        syn-C2H3C(O)NH2, v=0
  388013.3700  0.0017 -5.7494 3  592.5206107  71510 303533321      523320        syn-C2H3C(O)NH2, v=0
  388025.2523  0.0034 -4.1392 3   75.9398 51  71510 30325 620      24 321        syn-C2H3C(O)NH2, v=0
  388034.4331  0.0012 -5.1091 3  362.8668103  71510 303511438      501437        syn-C2H3C(O)NH2, v=0
  388078.5310  0.0955 -5.9441 3 1535.8373207  71510 303A33172      A23271        syn-C2H3C(O)NH2, v=0
  388086.5286  0.0512 -4.9747 3 1374.3446203  71510 303A12081      A11982        syn-C2H3C(O)NH2, v=0
  388096.8826  0.0512 -4.9747 3 1374.3446203  71510 303A12181      A12082        syn-C2H3C(O)NH2, v=0
  388101.2198  0.0017 -4.2913 3   76.1694 49  71510 30324 817      23 518        syn-C2H3C(O)NH2, v=0
  388120.2746  0.0473 -5.3104 3 1206.8164185  71510 303922667      912764        syn-C2H3C(O)NH2, v=0
  388123.9640  0.0017 -3.5745 3  334.2273 73  71510 3033628 8      3627 9        syn-C2H3C(O)NH2, v=0
  388123.9640  0.0017 -3.5745 3  334.2273 73  71510 3033628 9      362710        syn-C2H3C(O)NH2, v=0
  388136.6791  0.0029 -6.2288 3  428.9433105  71510 303522132      531835        syn-C2H3C(O)NH2, v=0
  388175.8157  0.0029 -6.2287 3  428.9420105  71510 303522131      531836        syn-C2H3C(O)NH2, v=0
  388206.1804  0.0035 -4.9066 3  150.8236 65  71510 303321220      32 923        syn-C2H3C(O)NH2, v=0
  388227.3011  0.0099 -4.2878 3  667.6390139  71510 303691851      681950        syn-C2H3C(O)NH2, v=0
  388250.9049  0.0100 -4.2050 3  895.6776169  71510 303841272      841173        syn-C2H3C(O)NH2, v=0
  388250.9056  0.0100 -4.2050 3  895.6776169  71510 303841372      841273        syn-C2H3C(O)NH2, v=0
  388254.1217  0.0018 -3.6027 3  325.4511 71  71510 3033528 7      3527 8        syn-C2H3C(O)NH2, v=0
  388254.1217  0.0018 -3.6027 3  325.4511 71  71510 3033528 8      3527 9        syn-C2H3C(O)NH2, v=0
  388263.1398  0.0016 -5.7010 3  577.2908107  71510 303533221      523220        syn-C2H3C(O)NH2, v=0
  388263.1398  0.0016 -5.7010 3  577.2908107  71510 303533222      523221        syn-C2H3C(O)NH2, v=0
  388306.8257  0.0181 -4.4425 3 1056.9693181  71510 303901575      901476        syn-C2H3C(O)NH2, v=0
  388306.8679  0.0181 -4.4425 3 1056.9693181  71510 303901675      901576        syn-C2H3C(O)NH2, v=0
  388374.6310  0.0019 -3.6380 3  316.9213 69  71510 3033428 6      3427 7        syn-C2H3C(O)NH2, v=0
  388374.6310  0.0019 -3.6380 3  316.9213 69  71510 3033428 7      3427 8        syn-C2H3C(O)NH2, v=0
  388445.9554  0.0138 -4.4121 3  728.6373145  71510 303721953      712052        syn-C2H3C(O)NH2, v=0
  388446.6258  0.0028 -3.9221 3  793.7411141  71510 303702941      702842        syn-C2H3C(O)NH2, v=0
  388446.6259  0.0028 -3.9221 3  793.7411141  71510 303702942      702843        syn-C2H3C(O)NH2, v=0
  388486.0135  0.0020 -3.6825 3  308.6377 67  71510 3033328 5      3327 6        syn-C2H3C(O)NH2, v=0
  388486.0135  0.0020 -3.6825 3  308.6377 67  71510 3033328 6      3327 7        syn-C2H3C(O)NH2, v=0
  388496.5473  0.0600 -5.4176 3 1264.5890189  71510 303942767      932866        syn-C2H3C(O)NH2, v=0
  388534.0212  0.0015 -5.6547 3  562.5404107  71510 303533122      523121        syn-C2H3C(O)NH2, v=0
  388534.0212  0.0015 -5.6547 3  562.5404107  71510 303533123      523122        syn-C2H3C(O)NH2, v=0
  388574.3576  0.0122 -4.2786 3  948.2140173  71510 303861373      861274        syn-C2H3C(O)NH2, v=0
  388574.3603  0.0122 -4.2786 3  948.2140173  71510 303861473      861374        syn-C2H3C(O)NH2, v=0
  388588.7733  0.0021 -3.7394 3  300.6000 65  71510 3033228 4      3227 5        syn-C2H3C(O)NH2, v=0
  388588.7733  0.0021 -3.7394 3  300.6000 65  71510 3033228 5      3227 6        syn-C2H3C(O)NH2, v=0
  388599.6639  0.0148 -4.3579 3 1001.9805177  71510 303881474      881375        syn-C2H3C(O)NH2, v=0
  388599.6748  0.0148 -4.3579 3 1001.9805177  71510 303881574      881475        syn-C2H3C(O)NH2, v=0
  388615.1952  0.0088 -4.3920 3 1075.8647169  71510 303843054      842955        syn-C2H3C(O)NH2, v=0
  388615.3131  0.0088 -4.3920 3 1075.8647169  71510 303843055      842956        syn-C2H3C(O)NH2, v=0
  388683.3973  0.0022 -3.8144 3  292.8081 63  71510 3033128 3      3127 4        syn-C2H3C(O)NH2, v=0
  388683.3973  0.0022 -3.8144 3  292.8081 63  71510 3033128 4      3127 5        syn-C2H3C(O)NH2, v=0
  388692.2236  0.0057 -3.9595 3  549.9870141  71510 30370 466      70 367        syn-C2H3C(O)NH2, v=0
  388692.2236  0.0057 -3.9595 3  549.9870141  71510 30370 566      70 467        syn-C2H3C(O)NH2, v=0
  388745.8829  0.2625 -6.2406 3 2058.2315245  71510 303C22894      C22795        syn-C2H3C(O)NH2, v=0
  388750.7395  0.0190 -4.5354 3  792.2940151  71510 303752055      742154        syn-C2H3C(O)NH2, v=0
  388770.3559  0.0022 -3.9175 3  285.2617 61  71510 3033028 2      3027 3        syn-C2H3C(O)NH2, v=0
  388770.3559  0.0022 -3.9175 3  285.2617 61  71510 3033028 3      3027 4        syn-C2H3C(O)NH2, v=0
  388781.1788  0.0049 -3.9639 3  668.1479151  71510 30375 768      75 669        syn-C2H3C(O)NH2, v=0
  388781.1788  0.0049 -3.9639 3  668.1479151  71510 30375 868      75 769        syn-C2H3C(O)NH2, v=0
  388829.1891  0.0014 -5.6102 3  548.2707107  71510 303533023      523022        syn-C2H3C(O)NH2, v=0
  388829.1891  0.0014 -5.6102 3  548.2707107  71510 303533024      523023        syn-C2H3C(O)NH2, v=0
  388850.1030  0.0023 -4.0720 3  277.9607 59  71510 3032928 1      2927 2        syn-C2H3C(O)NH2, v=0
  388850.1030  0.0023 -4.0720 3  277.9607 59  71510 3032928 2      2927 3        syn-C2H3C(O)NH2, v=0
  388876.9478  0.1156 -5.5393 3 1686.6586223  71510 303B12487      B12388        syn-C2H3C(O)NH2, v=0
  388903.0359  0.0191 -4.8141 3 1312.2433189  71510 303943163      943064        syn-C2H3C(O)NH2, v=0
  388909.0021  0.0191 -4.8141 3 1312.2430189  71510 303943164      943065        syn-C2H3C(O)NH2, v=0
  388923.0765  0.0024 -4.3515 3  270.9048 57  71510 3032828 0      2827 1        syn-C2H3C(O)NH2, v=0
  388923.0765  0.0024 -4.3515 3  270.9048 57  71510 3032828 1      2827 2        syn-C2H3C(O)NH2, v=0
  389120.1836  0.1140 -5.5387 3 1686.6599223  71510 303B12587      B12488        syn-C2H3C(O)NH2, v=0
  389152.4361  0.0014 -5.5675 3  534.4834107  71510 303532924      522923        syn-C2H3C(O)NH2, v=0
  389152.4361  0.0014 -5.5675 3  534.4834107  71510 303532925      522924        syn-C2H3C(O)NH2, v=0
  389193.4587  0.1976 -6.0412 3 1954.6898239  71510 303B92892      B92793        syn-C2H3C(O)NH2, v=0
  389213.2087  0.0024 -5.4657 3   83.1116 47  71510 303231113      23 816        syn-C2H3C(O)NH2, v=0
  389246.1940  0.0487 -5.3356 3 1132.6132181  71510 303902368      892465        syn-C2H3C(O)NH2, v=0
  389298.6368  0.0027 -3.8943 3  776.4302139  71510 303692940      692841        syn-C2H3C(O)NH2, v=0
  389298.6368  0.0027 -3.8943 3  776.4302139  71510 303692941      692842        syn-C2H3C(O)NH2, v=0
  389311.1569  0.0012 -5.2018 3  402.7025105  71510 303521835      511834        syn-C2H3C(O)NH2, v=0
  389321.1181  0.0012 -5.2018 3  402.7029105  71510 303521834      511833        syn-C2H3C(O)NH2, v=0
  389351.1623  0.0037 -4.7733 3  166.8627 71  71510 303351026      35 729        syn-C2H3C(O)NH2, v=0
  389384.1132  0.0013 -5.1233 3  368.8632103  71510 303511536      501535        syn-C2H3C(O)NH2, v=0
  389398.5360  0.0776 -5.2458 3 1526.8553213  71510 303A62284      A62185        syn-C2H3C(O)NH2, v=0
  389451.5755  0.0774 -5.2457 3 1526.8556213  71510 303A62384      A62285        syn-C2H3C(O)NH2, v=0
  389508.3310  0.0013 -5.5266 3  521.1804107  71510 303532825      522824        syn-C2H3C(O)NH2, v=0
  389508.3310  0.0013 -5.5266 3  521.1804107  71510 303532826      522825        syn-C2H3C(O)NH2, v=0
  389548.6783  0.0907 -5.9843 3 1935.4382233  71510 303B63483      B63384        syn-C2H3C(O)NH2, v=0
  389570.9952  0.0313 -5.1121 3 1095.6965177  71510 303882465      872562        syn-C2H3C(O)NH2, v=0
  389628.3055  0.0080 -4.1118 3  480.3870135  71510 30367 265      67 166        syn-C2H3C(O)NH2, v=0
  389628.3055  0.0080 -4.1118 3  480.3870135  71510 30367 365      67 266        syn-C2H3C(O)NH2, v=0
  389657.2549  0.0250 -4.6586 3  858.6098157  71510 303782157      772256        syn-C2H3C(O)NH2, v=0
  389700.6013  0.0347 -5.2016 3 1522.8386205  71510 303A23270      A23171        syn-C2H3C(O)NH2, v=0
  389743.1246  0.0012 -5.0943 3  364.2943105  71510 303521141      511140        syn-C2H3C(O)NH2, v=0
  389764.9094  0.0345 -5.2014 3 1522.8362205  71510 303A23271      A23172        syn-C2H3C(O)NH2, v=0
  389784.2574  0.0059 -5.9556 3   35.8411 37  71510 30318 513      17 216        syn-C2H3C(O)NH2, v=0
  389792.9579  0.0200 -3.3304 3  338.7899101 -71510 303501239      491138        syn-C2H3C(O)NH2, v=0
  389823.2195  0.0394 -5.2046 3 1150.5095181  71510 303902566      892663        syn-C2H3C(O)NH2, v=0
  389902.4313  0.0013 -5.4874 3  508.3640107  71510 303532726      522725        syn-C2H3C(O)NH2, v=0
  389902.4313  0.0013 -5.4874 3  508.3640107  71510 303532727      522726        syn-C2H3C(O)NH2, v=0
  389911.4551  0.0200 -3.3445 3  326.2739 99 -71510 303491238      481137        syn-C2H3C(O)NH2, v=0
  389953.3101  0.0854 -5.8143 3 1471.7875203  71510 303A13072      A03169        syn-C2H3C(O)NH2, v=0
  389985.8495  0.0062 -5.3113 3  113.5743 61  71510 30330 624      30 327        syn-C2H3C(O)NH2, v=0
  390043.9315  0.0019 -3.3316 3  158.3887 69  71510 303341024      33 925        syn-C2H3C(O)NH2, v=0
  390078.7859  0.0081 -4.3535 3 1054.9354167  71510 303833053      832954        syn-C2H3C(O)NH2, v=0
  390078.8465  0.0081 -4.3535 3 1054.9354167  71510 303833054      832955        syn-C2H3C(O)NH2, v=0
  390110.3301  0.0200 -3.8673 3  759.3768137 -71510 303682939      682840        syn-C2H3C(O)NH2, v=0
  390110.3301  0.0200 -3.8673 3  759.3768137 -71510 303682940      682841        syn-C2H3C(O)NH2, v=0
  390273.0102  0.0424 -4.8651 3 1312.7515199  71510 303991980      991881        syn-C2H3C(O)NH2, v=0
  390276.3644  0.0424 -4.8650 3 1312.7516199  71510 303992080      991981        syn-C2H3C(O)NH2, v=0
  390289.5883  0.0864 -5.8135 3 1471.7867203  71510 303A13071      A03170        syn-C2H3C(O)NH2, v=0
  390341.5723  0.0013 -5.4499 3  496.0369107  71510 303532627      522626        syn-C2H3C(O)NH2, v=0
  390341.5723  0.0013 -5.4499 3  496.0369107  71510 303532628      522627        syn-C2H3C(O)NH2, v=0
  390399.5530  0.0056 -4.0003 3  715.0338155  71510 30377 869      77 770        syn-C2H3C(O)NH2, v=0
  390399.5530  0.0056 -4.0003 3  715.0338155  71510 30377 969      77 870        syn-C2H3C(O)NH2, v=0
  390441.0507  0.0583 -5.5766 3 1722.6225219  71510 303A93376      A93277        syn-C2H3C(O)NH2, v=0
  390577.3443  0.0014 -5.0945 3  412.1904125  71510 30362 260      61 259        syn-C2H3C(O)NH2, v=0
  390577.3273  0.0200 -2.9268 3  412.1904125 -71510 30362 260      61 359        syn-C2H3C(O)NH2, v=0
  390577.3273  0.0200 -2.9268 3  412.1904125 -71510 30362 360      61 259        syn-C2H3C(O)NH2, v=0
  390577.3443  0.0014 -5.0945 3  412.1904125  71510 30362 360      61 359        syn-C2H3C(O)NH2, v=0
  390578.6561  0.0013 -5.1010 3  410.6351123  71510 30361 358      60 357        syn-C2H3C(O)NH2, v=0
  390578.6564  0.0200 -2.9527 3  410.6351123 -71510 30361 358      60 457        syn-C2H3C(O)NH2, v=0
  390578.6564  0.0200 -2.9527 3  410.6351123 -71510 30361 458      60 357        syn-C2H3C(O)NH2, v=0
  390578.6561  0.0013 -5.1010 3  410.6351123  71510 30361 458      60 457        syn-C2H3C(O)NH2, v=0
  390584.9198  0.0017 -5.0870 3  413.2285127  71510 30363 162      62 161        syn-C2H3C(O)NH2, v=0
  390584.9147  0.0200 -2.9018 3  413.2285127 -71510 30363 162      62 261        syn-C2H3C(O)NH2, v=0
  390584.9147  0.0200 -2.9018 3  413.2285127 -71510 30363 262      62 161        syn-C2H3C(O)NH2, v=0
  390584.9198  0.0017 -5.0870 3  413.2285127  71510 30363 262      62 261        syn-C2H3C(O)NH2, v=0
  390595.8549  0.0023 -5.0786 3  413.7572129  71510 30364 064      63 063        syn-C2H3C(O)NH2, v=0
  390595.8549  0.0023 -2.8775 3  413.7572129  71510 30364 064      63 163        syn-C2H3C(O)NH2, v=0
  390595.8549  0.0023 -2.8775 3  413.7572129  71510 30364 164      63 063        syn-C2H3C(O)NH2, v=0
  390595.8549  0.0023 -5.0786 3  413.7572129  71510 30364 164      63 163        syn-C2H3C(O)NH2, v=0
  390596.7884  0.0013 -5.1065 3  408.5530121  71510 30360 456      59 455        syn-C2H3C(O)NH2, v=0
  390596.7884  0.0013 -2.9799 3  408.5530121  71510 30360 456      59 555        syn-C2H3C(O)NH2, v=0
  390596.7884  0.0013 -2.9799 3  408.5530121  71510 30360 556      59 455        syn-C2H3C(O)NH2, v=0
  390596.7884  0.0013 -5.1065 3  408.5530121  71510 30360 556      59 555        syn-C2H3C(O)NH2, v=0
  390643.3776  0.0013 -5.1108 3  405.9318119  71510 30359 554      58 553        syn-C2H3C(O)NH2, v=0
  390643.3716  0.0200 -3.0088 3  405.9318119 -71510 30359 554      58 653        syn-C2H3C(O)NH2, v=0
  390643.3716  0.0200 -3.0088 3  405.9318119 -71510 30359 654      58 553        syn-C2H3C(O)NH2, v=0
  390643.3776  0.0013 -5.1108 3  405.9318119  71510 30359 654      58 653        syn-C2H3C(O)NH2, v=0
  390735.9893  0.0200 -3.0401 3  402.7557117 -71510 30358 652      57 751        syn-C2H3C(O)NH2, v=0
  390735.9944  0.0012 -5.1140 3  402.7557117  71510 30358 752      57 751        syn-C2H3C(O)NH2, v=0
  390735.9947  0.0012 -5.1140 3  402.7557117  71510 30358 652      57 651        syn-C2H3C(O)NH2, v=0
  390735.9893  0.0200 -3.0401 3  402.7557117 -71510 30358 752      57 651        syn-C2H3C(O)NH2, v=0
  390778.3898  0.0566 -5.5759 3 1722.6093219  71510 303A93377      A93278        syn-C2H3C(O)NH2, v=0
  390791.0024  0.0200 -3.3093 3  377.4346107 -71510 303531142      521241        syn-C2H3C(O)NH2, v=0
  390820.0504  0.0025 -5.5737 3   77.3939 45  71510 303221111      22 814        syn-C2H3C(O)NH2, v=0
  390834.2697  0.0013 -5.4139 3  484.2024107  71510 303532528      522527        syn-C2H3C(O)NH2, v=0
  390834.2697  0.0013 -5.4139 3  484.2024107  71510 303532529      522528        syn-C2H3C(O)NH2, v=0
  390883.4273  0.0024 -3.8411 3  742.5806135  71510 303672938      672839        syn-C2H3C(O)NH2, v=0
  390883.4273  0.0024 -3.8411 3  742.5806135  71510 303672939      672840        syn-C2H3C(O)NH2, v=0
  390902.2495  0.0200 -3.0747 3  399.0035115 -71510 30357 750      56 849        syn-C2H3C(O)NH2, v=0
  390902.2281  0.0012 -5.1159 3  399.0035115  71510 30357 850      56 849        syn-C2H3C(O)NH2, v=0
  390902.2407  0.0012 -5.1159 3  399.0035115  71510 30357 750      56 749        syn-C2H3C(O)NH2, v=0
  390902.2495  0.0200 -3.0747 3  399.0035115 -71510 30357 850      56 749        syn-C2H3C(O)NH2, v=0
  390952.2692  0.0053 -3.9492 3  593.6435145  71510 30372 567      72 468        syn-C2H3C(O)NH2, v=0
  390952.2692  0.0053 -3.9492 3  593.6435145  71510 30372 667      72 568        syn-C2H3C(O)NH2, v=0
  390965.5665  0.0178 -4.7680 3 1288.6930187  71510 303933162      933063        syn-C2H3C(O)NH2, v=0
  390967.4678  0.0251 -5.0918 3 1064.4396175  71510 303872365      862462        syn-C2H3C(O)NH2, v=0
  390968.8831  0.0178 -4.7680 3 1288.6928187  71510 303933163      933064        syn-C2H3C(O)NH2, v=0
  390974.7562  0.0061 -5.9563 3   78.6005 53  71510 30326 422      26 125        syn-C2H3C(O)NH2, v=0
  391013.0353  0.0049 -3.8477 3  108.6205 59  71510 30329 722      28 623        syn-C2H3C(O)NH2, v=0
  391035.6082  0.0012 -5.1757 3  395.0608105  71510 303521736      511735        syn-C2H3C(O)NH2, v=0
  391126.2874  0.0012 -5.1756 3  395.0644105  71510 303521735      511734        syn-C2H3C(O)NH2, v=0
  391187.2649  0.0011 -3.1141 3  394.6461113  71510 30356 848      55 947        syn-C2H3C(O)NH2, v=0
  391187.7056  0.0011 -5.1163 3  394.6461113  71510 30356 948      55 947        syn-C2H3C(O)NH2, v=0
  391187.9368  0.2363 -6.2354 3 2058.2478245  71510 303C22994      C22895        syn-C2H3C(O)NH2, v=0
  391188.0798  0.0011 -5.1163 3  394.6461113  71510 30356 848      55 847        syn-C2H3C(O)NH2, v=0
  391188.5205  0.0011 -3.1141 3  394.6461113  71510 30356 948      55 847        syn-C2H3C(O)NH2, v=0
  391199.1897  0.0028 -4.6902 3  180.3007 73  71510 303361126      36 829        syn-C2H3C(O)NH2, v=0
  391223.0318  0.0200 -3.3166 3  351.4617103 -71510 303511240      501139        syn-C2H3C(O)NH2, v=0
  391353.2061  0.0038 -4.6952 3  209.4324 77  71510 303381325      381028        syn-C2H3C(O)NH2, v=0
  391391.2934  0.0013 -5.3794 3  472.8647107  71510 303532429      522428        syn-C2H3C(O)NH2, v=0
  391391.2934  0.0013 -5.3794 3  472.8647107  71510 303532430      522429        syn-C2H3C(O)NH2, v=0
  391474.4886  0.0075 -4.3158 3 1034.2709165  71510 303823052      822953        syn-C2H3C(O)NH2, v=0
  391474.5195  0.0075 -4.3158 3 1034.2708165  71510 303823053      822954        syn-C2H3C(O)NH2, v=0
  391513.9083  0.0318 -4.7827 3  927.5850163  71510 303812259      802358        syn-C2H3C(O)NH2, v=0
  391540.4430  0.0025 -5.5726 3   77.3698 45  71510 303221112      22 815        syn-C2H3C(O)NH2, v=0
  391619.6317  0.0200 -3.8157 3  726.0411133 -71510 303662937      662838        syn-C2H3C(O)NH2, v=0
  391619.6317  0.0200 -3.8157 3  726.0411133 -71510 303662938      662839        syn-C2H3C(O)NH2, v=0
  391651.3883  0.0060 -5.9552 3   78.6005 53  71510 30326 522      26 225        syn-C2H3C(O)NH2, v=0
  391660.4577  0.0200 -3.1606 3  389.6415111 -71510 30355 946      541045        syn-C2H3C(O)NH2, v=0
  391662.9186  0.0013 -5.0597 3  342.9048101  71510 303501238      491237        syn-C2H3C(O)NH2, v=0
  391671.2785  0.0011 -5.1149 3  389.6415111  71510 303551046      541045        syn-C2H3C(O)NH2, v=0
  391679.6741  0.0011 -5.1149 3  389.6409111  71510 30355 946      54 945        syn-C2H3C(O)NH2, v=0
  391690.4900  0.0200 -3.1605 3  389.6409111 -71510 303551046      54 945        syn-C2H3C(O)NH2, v=0
  391721.2282  0.0200 -3.3575 3  313.9139 97 -71510 303481237      471136        syn-C2H3C(O)NH2, v=0
  391771.1714  0.1426 -5.7154 3 1783.3428229  71510 303B42589      B42490        syn-C2H3C(O)NH2, v=0
  391791.4329  0.0065 -4.0465 3  763.1847159  71510 30379 970      79 871        syn-C2H3C(O)NH2, v=0
  391791.4329  0.0065 -4.0465 3  763.1847159  71510 303791070      79 971        syn-C2H3C(O)NH2, v=0
  391888.2842  0.0064 -4.9503 3  161.8062 71  71510 30335 827      35 530        syn-C2H3C(O)NH2, v=0
  391988.5793  0.0053 -4.4035 3  377.2947105  71510 303521438      521141        syn-C2H3C(O)NH2, v=0
  391990.4792  0.0350 -4.7600 3 1252.3395195  71510 303971879      971780        syn-C2H3C(O)NH2, v=0
  391991.5190  0.0350 -4.7600 3 1252.3395195  71510 303971979      971880        syn-C2H3C(O)NH2, v=0
  392026.5121  0.0012 -5.3464 3  462.0288107  71510 303532330      522329        syn-C2H3C(O)NH2, v=0
  392026.5121  0.0012 -5.3464 3  462.0288107  71510 303532331      522330        syn-C2H3C(O)NH2, v=0
  392169.2839  0.1397 -5.7146 3 1783.3450229  71510 303B42689      B42590        syn-C2H3C(O)NH2, v=0
  392266.3506  0.0765 -5.6872 3 1409.1823199  71510 303992971      983068        syn-C2H3C(O)NH2, v=0
  392266.7838  0.0200 -3.2195 3  383.9274109 -71510 303541044      531143        syn-C2H3C(O)NH2, v=0
  392274.4170  0.0071 -4.0177 3  522.0603139  71510 30369 366      69 267        syn-C2H3C(O)NH2, v=0
  392274.4170  0.0071 -4.0177 3  522.0603139  71510 30369 466      69 367        syn-C2H3C(O)NH2, v=0
  392295.4997  0.0200 -3.1841 3  162.4498 69 -71510 303341123      331024        syn-C2H3C(O)NH2, v=0
  392320.5403  0.0200 -3.7912 3  709.7576131 -71510 303652936      652837        syn-C2H3C(O)NH2, v=0
  392320.5403  0.0200 -3.7912 3  709.7576131 -71510 303652937      652838        syn-C2H3C(O)NH2, v=0
  392363.3285  0.0320 -5.1495 3 1497.1743203  71510 303A13269      A13170        syn-C2H3C(O)NH2, v=0
  392388.0627  0.0913 -5.9236 3 1906.0784231  71510 303B53481      B53382        syn-C2H3C(O)NH2, v=0
  392400.9211  0.0319 -5.1494 3 1497.1729203  71510 303A13270      A13171        syn-C2H3C(O)NH2, v=0
  392412.8693  0.0045 -3.6900 3  126.8078 63  71510 30331 823      30 724        syn-C2H3C(O)NH2, v=0
  392413.0524  0.0200 -3.0757 3  150.6817 65 -71510 303321221      311120        syn-C2H3C(O)NH2, v=0
  392466.3841  0.0011 -5.1112 3  383.9274109  71510 303541144      531143        syn-C2H3C(O)NH2, v=0
  392505.4170  0.0648 -5.1262 3 1462.3088209  71510 303A42183      A42084        syn-C2H3C(O)NH2, v=0
  392523.8454  0.0647 -5.1261 3 1462.3089209  71510 303A42283      A42184        syn-C2H3C(O)NH2, v=0
  392592.2834  0.0061 -5.5824 3   95.4473 57  71510 30328 523      28 226        syn-C2H3C(O)NH2, v=0
  392604.4900  0.0011 -5.1109 3  383.9162109  71510 303541044      531043        syn-C2H3C(O)NH2, v=0
  392610.0448  0.0015 -4.1678 3   82.2835 51  71510 30325 818      24 519        syn-C2H3C(O)NH2, v=0
  392729.4448  0.0200 -3.0752 3  150.6727 65 -71510 303321220      311121        syn-C2H3C(O)NH2, v=0
  392758.1815  0.0012 -5.3148 3  451.7012107  71510 303532232      522231        syn-C2H3C(O)NH2, v=0
  392758.1822  0.0012 -5.3148 3  451.7012107  71510 303532231      522230        syn-C2H3C(O)NH2, v=0
  392804.0908  0.0200 -3.2182 3  383.9162109 -71510 303541144      531043        syn-C2H3C(O)NH2, v=0
  392805.8678  0.0070 -4.2789 3 1013.8704163  71510 303813051      812952        syn-C2H3C(O)NH2, v=0
  392805.8833  0.0070 -4.2789 3 1013.8704163  71510 303813052      812953        syn-C2H3C(O)NH2, v=0
  392833.0335  0.0099 -4.3487 3  453.4486133  71510 30366 165      66 066        syn-C2H3C(O)NH2, v=0
  392833.0335  0.0099 -4.3487 3  453.4486133  71510 30366 265      66 166        syn-C2H3C(O)NH2, v=0
  392917.3155  0.0032 -6.2550 3  492.5470113  71510 303562235      571938        syn-C2H3C(O)NH2, v=0
  392927.4361  0.0165 -4.7229 3 1265.4140185  71510 303923161      923062        syn-C2H3C(O)NH2, v=0
  392929.2601  0.0165 -4.7229 3 1265.4139185  71510 303923162      923063        syn-C2H3C(O)NH2, v=0
  392947.1829  0.0077 -4.1012 3  812.5942163  71510 303811071      81 972        syn-C2H3C(O)NH2, v=0
  392947.1829  0.0077 -4.1012 3  812.5942163  71510 303811171      811072        syn-C2H3C(O)NH2, v=0
  392967.2256  0.0032 -6.2549 3  492.5454113  71510 303562234      571939        syn-C2H3C(O)NH2, v=0
  392987.6215  0.0200 -3.7676 3  693.7297129 -71510 303642935      642836        syn-C2H3C(O)NH2, v=0
  392987.6215  0.0200 -3.7676 3  693.7297129 -71510 303642936      642837        syn-C2H3C(O)NH2, v=0
  392992.1289  0.0012 -5.1013 3  370.2386105  71510 303521340      511339        syn-C2H3C(O)NH2, v=0
  393012.3825  0.0052 -3.9597 3  638.5843149  71510 30374 668      74 569        syn-C2H3C(O)NH2, v=0
  393012.3825  0.0052 -3.9597 3  638.5843149  71510 30374 768      74 669        syn-C2H3C(O)NH2, v=0
  393086.9419  0.0787 -5.6854 3 1409.1802199  71510 303992970      983069        syn-C2H3C(O)NH2, v=0
  393112.7987  0.0027 -4.0148 3   85.4481 53  71510 30326 720      25 421        syn-C2H3C(O)NH2, v=0
  393121.4872  0.0012 -5.1506 3  388.0351105  71510 303521637      511636        syn-C2H3C(O)NH2, v=0
  393135.9529  0.0967 -5.4096 3 1619.1943219  71510 303A92386      A92287        syn-C2H3C(O)NH2, v=0
  393226.3548  0.0962 -5.4094 3 1619.1947219  71510 303A92486      A92387        syn-C2H3C(O)NH2, v=0
  393264.7393  0.0025 -5.6887 3   71.9015 43  71510 303211110      21 813        syn-C2H3C(O)NH2, v=0
  393284.7858  0.0289 -4.6595 3 1193.1178191  71510 303951778      951679        syn-C2H3C(O)NH2, v=0
  393285.0939  0.0289 -4.6595 3 1193.1178191  71510 303951878      951779        syn-C2H3C(O)NH2, v=0
  393361.1120  0.0842 -5.9215 3 1906.0399231  71510 303B53482      B53383        syn-C2H3C(O)NH2, v=0
  393445.5107  0.0012 -5.1053 3  377.4346107  71510 303531242      521241        syn-C2H3C(O)NH2, v=0
  393605.1786  0.0358 -5.2353 3 1109.5275179  71510 303892367      882464        syn-C2H3C(O)NH2, v=0
  393610.9974  0.0012 -5.2846 3  441.8901107  71510 303532133      522132        syn-C2H3C(O)NH2, v=0
  393611.0082  0.0012 -5.2846 3  441.8901107  71510 303532132      522131        syn-C2H3C(O)NH2, v=0
  393619.8514  0.0025 -5.6881 3   71.8896 43  71510 303211111      21 814        syn-C2H3C(O)NH2, v=0
  393622.2893  0.0200 -3.7448 3  677.9571127 -71510 303632934      632835        syn-C2H3C(O)NH2, v=0
  393622.2893  0.0200 -3.7448 3  677.9571127 -71510 303632935      632836        syn-C2H3C(O)NH2, v=0
  393650.9450  0.0200 -2.8057 3  114.5155 41 -71510 3032018 2      1917 3        syn-C2H3C(O)NH2, v=0
  393650.9450  0.0200 -2.8057 3  114.5155 41 -71510 3032018 3      1917 2        syn-C2H3C(O)NH2, v=0
  393771.1940  0.0532 -5.5189 3 1695.0957217  71510 303A83375      A83276        syn-C2H3C(O)NH2, v=0
  393772.0419  0.0019 -5.3540 3   39.4296 35  71510 30317 8 9      16 512        syn-C2H3C(O)NH2, v=0
  393788.4128  0.0012 -5.1492 3  388.0657105  71510 303521636      511635        syn-C2H3C(O)NH2, v=0
  393855.9137  0.0092 -4.1632 3  863.2556167  71510 303831172      831073        syn-C2H3C(O)NH2, v=0
  393855.9137  0.0092 -4.1632 3  863.2556167  71510 303831272      831173        syn-C2H3C(O)NH2, v=0
  393885.4502  0.0040 -6.2049 3  744.3905109  71510 303544113      534112        syn-C2H3C(O)NH2, v=0
  393885.4502  0.0040 -6.2049 3  744.3905109  71510 303544114      534113        syn-C2H3C(O)NH2, v=0
  393937.4850  0.0200 -3.3041 3  364.2943105 -71510 303521241      511140        syn-C2H3C(O)NH2, v=0
  393965.9902  0.0284 -5.1549 3 1086.8070177  71510 303882366      872463        syn-C2H3C(O)NH2, v=0
  393975.5281  0.0025 -6.2416 3  357.5466 95  71510 303472028      481731        syn-C2H3C(O)NH2, v=0
  393976.1095  0.0523 -5.5185 3 1695.0877217  71510 303A83376      A83277        syn-C2H3C(O)NH2, v=0
  393990.8945  0.0025 -6.2416 3  357.5461 95  71510 303472027      481732        syn-C2H3C(O)NH2, v=0
  394043.6135  0.0036 -6.1373 3  725.3642109  71510 303544014      534013        syn-C2H3C(O)NH2, v=0
  394043.6135  0.0036 -6.1373 3  725.3642109  71510 303544015      534014        syn-C2H3C(O)NH2, v=0
  394067.2737  0.0200 -2.8363 3  116.7298 45 -71510 3032217 5      2116 6        syn-C2H3C(O)NH2, v=0
  394067.2737  0.0200 -2.8363 3  116.7298 45 -71510 3032217 6      2116 5        syn-C2H3C(O)NH2, v=0
  394076.2118  0.0065 -4.2428 3  993.7332161  71510 303803050      802951        syn-C2H3C(O)NH2, v=0
  394076.2195  0.0065 -4.2428 3  993.7332161  71510 303803051      802952        syn-C2H3C(O)NH2, v=0
  394189.4789  0.0200 -3.0036 3  140.6766 61 -71510 303301318      291217        syn-C2H3C(O)NH2, v=0
  394192.8519  0.0238 -4.5638 3 1135.0954187  71510 303931677      931578        syn-C2H3C(O)NH2, v=0
  394192.9389  0.0238 -4.5638 3 1135.0954187  71510 303931777      931678        syn-C2H3C(O)NH2, v=0
  394194.6246  0.0200 -3.0036 3  140.6764 61 -71510 303301317      291218        syn-C2H3C(O)NH2, v=0
  394210.0699  0.0032 -6.0730 3  706.8110109  71510 303543915      533914        syn-C2H3C(O)NH2, v=0
  394210.0699  0.0032 -6.0730 3  706.8110109  71510 303543916      533915        syn-C2H3C(O)NH2, v=0
  394226.0071  0.0200 -3.7229 3  662.4391125 -71510 303622933      622834        syn-C2H3C(O)NH2, v=0
  394226.0071  0.0200 -3.7229 3  662.4391125 -71510 303622934      622835        syn-C2H3C(O)NH2, v=0
  394273.3690  0.1752 -5.8984 3 1882.5987235  71510 303B72691      B72592        syn-C2H3C(O)NH2, v=0
  394385.8348  0.0028 -6.0116 3  688.7315109  71510 303543816      533815        syn-C2H3C(O)NH2, v=0
  394385.8348  0.0028 -6.0116 3  688.7315109  71510 303543817      533816        syn-C2H3C(O)NH2, v=0
  394432.5459  0.0200 -2.8693 3  120.4260 49 -71510 3032416 8      2315 9        syn-C2H3C(O)NH2, v=0
  394432.5459  0.0200 -2.8693 3  120.4260 49 -71510 3032416 9      2315 8        syn-C2H3C(O)NH2, v=0
  394478.9320  0.0013 -5.0617 3  346.3672101  71510 303501337      491336        syn-C2H3C(O)NH2, v=0
  394483.6890  0.0392 -4.9089 3  999.2194169  71510 303842361      832460        syn-C2H3C(O)NH2, v=0
  394502.0130  0.0569 -5.2953 3 1206.7966185  71510 303922666      912765        syn-C2H3C(O)NH2, v=0
  394505.2645  0.0110 -4.2319 3  915.1620171  71510 303851273      851174        syn-C2H3C(O)NH2, v=0
  394505.2649  0.0110 -4.2319 3  915.1620171  71510 303851373      851274        syn-C2H3C(O)NH2, v=0
  394572.0683  0.0025 -5.9530 3  671.1262109  71510 303543717      533716        syn-C2H3C(O)NH2, v=0
  394572.0683  0.0025 -5.9530 3  671.1262109  71510 303543718      533717        syn-C2H3C(O)NH2, v=0
  394619.5216  0.0012 -5.2556 3  432.6067107  71510 303532034      522033        syn-C2H3C(O)NH2, v=0
  394619.6722  0.0012 -5.2556 3  432.6067107  71510 303532033      522032        syn-C2H3C(O)NH2, v=0
  394682.2027  0.0200 -2.9064 3  125.6246 53 -71510 303261512      251411        syn-C2H3C(O)NH2, v=0
  394682.2027  0.0200 -2.9064 3  125.6246 53 -71510 303261511      251412        syn-C2H3C(O)NH2, v=0
  394689.5400  0.0200 -2.9499 3  132.3572 57 -71510 303281415      271314        syn-C2H3C(O)NH2, v=0
  394689.5400  0.0200 -2.9499 3  132.3572 57 -71510 303281414      271315        syn-C2H3C(O)NH2, v=0
  394734.7569  0.0063 -3.9776 3  565.0303143  71510 30371 467      71 368        syn-C2H3C(O)NH2, v=0
  394734.7569  0.0063 -3.9776 3  565.0303143  71510 30371 567      71 468        syn-C2H3C(O)NH2, v=0
  394745.1648  0.0195 -4.4730 3 1078.2808183  71510 303911576      911477        syn-C2H3C(O)NH2, v=0
  394745.1882  0.0195 -4.4730 3 1078.2808183  71510 303911676      911577        syn-C2H3C(O)NH2, v=0
  394770.1015  0.0022 -5.8968 3  653.9959109  71510 303543618      533617        syn-C2H3C(O)NH2, v=0
  394770.1015  0.0022 -5.8968 3  653.9959109  71510 303543619      533618        syn-C2H3C(O)NH2, v=0
  394795.2598  0.0153 -4.6786 3 1242.4051183  71510 303913160      913061        syn-C2H3C(O)NH2, v=0
  394796.2521  0.0153 -4.6786 3 1242.4051183  71510 303913161      913062        syn-C2H3C(O)NH2, v=0
  394799.8825  0.0200 -3.7019 3  647.1755123 -71510 303612932      612833        syn-C2H3C(O)NH2, v=0
  394799.8825  0.0200 -3.7019 3  647.1755123 -71510 303612933      612834        syn-C2H3C(O)NH2, v=0
  394833.1267  0.0680 -5.5637 3 1348.0275195  71510 303972870      962967        syn-C2H3C(O)NH2, v=0
  394866.0211  0.0055 -3.9853 3  684.8032153  71510 30376 769      76 670        syn-C2H3C(O)NH2, v=0
  394866.0211  0.0055 -3.9853 3  684.8032153  71510 30376 869      76 770        syn-C2H3C(O)NH2, v=0
  394881.1324  0.0133 -4.3067 3  968.3065175  71510 303871374      871275        syn-C2H3C(O)NH2, v=0
  394881.1339  0.0133 -4.3067 3  968.3065175  71510 303871474      871375        syn-C2H3C(O)NH2, v=0
  394882.6370  0.0296 -5.0983 3 1471.7875201  71510 303A03268      A03169        syn-C2H3C(O)NH2, v=0
  394904.3828  0.0296 -5.0983 3 1471.7867201  71510 303A03269      A03170        syn-C2H3C(O)NH2, v=0
  394915.5294  0.1697 -5.8971 3 1882.6025235  71510 303B72791      B72692        syn-C2H3C(O)NH2, v=0
  394920.7735  0.0058 -5.5788 3   95.4474 57  71510 30328 623      28 326        syn-C2H3C(O)NH2, v=0
  394967.3325  0.0161 -4.3872 3 1022.6819179  71510 303891475      891376        syn-C2H3C(O)NH2, v=0
  394967.3384  0.0161 -4.3872 3 1022.6819179  71510 303891575      891476        syn-C2H3C(O)NH2, v=0
  394981.4685  0.0020 -5.8431 3  637.3414109  71510 303543519      533518        syn-C2H3C(O)NH2, v=0
  394981.4685  0.0020 -5.8431 3  637.3414109  71510 303543520      533519        syn-C2H3C(O)NH2, v=0
  394985.3682  0.0012 -5.1015 3  377.2947107  71510 303531142      521141        syn-C2H3C(O)NH2, v=0
  395044.8317  0.0540 -5.0111 3 1398.9249205  71510 303A22082      A21983        syn-C2H3C(O)NH2, v=0
  395050.9712  0.0540 -5.0111 3 1398.9249205  71510 303A22182      A22083        syn-C2H3C(O)NH2, v=0
  395133.5654  0.0012 -5.1276 3  381.6453105  71510 303521538      511537        syn-C2H3C(O)NH2, v=0
  395159.6616  0.0200 -3.3672 3  301.7179 95 -71510 303471236      461135        syn-C2H3C(O)NH2, v=0
  395207.9459  0.0018 -5.7915 3  621.1636109  71510 303543420      533419        syn-C2H3C(O)NH2, v=0
  395207.9459  0.0018 -5.7915 3  621.1636109  71510 303543421      533420        syn-C2H3C(O)NH2, v=0
  395257.6756  0.0027 -6.2507 3   62.5704 43  71510 30321 912      21 417        syn-C2H3C(O)NH2, v=0
  395278.2037  0.0025 -5.8141 3   66.6758 41  71510 3032011 9      20 812        syn-C2H3C(O)NH2, v=0
  395288.5642  0.0060 -4.2075 3  973.8586159  71510 303793049      792950        syn-C2H3C(O)NH2, v=0
  395288.5680  0.0060 -4.2075 3  973.8586159  71510 303793050      792951        syn-C2H3C(O)NH2, v=0
  395345.3075  0.0200 -3.6818 3  632.1658121 -71510 303602931      602832        syn-C2H3C(O)NH2, v=0
  395345.3075  0.0200 -3.6818 3  632.1658121 -71510 303602932      602833        syn-C2H3C(O)NH2, v=0
  395444.9045  0.0025 -5.8138 3   66.6703 41  71510 303201110      20 813        syn-C2H3C(O)NH2, v=0
  395451.6021  0.0017 -5.7420 3  605.4634109  71510 303543321      533320        syn-C2H3C(O)NH2, v=0
  395451.6021  0.0017 -5.7420 3  605.4634109  71510 303543322      533321        syn-C2H3C(O)NH2, v=0
  395457.8322  0.0200 -3.4215 3  396.6737109 -71510 303541242      531341        syn-C2H3C(O)NH2, v=0
  395500.9653  0.1255 -6.2404 3 1695.0369217  71510 303A83376      A73473        syn-C2H3C(O)NH2, v=0
  395536.1508  0.1257 -6.2403 3 1695.0368217  71510 303A83375      A73474        syn-C2H3C(O)NH2, v=0
  395543.3634  0.0027 -6.0803 3   68.0122 45  71510 30322 913      22 418        syn-C2H3C(O)NH2, v=0
  395630.6409  0.0012 -5.1099 3  375.8102105  71510 303521439      511438        syn-C2H3C(O)NH2, v=0
  395660.5437  0.0087 -4.1279 3  494.4234137  71510 30368 266      68 167        syn-C2H3C(O)NH2, v=0
  395660.5437  0.0087 -4.1279 3  494.4234137  71510 30368 366      68 267        syn-C2H3C(O)NH2, v=0
  395714.8593  0.0016 -5.6946 3  590.2419109  71510 303543222      533221        syn-C2H3C(O)NH2, v=0
  395714.8593  0.0016 -5.6946 3  590.2419109  71510 303543223      533222        syn-C2H3C(O)NH2, v=0
  395751.5641  0.0035 -3.5235 3  146.2361 67  71510 30333 924      32 825        syn-C2H3C(O)NH2, v=0
  395833.9433  0.0012 -5.2277 3  423.8659107  71510 303531935      521934        syn-C2H3C(O)NH2, v=0
  395835.7600  0.0012 -5.2277 3  423.8659107  71510 303531934      521933        syn-C2H3C(O)NH2, v=0
  395863.3866  0.0200 -3.6626 3  617.4095119 -71510 303592930      592831        syn-C2H3C(O)NH2, v=0
  395863.3866  0.0200 -3.6626 3  617.4095119 -71510 303592931      592832        syn-C2H3C(O)NH2, v=0
  396000.5717  0.0015 -5.6490 3  575.5005109  71510 303543123      533122        syn-C2H3C(O)NH2, v=0
  396000.5717  0.0015 -5.6490 3  575.5005109  71510 303543124      533123        syn-C2H3C(O)NH2, v=0
  396175.1396  0.0028 -5.0016 3   50.1456 41  71510 30320 713      19 416        syn-C2H3C(O)NH2, v=0
  396312.1266  0.0014 -5.6053 3  561.2406109  71510 303543024      533023        syn-C2H3C(O)NH2, v=0
  396312.1266  0.0014 -5.6053 3  561.2406109  71510 303543025      533024        syn-C2H3C(O)NH2, v=0
  396319.1578  0.0035 -3.7197 3  464.6628117  71510 303581444      571543        syn-C2H3C(O)NH2, v=0
  396336.0140  0.2148 -6.0884 3 1984.4195241  71510 303C02793      C02694        syn-C2H3C(O)NH2, v=0
  396355.2895  0.0017 -3.6443 3  602.9063117  71510 303582929      582830        syn-C2H3C(O)NH2, v=0
  396355.2895  0.0017 -3.6443 3  602.9063117  71510 303582930      582831        syn-C2H3C(O)NH2, v=0
  396401.0492  0.0821 -5.8610 3 1876.9535229  71510 303B43480      B43381        syn-C2H3C(O)NH2, v=0
  396445.7509  0.0056 -4.1729 3  954.2458157  71510 303783048      782949        syn-C2H3C(O)NH2, v=0
  396445.7527  0.0056 -4.1729 3  954.2458157  71510 303783049      782950        syn-C2H3C(O)NH2, v=0
  396505.8852  0.0062 -4.0230 3  732.2940157  71510 30378 870      78 771        syn-C2H3C(O)NH2, v=0
  396505.8852  0.0062 -4.0230 3  732.2940157  71510 30378 970      78 871        syn-C2H3C(O)NH2, v=0
  396567.0244  0.1195 -5.5803 3 1714.1191225  71510 303B22488      B22389        syn-C2H3C(O)NH2, v=0
  396574.9227  0.0142 -4.6351 3 1219.6654181  71510 303903159      903060        syn-C2H3C(O)NH2, v=0
  396575.4569  0.0142 -4.6351 3 1219.6654181  71510 303903160      903061        syn-C2H3C(O)NH2, v=0
  396621.1917  0.0015 -5.1014 3  425.2186127  71510 30363 261      62 260        syn-C2H3C(O)NH2, v=0
  396621.1917  0.0015 -2.9330 3  425.2186127  71510 30363 261      62 360        syn-C2H3C(O)NH2, v=0
  396621.1917  0.0015 -2.9330 3  425.2186127  71510 30363 361      62 260        syn-C2H3C(O)NH2, v=0
  396621.1917  0.0015 -5.1014 3  425.2186127  71510 30363 361      62 360        syn-C2H3C(O)NH2, v=0
  396621.7599  0.0013 -5.1078 3  423.6634125  71510 30362 359      61 358        syn-C2H3C(O)NH2, v=0
  396621.7599  0.0013 -2.9584 3  423.6634125  71510 30362 359      61 458        syn-C2H3C(O)NH2, v=0
  396621.7599  0.0013 -2.9584 3  423.6634125  71510 30362 459      61 358        syn-C2H3C(O)NH2, v=0
  396621.7599  0.0013 -5.1078 3  423.6634125  71510 30362 459      61 458        syn-C2H3C(O)NH2, v=0
  396629.0621  0.0018 -5.0941 3  426.2570129  71510 30364 163      63 162        syn-C2H3C(O)NH2, v=0
  396629.0513  0.0200 -2.9085 3  426.2570129 -71510 30364 163      63 262        syn-C2H3C(O)NH2, v=0
  396629.0513  0.0200 -2.9085 3  426.2570129 -71510 30364 263      63 162        syn-C2H3C(O)NH2, v=0
  396629.0621  0.0018 -5.0941 3  426.2570129  71510 30364 263      63 262        syn-C2H3C(O)NH2, v=0
  396638.3279  0.0013 -5.1131 3  421.5819123  71510 30361 457      60 456        syn-C2H3C(O)NH2, v=0
  396638.3293  0.0200 -2.9849 3  421.5819123 -71510 30361 457      60 556        syn-C2H3C(O)NH2, v=0
  396638.3293  0.0200 -2.9849 3  421.5819123 -71510 30361 557      60 456        syn-C2H3C(O)NH2, v=0
  396638.3279  0.0013 -5.1131 3  421.5819123  71510 30361 557      60 556        syn-C2H3C(O)NH2, v=0
  396640.0670  0.0024 -5.0858 3  426.7861131  71510 30365 065      64 064        syn-C2H3C(O)NH2, v=0
  396640.0608  0.0200 -2.8846 3  426.7861131 -71510 30365 065      64 164        syn-C2H3C(O)NH2, v=0
  396640.0608  0.0200 -2.8846 3  426.7861131 -71510 30365 165      64 064        syn-C2H3C(O)NH2, v=0
  396640.0670  0.0024 -5.0858 3  426.7861131  71510 30365 165      64 164        syn-C2H3C(O)NH2, v=0
  396653.5753  0.0014 -5.5634 3  547.4641109  71510 303542925      532924        syn-C2H3C(O)NH2, v=0
  396653.5753  0.0014 -5.5634 3  547.4641109  71510 303542926      532925        syn-C2H3C(O)NH2, v=0
  396660.8891  0.0811 -5.2846 3 1552.8719215  71510 303A72285      A72186        syn-C2H3C(O)NH2, v=0
  396681.9019  0.0013 -5.1173 3  418.9623121  71510 30360 555      59 554        syn-C2H3C(O)NH2, v=0
  396681.8891  0.0200 -3.0131 3  418.9623121 -71510 30360 555      59 654        syn-C2H3C(O)NH2, v=0
  396681.8891  0.0200 -3.0131 3  418.9623121 -71510 30360 655      59 554        syn-C2H3C(O)NH2, v=0
  396681.9019  0.0013 -5.1173 3  418.9623121  71510 30360 655      59 654        syn-C2H3C(O)NH2, v=0
  396693.1252  0.0809 -5.2846 3 1552.8720215  71510 303A72385      A72286        syn-C2H3C(O)NH2, v=0
  396718.7221  0.1185 -5.5800 3 1714.1199225  71510 303B22588      B22489        syn-C2H3C(O)NH2, v=0
  396727.5389  0.0055 -5.3022 3  113.5744 61  71510 30330 724      30 427        syn-C2H3C(O)NH2, v=0
  396768.9528  0.0200 -3.0435 3  415.7892119 -71510 30359 653      58 752        syn-C2H3C(O)NH2, v=0
  396768.9521  0.0012 -5.1204 3  415.7892119  71510 30359 753      58 752        syn-C2H3C(O)NH2, v=0
  396768.9523  0.0012 -5.1204 3  415.7892119  71510 30359 653      58 652        syn-C2H3C(O)NH2, v=0
  396768.9528  0.0200 -3.0435 3  415.7892119 -71510 30359 753      58 652        syn-C2H3C(O)NH2, v=0
  396782.2076  0.0724 -5.5593 3 1348.0220195  71510 303972869      962968        syn-C2H3C(O)NH2, v=0
  396822.0547  0.0017 -3.6271 3  588.6557115  71510 303572928      572829        syn-C2H3C(O)NH2, v=0
  396822.0547  0.0017 -3.6271 3  588.6557115  71510 303572929      572830        syn-C2H3C(O)NH2, v=0
  396890.6930  0.0489 -5.4623 3 1667.8534215  71510 303A73374      A73275        syn-C2H3C(O)NH2, v=0
  396925.0591  0.0200 -3.0769 3  412.0426117 -71510 30358 751      57 850        syn-C2H3C(O)NH2, v=0
  396925.0537  0.0012 -5.1222 3  412.0426117  71510 30358 851      57 850        syn-C2H3C(O)NH2, v=0
  396925.0603  0.0012 -5.1222 3  412.0426117  71510 30358 751      57 750        syn-C2H3C(O)NH2, v=0
  396925.0591  0.0200 -3.0769 3  412.0426117 -71510 30358 851      57 750        syn-C2H3C(O)NH2, v=0
  396929.0611  0.0013 -5.0679 3  355.9693103  71510 303511239      501238        syn-C2H3C(O)NH2, v=0
  396949.5672  0.0026 -5.9514 3   61.7130 39  71510 3031911 8      19 811        syn-C2H3C(O)NH2, v=0
  397004.2249  0.0059 -3.9686 3  609.2910147  71510 30373 568      73 469        syn-C2H3C(O)NH2, v=0
  397004.2249  0.0059 -3.9686 3  609.2910147  71510 30373 668      73 569        syn-C2H3C(O)NH2, v=0
  397008.6541  0.0779 -5.8597 3 1876.9296229  71510 303B43481      B43382        syn-C2H3C(O)NH2, v=0
  397013.8419  0.0483 -5.4621 3 1667.8487215  71510 303A73375      A73276        syn-C2H3C(O)NH2, v=0
  397023.8385  0.0026 -5.9513 3   61.7105 39  71510 3031911 9      19 812        syn-C2H3C(O)NH2, v=0
  397029.8064  0.0014 -5.5231 3  534.1730109  71510 303542826      532825        syn-C2H3C(O)NH2, v=0
  397029.8064  0.0014 -5.5231 3  534.1730109  71510 303542827      532826        syn-C2H3C(O)NH2, v=0
  397085.7511  0.0449 -4.9005 3 1336.7142201  71510 303A01981      A01882        syn-C2H3C(O)NH2, v=0
  397087.7113  0.0449 -4.9005 3 1336.7142201  71510 303A02081      A01982        syn-C2H3C(O)NH2, v=0
  397141.8458  0.1297 -6.2286 3 2068.4406241  71510 303C03585      C03486        syn-C2H3C(O)NH2, v=0
  397157.8735  0.0014 -5.0888 3  363.5373103  71510 303511437      501436        syn-C2H3C(O)NH2, v=0
  397162.3977  0.1136 -6.1033 3 1627.6427213  71510 303A63275      A53372        syn-C2H3C(O)NH2, v=0
  397191.7000  0.0012 -3.1147 3  407.6947115  71510 30357 849      56 948        syn-C2H3C(O)NH2, v=0
  397191.9372  0.0012 -5.1225 3  407.6947115  71510 30357 949      56 948        syn-C2H3C(O)NH2, v=0
  397192.1408  0.0012 -5.1225 3  407.6947115  71510 30357 849      56 848        syn-C2H3C(O)NH2, v=0
  397192.3779  0.0012 -3.1147 3  407.6947115  71510 30357 949      56 848        syn-C2H3C(O)NH2, v=0
  397252.7109  0.1140 -6.1031 3 1627.6424213  71510 303A63274      A53373        syn-C2H3C(O)NH2, v=0
  397264.7344  0.0016 -3.6108 3  574.6575113  71510 303562927      562828        syn-C2H3C(O)NH2, v=0
  397264.7344  0.0016 -3.6108 3  574.6575113  71510 303562928      562829        syn-C2H3C(O)NH2, v=0
  397271.1989  0.0275 -5.0481 3 1446.6766199  71510 303993267      993168        syn-C2H3C(O)NH2, v=0
  397283.6475  0.0275 -5.0480 3 1446.6762199  71510 303993268      993169        syn-C2H3C(O)NH2, v=0
  397327.4500  0.0012 -5.2009 3  415.6886107  71510 303531836      521835        syn-C2H3C(O)NH2, v=0
  397346.1269  0.0012 -5.2009 3  415.6892107  71510 303531835      521834        syn-C2H3C(O)NH2, v=0
  397357.1484  0.2046 -6.0862 3 1984.4258241  71510 303C02893      C02794        syn-C2H3C(O)NH2, v=0
  397446.7778  0.0013 -5.4845 3  521.3697109  71510 303542727      532726        syn-C2H3C(O)NH2, v=0
  397446.7778  0.0013 -5.4845 3  521.3697109  71510 303542728      532727        syn-C2H3C(O)NH2, v=0
  397468.3093  0.0595 -5.4446 3 1288.3299191  71510 303952769      942866        syn-C2H3C(O)NH2, v=0
  397550.4020  0.0052 -4.1392 3  934.8944155  71510 303773047      772948        syn-C2H3C(O)NH2, v=0
  397550.4028  0.0052 -4.1392 3  934.8944155  71510 303773048      772949        syn-C2H3C(O)NH2, v=0
  397567.5176  0.0048 -5.9420 3   75.9398 49  71510 30324 816      24 321        syn-C2H3C(O)NH2, v=0
  397635.2185  0.0011 -3.1590 3  402.7063113  71510 30356 947      551046        syn-C2H3C(O)NH2, v=0
  397639.8689  0.0013 -3.2931 3  377.2947107  71510 303531242      521141        syn-C2H3C(O)NH2, v=0
  397641.2585  0.0011 -5.1210 3  402.7063113  71510 303561047      551046        syn-C2H3C(O)NH2, v=0
  397646.0235  0.0011 -5.1210 3  402.7059113  71510 30356 947      55 946        syn-C2H3C(O)NH2, v=0
  397652.0635  0.0011 -3.1590 3  402.7059113  71510 303561047      55 946        syn-C2H3C(O)NH2, v=0
  397684.3223  0.0016 -3.5956 3  560.9112111  71510 303552926      552827        syn-C2H3C(O)NH2, v=0
  397684.3223  0.0016 -3.5956 3  560.9112111  71510 303552927      552828        syn-C2H3C(O)NH2, v=0
  397752.0543  0.0012 -3.2937 3  390.5585109  71510 303541143      531242        syn-C2H3C(O)NH2, v=0
  397818.0286  0.0051 -5.0871 3  132.9663 65  71510 30332 825      32 528        syn-C2H3C(O)NH2, v=0
  397888.3616  0.0034 -4.4491 3  342.9048 99  71510 303491534      491237        syn-C2H3C(O)NH2, v=0
  397911.8345  0.0013 -5.4474 3  509.0573109  71510 303542628      532627        syn-C2H3C(O)NH2, v=0
  397911.8345  0.0013 -5.4474 3  509.0573109  71510 303542629      532628        syn-C2H3C(O)NH2, v=0
  397923.8047  0.0073 -4.0705 3  781.0503161  71510 30380 971      80 872        syn-C2H3C(O)NH2, v=0
  397923.8047  0.0073 -4.0705 3  781.0503161  71510 303801071      80 972        syn-C2H3C(O)NH2, v=0
  398081.7729  0.0016 -3.5815 3  547.4165109  71510 303542925      542826        syn-C2H3C(O)NH2, v=0
  398081.7729  0.0016 -3.5815 3  547.4165109  71510 303542926      542827        syn-C2H3C(O)NH2, v=0
  398158.8928  0.0027 -5.9479 3   73.6368 47  71510 30323 914      23 419        syn-C2H3C(O)NH2, v=0
  398193.8313  0.0941 -5.6216 3 1259.7564191  71510 303952472      942569        syn-C2H3C(O)NH2, v=0
  398268.5304  0.0011 -3.2142 3  397.0187111  71510 303551045      541144        syn-C2H3C(O)NH2, v=0
  398271.7085  0.0132 -4.5924 3 1197.1938179  71510 303893158      893059        syn-C2H3C(O)NH2, v=0
  398271.9928  0.0132 -4.5924 3 1197.1938179  71510 303893159      893060        syn-C2H3C(O)NH2, v=0
  398309.6184  0.0077 -4.0351 3  536.7009141  71510 30370 367      70 268        syn-C2H3C(O)NH2, v=0
  398309.6184  0.0077 -4.0351 3  536.7009141  71510 30370 467      70 368        syn-C2H3C(O)NH2, v=0
  398342.3552  0.0026 -6.1031 3   57.0100 37  71510 3031811 7      18 810        syn-C2H3C(O)NH2, v=0
  398345.2125  0.0039 -5.0589 3   53.3456 47  71510 30323 221      22 122        syn-C2H3C(O)NH2, v=0
  398361.2260  0.0039 -5.0588 3   53.3456 47  71510 30323 321      22 022        syn-C2H3C(O)NH2, v=0
  398361.4744  0.0032 -4.9683 3  142.5246 63  71510 303311219      31 922        syn-C2H3C(O)NH2, v=0
  398373.6169  0.0026 -6.1031 3   57.0090 37  71510 3031811 8      18 811        syn-C2H3C(O)NH2, v=0
  398385.4106  0.0011 -5.1174 3  397.0187111  71510 303551145      541144        syn-C2H3C(O)NH2, v=0
  398434.1538  0.0013 -5.4119 3  497.2393109  71510 303542529      532528        syn-C2H3C(O)NH2, v=0
  398434.1538  0.0013 -5.4119 3  497.2393109  71510 303542530      532529        syn-C2H3C(O)NH2, v=0
  398458.0040  0.0015 -3.5684 3  534.1730107  71510 303532924      532825        syn-C2H3C(O)NH2, v=0
  398458.0040  0.0015 -3.5684 3  534.1730107  71510 303532925      532826        syn-C2H3C(O)NH2, v=0
  398468.1258  0.0011 -5.1172 3  397.0121111  71510 303551045      541044        syn-C2H3C(O)NH2, v=0
  398570.9881  0.0473 -5.0382 3 1073.5121175  71510 303872463      862562        syn-C2H3C(O)NH2, v=0
  398585.0061  0.0011 -3.2134 3  397.0121111  71510 303551145      541044        syn-C2H3C(O)NH2, v=0
  398604.9722  0.0048 -4.1062 3  915.8035153  71510 303763046      762947        syn-C2H3C(O)NH2, v=0
  398604.9726  0.0048 -4.1062 3  915.8035153  71510 303763047      762948        syn-C2H3C(O)NH2, v=0
  398610.6556  0.0320 -5.1450 3 1118.1191179  71510 303892466      882563        syn-C2H3C(O)NH2, v=0
  398680.3052  0.0373 -4.7944 3 1275.6866197  71510 303981880      981781        syn-C2H3C(O)NH2, v=0
  398680.9043  0.0373 -4.7944 3 1275.6866197  71510 303981980      981881        syn-C2H3C(O)NH2, v=0
  398772.2592  0.0013 -5.1199 3  381.8516105  71510 303521537      511536        syn-C2H3C(O)NH2, v=0
  398793.0501  0.0010 -3.0832 3  158.6912 67  71510 303331222      321121        syn-C2H3C(O)NH2, v=0
  398813.8989  0.0015 -3.5566 3  521.1804105  71510 303522923      522824        syn-C2H3C(O)NH2, v=0
  398813.8989  0.0015 -3.5566 3  521.1804105  71510 303522924      522825        syn-C2H3C(O)NH2, v=0
  398822.1668  0.1136 -6.2249 3 2068.3735241  71510 303C03586      C03487        syn-C2H3C(O)NH2, v=0
  398864.4193  0.0106 -4.3641 3  467.0823135  71510 30367 166      67 067        syn-C2H3C(O)NH2, v=0
  398864.4193  0.0106 -4.3641 3  467.0823135  71510 30367 266      67 167        syn-C2H3C(O)NH2, v=0
  398912.1585  0.0030 -4.3602 3  443.4137113  71510 303561640      561343        syn-C2H3C(O)NH2, v=0
  399025.3842  0.0013 -5.3779 3  485.9201109  71510 303542430      532429        syn-C2H3C(O)NH2, v=0
  399025.3842  0.0013 -5.3779 3  485.9201109  71510 303542431      532430        syn-C2H3C(O)NH2, v=0
  399077.1698  0.0058 -3.9804 3  654.8361151  71510 30375 669      75 570        syn-C2H3C(O)NH2, v=0
  399077.1698  0.0058 -3.9804 3  654.8361151  71510 30375 769      75 670        syn-C2H3C(O)NH2, v=0
  399110.6055  0.0086 -4.1264 3  831.0655165  71510 303821072      82 973        syn-C2H3C(O)NH2, v=0
  399110.6055  0.0086 -4.1264 3  831.0655165  71510 303821172      821073        syn-C2H3C(O)NH2, v=0
  399111.7704  0.1027 -5.9690 3 1561.6871209  71510 303A43174      A33271        syn-C2H3C(O)NH2, v=0
  399150.3083  0.0015 -3.5459 3  508.4384103  71510 303512922      512823        syn-C2H3C(O)NH2, v=0
  399150.3083  0.0015 -3.5459 3  508.4384103  71510 303512923      512824        syn-C2H3C(O)NH2, v=0
  399185.3035  0.0012 -5.1750 3  408.1043107  71510 303531737      521736        syn-C2H3C(O)NH2, v=0
  399314.8597  0.0050 -4.3830 3  423.7272111  71510 303551540      551243        syn-C2H3C(O)NH2, v=0
  399339.0344  0.1036 -5.9685 3 1561.6866209  71510 303A43173      A33272        syn-C2H3C(O)NH2, v=0
  399345.2317  0.0012 -5.1747 3  408.1109107  71510 303531736      521735        syn-C2H3C(O)NH2, v=0
  399406.6613  0.0012 -5.1114 3  390.5585109  71510 303541243      531242        syn-C2H3C(O)NH2, v=0
  399407.6649  0.0009 -3.0821 3  158.6739 67  71510 303331221      321122        syn-C2H3C(O)NH2, v=0
  399429.9106  0.0014 -4.0682 3   88.5795 53  71510 30326 819      25 520        syn-C2H3C(O)NH2, v=0
  399448.2951  0.0046 -4.9167 3  153.6068 69  71510 30334 926      34 629        syn-C2H3C(O)NH2, v=0
  399468.0523  0.0014 -3.5365 3  495.9466101  71510 303502921      502822        syn-C2H3C(O)NH2, v=0
  399468.0523  0.0014 -3.5365 3  495.9466101  71510 303502922      502823        syn-C2H3C(O)NH2, v=0
  399512.7162  0.0012 -5.1058 3  383.3474107  71510 303531341      521340        syn-C2H3C(O)NH2, v=0
  399539.5853  0.0255 -4.9987 3 1421.8403197  71510 303983266      983167        syn-C2H3C(O)NH2, v=0
  399546.6381  0.0255 -4.9987 3 1421.8401197  71510 303983267      983168        syn-C2H3C(O)NH2, v=0
  399571.5926  0.0680 -5.1642 3 1487.7037211  71510 303A52184      A52085        syn-C2H3C(O)NH2, v=0
  399582.5852  0.0062 -4.8284 3  193.3111 77  71510 30338 929      38 632        syn-C2H3C(O)NH2, v=0
  399582.6240  0.0679 -5.1642 3 1487.7037211  71510 303A52284      A52185        syn-C2H3C(O)NH2, v=0
  399611.7578  0.0044 -4.0740 3  896.9726151  71510 303753045      752946        syn-C2H3C(O)NH2, v=0
  399611.7580  0.0044 -4.0740 3  896.9726151  71510 303753046      752947        syn-C2H3C(O)NH2, v=0
  399627.6509  0.0028 -6.2383 3  415.6892103  71510 303512131      521834        syn-C2H3C(O)NH2, v=0
  399648.1056  0.0028 -6.2382 3  415.6886103  71510 303512130      521835        syn-C2H3C(O)NH2, v=0
  399670.0098  0.1467 -5.7579 3 1811.6235231  71510 303B52590      B52491        syn-C2H3C(O)NH2, v=0
  399700.5941  0.0013 -5.3453 3  475.1054109  71510 303542331      532330        syn-C2H3C(O)NH2, v=0
  399700.5941  0.0013 -5.3453 3  475.1054109  71510 303542332      532331        syn-C2H3C(O)NH2, v=0
  399717.2861  0.0508 -5.3319 3 1230.1000187  71510 303932668      922765        syn-C2H3C(O)NH2, v=0
  399767.9217  0.0014 -3.5284 3  483.7047 99  71510 303492920      492821        syn-C2H3C(O)NH2, v=0
  399767.9217  0.0014 -3.5284 3  483.7047 99  71510 303492921      492822        syn-C2H3C(O)NH2, v=0
  399825.7847  0.0450 -5.4068 3 1640.8934213  71510 303A63373      A63274        syn-C2H3C(O)NH2, v=0
  399869.7651  0.0309 -4.6929 3 1215.8512193  71510 303961779      961680        syn-C2H3C(O)NH2, v=0
  399869.9401  0.0309 -4.6929 3 1215.8512193  71510 303961879      961780        syn-C2H3C(O)NH2, v=0
  399890.3954  0.0123 -4.5506 3 1174.9895177  71510 303883157      883058        syn-C2H3C(O)NH2, v=0
  399890.5451  0.0123 -4.5506 3 1174.9895177  71510 303883158      883059        syn-C2H3C(O)NH2, v=0
  399899.0207  0.0448 -5.4067 3 1640.8906213  71510 303A63374      A63275        syn-C2H3C(O)NH2, v=0
  399920.7814  0.1447 -5.7574 3 1811.6248231  71510 303B52690      B52591        syn-C2H3C(O)NH2, v=0
  399930.9582  0.0028 -3.3709 3  289.7024 93  71510 303461235      451134        syn-C2H3C(O)NH2, v=0
  399939.3047  0.0042 -4.1342 3   81.7129 53  71510 30326 521      25 422        syn-C2H3C(O)NH2, v=0
  400050.6800  0.0014 -3.5218 3  471.7124 97  71510 303482919      482820        syn-C2H3C(O)NH2, v=0
  400050.6800  0.0014 -3.5218 3  471.7124 97  71510 303482920      482821        syn-C2H3C(O)NH2, v=0
  400055.9470  0.0102 -4.1896 3  882.3332169  71510 303841173      841074        syn-C2H3C(O)NH2, v=0
  400055.9470  0.0102 -4.1896 3  882.3332169  71510 303841273      841174        syn-C2H3C(O)NH2, v=0
  400111.7457  0.0745 -5.7997 3 1848.1205227  71510 303B33479      B33380        syn-C2H3C(O)NH2, v=0
  400233.8523  0.0031 -4.6855 3  189.3346 75  71510 303371127      37 830        syn-C2H3C(O)NH2, v=0
  400317.0642  0.0014 -3.5166 3  459.9695 95  71510 303472918      472819        syn-C2H3C(O)NH2, v=0
  400317.0642  0.0014 -3.5166 3  459.9695 95  71510 303472919      472820        syn-C2H3C(O)NH2, v=0
  400406.5549  0.0012 -5.1090 3  390.4700109  71510 303541143      531142        syn-C2H3C(O)NH2, v=0
  400479.7339  0.0012 -5.3140 3  464.8022109  71510 303542233      532232        syn-C2H3C(O)NH2, v=0
  400479.7354  0.0012 -5.3140 3  464.8022109  71510 303542232      532231        syn-C2H3C(O)NH2, v=0
  400486.9606  0.0721 -5.7989 3 1848.1059227  71510 303B33480      B33381        syn-C2H3C(O)NH2, v=0
  400503.7497  0.0012 -2.7716 3  118.1501 39  71510 3031919 0      1818 1        syn-C2H3C(O)NH2, v=0
  400503.7497  0.0012 -2.7716 3  118.1501 39  71510 3031919 1      1818 0        syn-C2H3C(O)NH2, v=0
  400541.6414  0.1006 -5.4501 3 1646.0278221  71510 303B02387      B02288        syn-C2H3C(O)NH2, v=0
  400552.4868  0.0010 -3.2029 3  171.0210 71  71510 303351124      341025        syn-C2H3C(O)NH2, v=0
  400559.3729  0.1709 -5.9451 3 1393.8044201  71510 303A02576      992673        syn-C2H3C(O)NH2, v=0
  400567.7866  0.0014 -3.5131 3  448.4755 93  71510 303462917      462818        syn-C2H3C(O)NH2, v=0
  400567.7866  0.0014 -3.5131 3  448.4755 93  71510 303462918      462819        syn-C2H3C(O)NH2, v=0
  400572.9115  0.0041 -4.0426 3  878.4011149  71510 303743044      742945        syn-C2H3C(O)NH2, v=0
  400572.9116  0.0041 -4.0426 3  878.4011149  71510 303743045      742946        syn-C2H3C(O)NH2, v=0
  400597.1140  0.1002 -5.4499 3 1646.0281221  71510 303B02487      B02388        syn-C2H3C(O)NH2, v=0
  400651.8188  0.0414 -5.2295 3 1173.3540183  71510 303912567      902664        syn-C2H3C(O)NH2, v=0
  400661.4700  0.0019 -5.2245 3   43.6454 37  71510 30318 810      17 513        syn-C2H3C(O)NH2, v=0
  400687.8317  0.0255 -4.5961 3 1157.2167189  71510 303941678      941579        syn-C2H3C(O)NH2, v=0
  400687.8805  0.0255 -4.5961 3 1157.2167189  71510 303941778      941679        syn-C2H3C(O)NH2, v=0
  400748.1247  0.0121 -4.2596 3  934.8465173  71510 303861274      861175        syn-C2H3C(O)NH2, v=0
  400748.1248  0.0121 -4.2596 3  934.8465173  71510 303861374      861275        syn-C2H3C(O)NH2, v=0
  400775.8033  0.0069 -3.9964 3  580.2750145  71510 30372 468      72 369        syn-C2H3C(O)NH2, v=0
  400775.8033  0.0069 -3.9964 3  580.2750145  71510 30372 568      72 469        syn-C2H3C(O)NH2, v=0
  400780.1829  0.0023 -3.5502 3  430.0451113  71510 303561343      551442        syn-C2H3C(O)NH2, v=0
  400803.5358  0.0014 -3.5114 3  437.2303 91  71510 303452916      452817        syn-C2H3C(O)NH2, v=0
  400803.5358  0.0014 -3.5114 3  437.2303 91  71510 303452917      452818        syn-C2H3C(O)NH2, v=0
  400934.7701  0.0011 -2.8009 3  119.3889 43  71510 3032118 3      2017 4        syn-C2H3C(O)NH2, v=0
  400934.7701  0.0011 -2.8009 3  119.3889 43  71510 3032118 4      2017 3        syn-C2H3C(O)NH2, v=0
  400947.3146  0.0062 -4.0073 3  701.6596155  71510 30377 770      77 671        syn-C2H3C(O)NH2, v=0
  400947.3146  0.0062 -4.0073 3  701.6596155  71510 30377 870      77 771        syn-C2H3C(O)NH2, v=0
  401024.9776  0.0015 -3.5115 3  426.2336 89  71510 303442915      442816        syn-C2H3C(O)NH2, v=0
  401024.9776  0.0015 -3.5115 3  426.2336 89  71510 303442916      442817        syn-C2H3C(O)NH2, v=0
  401112.6967  0.0009 -3.0056 3  148.1144 63  71510 303311319      301218        syn-C2H3C(O)NH2, v=0
  401124.4111  0.0009 -3.0055 3  148.1140 63  71510 303311318      301219        syn-C2H3C(O)NH2, v=0
  401162.5982  0.0211 -4.5041 3 1099.7912185  71510 303921577      921478        syn-C2H3C(O)NH2, v=0
  401162.6112  0.0211 -4.5041 3 1099.7912185  71510 303921677      921578        syn-C2H3C(O)NH2, v=0
  401173.8256  0.0145 -4.3356 3  988.5987177  71510 303881375      881276        syn-C2H3C(O)NH2, v=0
  401173.8264  0.0145 -4.3356 3  988.5987177  71510 303881475      881376        syn-C2H3C(O)NH2, v=0
  401232.7561  0.0015 -3.5137 3  415.4851 87  71510 303432914      432815        syn-C2H3C(O)NH2, v=0
  401232.7561  0.0015 -3.5137 3  415.4851 87  71510 303432915      432816        syn-C2H3C(O)NH2, v=0
  401251.8306  0.0041 -6.1876 3  757.5291111  71510 303554114      544113        syn-C2H3C(O)NH2, v=0
  401251.8306  0.0041 -6.1876 3  757.5291111  71510 303554115      544114        syn-C2H3C(O)NH2, v=0
  401317.8244  0.0175 -4.4172 3 1043.5827181  71510 303901476      901377        syn-C2H3C(O)NH2, v=0
  401317.8276  0.0175 -4.4172 3 1043.5827181  71510 303901576      901477        syn-C2H3C(O)NH2, v=0
  401340.2770  0.0200 -2.8317 3  122.0999 47 -71510 3032317 6      2216 7        syn-C2H3C(O)NH2, v=0
  401340.2770  0.0200 -2.8317 3  122.0999 47 -71510 3032317 7      2216 6        syn-C2H3C(O)NH2, v=0
  401364.0791  0.0012 -5.1502 3  401.1482107  71510 303531638      521637        syn-C2H3C(O)NH2, v=0
  401371.6250  0.0926 -5.8378 3 1497.1743205  71510 303A23073      A13170        syn-C2H3C(O)NH2, v=0
  401389.9950  0.0012 -5.2841 3  455.0196109  71510 303542134      532133        syn-C2H3C(O)NH2, v=0
  401390.0183  0.0012 -5.2841 3  455.0196109  71510 303542133      532132        syn-C2H3C(O)NH2, v=0
  401417.4723  0.0036 -6.1222 3  738.5081111  71510 303554015      544014        syn-C2H3C(O)NH2, v=0
  401417.4723  0.0036 -6.1222 3  738.5081111  71510 303554016      544015        syn-C2H3C(O)NH2, v=0
  401427.4946  0.0015 -3.5183 3  404.9845 85  71510 303422913      422814        syn-C2H3C(O)NH2, v=0
  401427.4946  0.0015 -3.5183 3  404.9845 85  71510 303422914      422815        syn-C2H3C(O)NH2, v=0
  401435.3311  0.0114 -4.5095 3 1153.0515175  71510 303873156      873057        syn-C2H3C(O)NH2, v=0
  401435.4091  0.0114 -4.5095 3 1153.0515175  71510 303873157      873058        syn-C2H3C(O)NH2, v=0
  401490.4561  0.0039 -4.0120 3  860.0885147  71510 303733043      732944        syn-C2H3C(O)NH2, v=0
  401490.4561  0.0039 -4.0120 3  860.0885147  71510 303733044      732945        syn-C2H3C(O)NH2, v=0
  401571.8938  0.0035 -4.3628 3  458.0004115  71510 303571641      571344        syn-C2H3C(O)NH2, v=0
  401591.9277  0.0032 -6.0598 3  719.9604111  71510 303553916      543915        syn-C2H3C(O)NH2, v=0
  401591.9277  0.0032 -6.0598 3  719.9604111  71510 303553917      543916        syn-C2H3C(O)NH2, v=0
  401609.7964  0.0016 -3.5254 3  394.7316 83  71510 303412912      412813        syn-C2H3C(O)NH2, v=0
  401609.7964  0.0016 -3.5254 3  394.7316 83  71510 303412913      412814        syn-C2H3C(O)NH2, v=0
  401681.2235  0.0200 -2.8655 3  126.2979 51 -71510 3032516 9      241510        syn-C2H3C(O)NH2, v=0
  401681.2235  0.0200 -2.8655 3  126.2979 51 -71510 303251610      2415 9        syn-C2H3C(O)NH2, v=0
  401683.7843  0.1153 -6.1620 3 2037.9988239  71510 303B93584      B93485        syn-C2H3C(O)NH2, v=0
  401691.9821  0.0094 -4.1446 3  508.6613139  71510 30369 267      69 168        syn-C2H3C(O)NH2, v=0
  401691.9821  0.0094 -4.1446 3  508.6613139  71510 30369 367      69 268        syn-C2H3C(O)NH2, v=0
  401696.7893  0.0237 -4.9502 3 1397.2772195  71510 303973265      973166        syn-C2H3C(O)NH2, v=0
  401698.4875  0.0030 -4.3786 3  428.9753111  71510 303551639      551342        syn-C2H3C(O)NH2, v=0
  401700.7439  0.0237 -4.9502 3 1397.2771195  71510 303973266      973167        syn-C2H3C(O)NH2, v=0
  401707.6408  0.0013 -5.0777 3  369.2094105  71510 303521240      511239        syn-C2H3C(O)NH2, v=0
  401776.2731  0.0028 -6.0001 3  701.8868111  71510 303553817      543816        syn-C2H3C(O)NH2, v=0
  401776.2731  0.0028 -6.0001 3  701.8868111  71510 303553818      543817        syn-C2H3C(O)NH2, v=0
  401780.2457  0.0017 -3.5355 3  384.7261 81  71510 303402911      402812        syn-C2H3C(O)NH2, v=0
  401780.2457  0.0017 -3.5355 3  384.7261 81  71510 303402912      402813        syn-C2H3C(O)NH2, v=0
  401797.1495  0.0200 -2.9490 3  139.2579 59 -71510 303291416      281315        syn-C2H3C(O)NH2, v=0
  401797.1495  0.0200 -2.9490 3  139.2579 59 -71510 303291415      281316        syn-C2H3C(O)NH2, v=0
  401882.4477  0.0200 -2.9037 3  132.0054 55 -71510 303271513      261412        syn-C2H3C(O)NH2, v=0
  401882.4477  0.0200 -2.9037 3  132.0054 55 -71510 303271512      261413        syn-C2H3C(O)NH2, v=0
  401930.9736  0.0945 -5.8366 3 1497.1729205  71510 303A23072      A13171        syn-C2H3C(O)NH2, v=0
  401939.4079  0.0017 -3.5489 3  374.9678 79  71510 303392910      392811        syn-C2H3C(O)NH2, v=0
  401939.4079  0.0017 -3.5489 3  374.9678 79  71510 303392911      392812        syn-C2H3C(O)NH2, v=0
  401949.7875  0.0569 -5.0482 3 1423.7008207  71510 303A32083      A31984        syn-C2H3C(O)NH2, v=0
  401953.0269  0.0682 -5.4343 3 1288.3164191  71510 303952768      942867        syn-C2H3C(O)NH2, v=0
  401953.4092  0.0569 -5.0482 3 1423.7008207  71510 303A32183      A32084        syn-C2H3C(O)NH2, v=0
  401971.7386  0.0025 -5.9429 3  684.2877111  71510 303553718      543717        syn-C2H3C(O)NH2, v=0
  401971.7386  0.0025 -5.9429 3  684.2877111  71510 303553719      543718        syn-C2H3C(O)NH2, v=0
  402043.9402  0.0038 -4.6011 3   62.5290 49  71510 30324 321      23 222        syn-C2H3C(O)NH2, v=0
  402061.1619  0.0012 -3.2838 3  390.4700109  71510 303541243      531142        syn-C2H3C(O)NH2, v=0
  402087.8305  0.0018 -3.5663 3  365.4565 77  71510 3033829 9      382810        syn-C2H3C(O)NH2, v=0
  402087.8305  0.0018 -3.5663 3  365.4565 77  71510 303382910      382811        syn-C2H3C(O)NH2, v=0
  402179.7367  0.0023 -5.8880 3  667.1641111  71510 303553619      543618        syn-C2H3C(O)NH2, v=0
  402179.7367  0.0023 -5.8880 3  667.1641111  71510 303553620      543619        syn-C2H3C(O)NH2, v=0
  402206.7696  0.0038 -4.6008 3   62.5290 49  71510 30324 421      23 122        syn-C2H3C(O)NH2, v=0
  402226.0438  0.0019 -3.5884 3  356.1918 75  71510 3033729 8      3728 9        syn-C2H3C(O)NH2, v=0
  402226.0438  0.0019 -3.5884 3  356.1918 75  71510 3033729 9      372810        syn-C2H3C(O)NH2, v=0
  402354.5610  0.0020 -3.6161 3  347.1737 73  71510 3033629 7      3628 8        syn-C2H3C(O)NH2, v=0
  402354.5610  0.0020 -3.6161 3  347.1737 73  71510 3033629 8      3628 9        syn-C2H3C(O)NH2, v=0
  402366.2955  0.0036 -3.9822 3  842.0342145  71510 303723042      722943        syn-C2H3C(O)NH2, v=0
  402366.2955  0.0036 -3.9822 3  842.0342145  71510 303723043      722944        syn-C2H3C(O)NH2, v=0
  402401.8956  0.0020 -5.8354 3  650.5166111  71510 303553520      543519        syn-C2H3C(O)NH2, v=0
  402401.8956  0.0020 -5.8354 3  650.5166111  71510 303553521      543520        syn-C2H3C(O)NH2, v=0
  402416.9316  0.1793 -5.9423 3 1911.7008237  71510 303B82692      B82593        syn-C2H3C(O)NH2, v=0
  402456.5733  0.0013 -5.1480 3  401.2011107  71510 303531637      521636        syn-C2H3C(O)NH2, v=0
  402469.7798  0.0012 -5.2554 3  445.7698109  71510 303542035      532034        syn-C2H3C(O)NH2, v=0
  402470.0887  0.0012 -5.2554 3  445.7698109  71510 303542034      532033        syn-C2H3C(O)NH2, v=0
  402473.8791  0.0020 -3.6510 3  338.4019 71  71510 3033529 6      3528 7        syn-C2H3C(O)NH2, v=0
  402473.8791  0.0020 -3.6510 3  338.4019 71  71510 3033529 7      3528 8        syn-C2H3C(O)NH2, v=0
  402584.4790  0.0021 -3.6951 3  329.8761 69  71510 3033429 5      3428 6        syn-C2H3C(O)NH2, v=0
  402584.4790  0.0021 -3.6951 3  329.8761 69  71510 3033429 6      3428 7        syn-C2H3C(O)NH2, v=0
  402596.8979  0.0417 -5.3523 3 1614.2135211  71510 303A53372      A53273        syn-C2H3C(O)NH2, v=0
  402607.6699  0.0070 -4.0463 3  749.7552159  71510 30379 871      79 772        syn-C2H3C(O)NH2, v=0
  402607.6699  0.0070 -4.0463 3  749.7552159  71510 30379 971      79 872        syn-C2H3C(O)NH2, v=0
  402640.0029  0.0415 -5.3522 3 1614.2118211  71510 303A53373      A53274        syn-C2H3C(O)NH2, v=0
  402640.1027  0.0019 -5.7849 3  634.3463111  71510 303553421      543420        syn-C2H3C(O)NH2, v=0
  402640.1027  0.0019 -5.7849 3  634.3463111  71510 303553422      543421        syn-C2H3C(O)NH2, v=0
  402664.3821  0.0014 -5.1153 3  436.8933127  71510 30363 360      62 359        syn-C2H3C(O)NH2, v=0
  402664.3821  0.0014 -2.9649 3  436.8933127  71510 30363 360      62 459        syn-C2H3C(O)NH2, v=0
  402664.3821  0.0014 -2.9649 3  436.8933127  71510 30363 460      62 359        syn-C2H3C(O)NH2, v=0
  402664.3821  0.0014 -5.1153 3  436.8933127  71510 30363 460      62 459        syn-C2H3C(O)NH2, v=0
  402664.5202  0.0015 -5.1091 3  438.4485129  71510 30364 262      63 261        syn-C2H3C(O)NH2, v=0
  402664.5202  0.0015 -2.9400 3  438.4485129  71510 30364 262      63 361        syn-C2H3C(O)NH2, v=0
  402664.5202  0.0015 -2.9400 3  438.4485129  71510 30364 362      63 261        syn-C2H3C(O)NH2, v=0
  402664.5202  0.0015 -5.1091 3  438.4485129  71510 30364 362      63 361        syn-C2H3C(O)NH2, v=0
  402672.6719  0.0018 -5.1019 3  439.4871131  71510 30365 164      64 163        syn-C2H3C(O)NH2, v=0
  402672.6516  0.0200 -2.9160 3  439.4871131 -71510 30365 164      64 263        syn-C2H3C(O)NH2, v=0
  402672.6516  0.0200 -2.9160 3  439.4871131 -71510 30365 264      64 163        syn-C2H3C(O)NH2, v=0
  402672.6719  0.0018 -5.1019 3  439.4871131  71510 30365 264      64 263        syn-C2H3C(O)NH2, v=0
  402679.4722  0.0013 -5.1205 3  434.8123125  71510 30362 458      61 457        syn-C2H3C(O)NH2, v=0
  402679.4665  0.0200 -2.9908 3  434.8123125 -71510 30362 458      61 557        syn-C2H3C(O)NH2, v=0
  402679.4665  0.0200 -2.9908 3  434.8123125 -71510 30362 558      61 457        syn-C2H3C(O)NH2, v=0
  402679.4722  0.0013 -5.1205 3  434.8123125  71510 30362 558      61 557        syn-C2H3C(O)NH2, v=0
  402683.7430  0.0025 -5.0938 3  440.0166133  71510 30366 066      65 065        syn-C2H3C(O)NH2, v=0
  402683.7391  0.0200 -2.8925 3  440.0166133 -71510 30366 066      65 165        syn-C2H3C(O)NH2, v=0
  402683.7391  0.0200 -2.8925 3  440.0166133 -71510 30366 166      65 065        syn-C2H3C(O)NH2, v=0
  402683.7430  0.0025 -5.0938 3  440.0166133  71510 30366 166      65 165        syn-C2H3C(O)NH2, v=0
  402686.8261  0.0022 -3.7517 3  321.5962 67  71510 3033329 4      3328 5        syn-C2H3C(O)NH2, v=0
  402686.8261  0.0022 -3.7517 3  321.5962 67  71510 3033329 5      3328 6        syn-C2H3C(O)NH2, v=0
  402713.1617  0.0037 -4.5854 3  266.3103 87  71510 303431429      431132        syn-C2H3C(O)NH2, v=0
  402720.2154  0.0013 -5.1246 3  432.1941123  71510 30361 556      60 555        syn-C2H3C(O)NH2, v=0
  402720.1969  0.0200 -3.0183 3  432.1941123 -71510 30361 556      60 655        syn-C2H3C(O)NH2, v=0
  402720.1969  0.0200 -3.0183 3  432.1941123 -71510 30361 656      60 555        syn-C2H3C(O)NH2, v=0
  402720.2154  0.0013 -5.1246 3  432.1941123  71510 30361 656      60 655        syn-C2H3C(O)NH2, v=0
  402750.3861  0.1056 -6.1597 3 2037.9565239  71510 303B93585      B93486        syn-C2H3C(O)NH2, v=0
  402781.3704  0.0023 -3.8263 3  313.5619 65  71510 3033229 3      3228 4        syn-C2H3C(O)NH2, v=0
  402781.3704  0.0023 -3.8263 3  313.5619 65  71510 3033229 4      3228 5        syn-C2H3C(O)NH2, v=0
  402802.0904  0.0200 -3.0478 3  429.0240121 -71510 30360 654      59 753        syn-C2H3C(O)NH2, v=0
  402802.0785  0.0013 -5.1275 3  429.0240121  71510 30360 654      59 653        syn-C2H3C(O)NH2, v=0
  402802.0785  0.0013 -5.1275 3  429.0240121  71510 30360 754      59 753        syn-C2H3C(O)NH2, v=0
  402802.0904  0.0200 -3.0478 3  429.0240121 -71510 30360 754      59 653        syn-C2H3C(O)NH2, v=0
  402825.5320  0.1755 -5.9415 3 1911.7031237  71510 303B82792      B82693        syn-C2H3C(O)NH2, v=0
  402868.5473  0.0024 -3.9291 3  305.7732 63  71510 3033129 2      3128 3        syn-C2H3C(O)NH2, v=0
  402868.5473  0.0024 -3.9291 3  305.7732 63  71510 3033129 3      3128 4        syn-C2H3C(O)NH2, v=0
  402896.5568  0.0017 -5.7364 3  618.6542111  71510 303553322      543321        syn-C2H3C(O)NH2, v=0
  402896.5568  0.0017 -5.7364 3  618.6542111  71510 303553323      543322        syn-C2H3C(O)NH2, v=0
  402910.4916  0.0106 -4.4692 3 1131.3790173  71510 303863155      863056        syn-C2H3C(O)NH2, v=0
  402910.5318  0.0106 -4.4692 3 1131.3790173  71510 303863156      863057        syn-C2H3C(O)NH2, v=0
  402948.7773  0.0025 -4.0833 3  298.2297 61  71510 3033029 1      3028 2        syn-C2H3C(O)NH2, v=0
  402948.7773  0.0025 -4.0833 3  298.2297 61  71510 3033029 2      3028 3        syn-C2H3C(O)NH2, v=0
  402948.8096  0.0200 -3.0801 3  425.2826119 -71510 30359 752      58 851        syn-C2H3C(O)NH2, v=0
  402948.8255  0.0012 -5.1292 3  425.2826119  71510 30359 852      58 851        syn-C2H3C(O)NH2, v=0
  402948.8290  0.0012 -5.1292 3  425.2826119  71510 30359 752      58 751        syn-C2H3C(O)NH2, v=0
  402948.8096  0.0200 -3.0801 3  425.2826119 -71510 30359 852      58 751        syn-C2H3C(O)NH2, v=0
  402950.5725  0.0013 -5.0611 3  359.5256103  71510 303511338      501337        syn-C2H3C(O)NH2, v=0
  403016.0092  0.0012 -5.1124 3  389.0070107  71510 303531440      521439        syn-C2H3C(O)NH2, v=0
  403022.4665  0.0026 -4.3625 3  290.9313 59  71510 3032929 0      2928 1        syn-C2H3C(O)NH2, v=0
  403022.4665  0.0026 -4.3625 3  290.9313 59  71510 3032929 1      2928 2        syn-C2H3C(O)NH2, v=0
  403054.1827  0.0065 -3.9887 3  625.1398149  71510 30374 569      74 470        syn-C2H3C(O)NH2, v=0
  403054.1827  0.0065 -3.9887 3  625.1398149  71510 30374 669      74 570        syn-C2H3C(O)NH2, v=0
  403083.5924  0.0030 -5.8491 3   79.4475 49  71510 30324 915      24 420        syn-C2H3C(O)NH2, v=0
  403173.8348  0.0016 -5.6898 3  603.4415111  71510 303553223      543222        syn-C2H3C(O)NH2, v=0
  403173.8348  0.0016 -5.6898 3  603.4415111  71510 303553224      543223        syn-C2H3C(O)NH2, v=0
  403196.3088  0.0012 -5.1281 3  394.8256107  71510 303531539      521538        syn-C2H3C(O)NH2, v=0
  403198.6022  0.0012 -3.1164 3  420.9436117  71510 30358 850      57 949        syn-C2H3C(O)NH2, v=0
  403198.7292  0.0012 -5.1294 3  420.9436117  71510 30358 950      57 949        syn-C2H3C(O)NH2, v=0
  403198.8394  0.0012 -5.1294 3  420.9436117  71510 30358 850      57 849        syn-C2H3C(O)NH2, v=0
  403198.9663  0.0012 -3.1164 3  420.9436117  71510 30358 950      57 849        syn-C2H3C(O)NH2, v=0
  403202.2257  0.0034 -3.9532 3  824.2376143  71510 303713041      712942        syn-C2H3C(O)NH2, v=0
  403202.2257  0.0034 -3.9532 3  824.2376143  71510 303713042      712943        syn-C2H3C(O)NH2, v=0
  403276.6293  0.0040 -4.7843 3  175.4799 73  71510 303361027      36 730        syn-C2H3C(O)NH2, v=0
  403386.9740  0.0038 -4.3238 3   71.9926 51  71510 30325 421      24 322        syn-C2H3C(O)NH2, v=0
  403474.9766  0.0015 -5.6450 3  588.7096111  71510 303553124      543123        syn-C2H3C(O)NH2, v=0
  403474.9766  0.0015 -5.6450 3  588.7096111  71510 303553125      543124        syn-C2H3C(O)NH2, v=0
  403568.2230  0.0681 -5.7396 3 1819.5760225  71510 303B23478      B23379        syn-C2H3C(O)NH2, v=0
  403613.5014  0.0012 -3.1587 3  415.9702115  71510 30357 948      561047        syn-C2H3C(O)NH2, v=0
  403616.8568  0.0012 -5.1279 3  415.9702115  71510 303571048      561047        syn-C2H3C(O)NH2, v=0
  403619.5415  0.0012 -5.1279 3  415.9699115  71510 30357 948      56 947        syn-C2H3C(O)NH2, v=0
  403622.9012  0.0200 -3.1587 3  415.9699115 -71510 303571048      56 947        syn-C2H3C(O)NH2, v=0
  403674.6958  0.0564 -5.1713 3 1150.4619181  71510 303902565      892664        syn-C2H3C(O)NH2, v=0
  403750.5922  0.0221 -4.9026 3 1372.9862193  71510 303963264      963165        syn-C2H3C(O)NH2, v=0
  403752.7868  0.0221 -4.9026 3 1372.9861193  71510 303963265      963166        syn-C2H3C(O)NH2, v=0
  403775.2084  0.0012 -5.2278 3  437.0695109  71510 303541936      531935        syn-C2H3C(O)NH2, v=0
  403778.7432  0.0012 -5.2278 3  437.0696109  71510 303541935      531934        syn-C2H3C(O)NH2, v=0
  403797.4497  0.0667 -5.7391 3 1819.5671225  71510 303B23479      B23380        syn-C2H3C(O)NH2, v=0
  403803.5942  0.0015 -5.6020 3  574.4602111  71510 303553025      543024        syn-C2H3C(O)NH2, v=0
  403803.5942  0.0015 -5.6020 3  574.4602111  71510 303553026      543025        syn-C2H3C(O)NH2, v=0
  403845.3797  0.0847 -5.3243 3 1579.0820217  71510 303A82286      A82187        syn-C2H3C(O)NH2, v=0
  403855.4175  0.0475 -4.9366 3 1360.8734203  71510 303A11982      A11883        syn-C2H3C(O)NH2, v=0
  403856.5575  0.0475 -4.9366 3 1360.8734203  71510 303A12082      A11983        syn-C2H3C(O)NH2, v=0
  403864.8587  0.0846 -5.3243 3 1579.0821217  71510 303A82386      A82287        syn-C2H3C(O)NH2, v=0
  403925.8076  0.0830 -5.7099 3 1434.1090201  71510 303A02972      993069        syn-C2H3C(O)NH2, v=0
  403999.9436  0.0032 -3.9250 3  806.6983141  71510 303703040      702941        syn-C2H3C(O)NH2, v=0
  403999.9436  0.0032 -3.9250 3  806.6983141  71510 303703041      702942        syn-C2H3C(O)NH2, v=0
  404050.4298  0.0081 -4.0950 3  799.1166163  71510 30381 972      81 873        syn-C2H3C(O)NH2, v=0
  404050.4298  0.0081 -4.0950 3  799.1166163  71510 303811072      81 973        syn-C2H3C(O)NH2, v=0
  404133.7405  0.1238 -5.6223 3 1741.7705227  71510 303B32489      B32390        syn-C2H3C(O)NH2, v=0
  404164.0137  0.0014 -5.5606 3  560.6951111  71510 303552926      542925        syn-C2H3C(O)NH2, v=0
  404164.0137  0.0014 -5.5606 3  560.6951111  71510 303552927      542926        syn-C2H3C(O)NH2, v=0
  404227.7218  0.1231 -5.6221 3 1741.7710227  71510 303B32589      B32490        syn-C2H3C(O)NH2, v=0
  404242.5311  0.0200 -3.2105 3  410.3074113 -71510 303561046      551145        syn-C2H3C(O)NH2, v=0
  404310.3591  0.0012 -5.1243 3  410.3074113  71510 303561146      551145        syn-C2H3C(O)NH2, v=0
  404313.1240  0.0012 -3.2822 3  403.8813111  71510 303551144      541243        syn-C2H3C(O)NH2, v=0
  404319.5283  0.0099 -4.4298 3 1109.9713171  71510 303853154      853055        syn-C2H3C(O)NH2, v=0
  404319.5488  0.0099 -4.4298 3 1109.9713171  71510 303853155      853056        syn-C2H3C(O)NH2, v=0
  404343.7406  0.0084 -4.0531 3  551.5429143  71510 30371 368      71 269        syn-C2H3C(O)NH2, v=0
  404343.7406  0.0084 -4.0531 3  551.5429143  71510 30371 468      71 369        syn-C2H3C(O)NH2, v=0
  404359.3807  0.0012 -5.1242 3  410.3035113  71510 303561046      551045        syn-C2H3C(O)NH2, v=0
  404427.2341  0.0200 -3.2101 3  410.3035113 -71510 303561146      551045        syn-C2H3C(O)NH2, v=0
  404555.2540  0.0037 -4.3221 3   71.9923 51  71510 30325 521      24 222        syn-C2H3C(O)NH2, v=0
  404561.4643  0.0014 -5.5209 3  547.4165111  71510 303552827      542826        syn-C2H3C(O)NH2, v=0
  404561.4643  0.0014 -5.5209 3  547.4165111  71510 303552828      542827        syn-C2H3C(O)NH2, v=0
  404680.9350  0.0044 -3.8402 3  515.8330123  71510 303611546      601645        syn-C2H3C(O)NH2, v=0
  404716.7854  0.0024 -3.3729 3  166.9310 71  71510 303351025      34 926        syn-C2H3C(O)NH2, v=0
  404761.0553  0.0030 -3.8976 3  789.4158139  71510 303693039      692940        syn-C2H3C(O)NH2, v=0
  404761.0553  0.0030 -3.8976 3  789.4158139  71510 303693040      692941        syn-C2H3C(O)NH2, v=0
  404771.3693  0.2183 -6.1335 3 2014.3445243  71510 303C12794      C12695        syn-C2H3C(O)NH2, v=0
  404826.1593  0.0060 -4.7279 3  227.4710 83  71510 303411031      41 734        syn-C2H3C(O)NH2, v=0
  404857.7962  0.0062 -5.1188 3  140.5536 67  71510 30333 726      33 429        syn-C2H3C(O)NH2, v=0
  404895.1880  0.0114 -4.3801 3  480.9175137  71510 30368 167      68 068        syn-C2H3C(O)NH2, v=0
  404895.1880  0.0114 -4.3801 3  480.9175137  71510 30368 267      68 168        syn-C2H3C(O)NH2, v=0
  404912.9821  0.0200 -3.0930 3  166.9741 69 -71510 303341223      331122        syn-C2H3C(O)NH2, v=0
  405002.3322  0.0014 -5.4828 3  534.6271111  71510 303552728      542727        syn-C2H3C(O)NH2, v=0
  405002.3322  0.0014 -5.4828 3  534.6271111  71510 303552729      542728        syn-C2H3C(O)NH2, v=0
  405139.3195  0.0065 -4.0017 3  671.2892153  71510 30376 670      76 571        syn-C2H3C(O)NH2, v=0
  405139.3195  0.0065 -4.0017 3  671.2892153  71510 30376 770      76 671        syn-C2H3C(O)NH2, v=0
  405187.7836  0.0200 -3.3900 3  410.2116111 -71510 303551243      541342        syn-C2H3C(O)NH2, v=0
  405220.2867  0.0386 -5.2987 3 1587.8119209  71510 303A43371      A43272        syn-C2H3C(O)NH2, v=0
  405245.3994  0.0386 -5.2986 3 1587.8110209  71510 303A43372      A43273        syn-C2H3C(O)NH2, v=0
  405266.8500  0.0095 -4.1522 3  849.7373167  71510 303831073      83 974        syn-C2H3C(O)NH2, v=0
  405266.8500  0.0095 -4.1522 3  849.7373167  71510 303831173      831074        syn-C2H3C(O)NH2, v=0
  405268.2792  0.0869 -5.7069 3 1434.1053201  71510 303A02971      993070        syn-C2H3C(O)NH2, v=0
  405330.7844  0.0012 -5.1183 3  403.8813111  71510 303551244      541243        syn-C2H3C(O)NH2, v=0
  405334.9591  0.0396 -4.8295 3 1299.2310199  71510 303991881      991782        syn-C2H3C(O)NH2, v=0
  405335.3027  0.0396 -4.8295 3 1299.2310199  71510 303991981      991882        syn-C2H3C(O)NH2, v=0
  405386.3403  0.0012 -5.2012 3  428.9420109  71510 303541837      531836        syn-C2H3C(O)NH2, v=0
  405389.7630  0.0037 -4.7542 3  199.4560 75  71510 303371324      371027        syn-C2H3C(O)NH2, v=0
  405420.6999  0.0012 -5.2011 3  428.9433109  71510 303541836      531835        syn-C2H3C(O)NH2, v=0
  405427.8347  0.2113 -6.1321 3 2014.3484243  71510 303C12894      C12795        syn-C2H3C(O)NH2, v=0
  405487.0837  0.0028 -3.8711 3  772.3895137  71510 303683038      682939        syn-C2H3C(O)NH2, v=0
  405487.0837  0.0028 -3.8711 3  772.3895137  71510 303683039      682940        syn-C2H3C(O)NH2, v=0
  405494.5102  0.0013 -5.4463 3  522.3302111  71510 303552629      542628        syn-C2H3C(O)NH2, v=0
  405494.5102  0.0013 -5.4463 3  522.3302111  71510 303552630      542629        syn-C2H3C(O)NH2, v=0
  405525.2990  0.0021 -4.7425 3  175.7066 71  71510 303351224      35 927        syn-C2H3C(O)NH2, v=0
  405549.7141  0.0030 -3.3663 3  277.8908 91  71510 303451234      441133        syn-C2H3C(O)NH2, v=0
  405665.8073  0.0092 -4.3911 3 1088.8275169  71510 303843153      843054        syn-C2H3C(O)NH2, v=0
  405665.8175  0.0092 -4.3911 3 1088.8275169  71510 303843154      843055        syn-C2H3C(O)NH2, v=0
  405707.8232  0.0206 -4.8558 3 1348.9660191  71510 303953263      953164        syn-C2H3C(O)NH2, v=0
  405709.0285  0.0206 -4.8558 3 1348.9659191  71510 303953264      953165        syn-C2H3C(O)NH2, v=0
  405843.8859  0.1037 -6.0970 3 2007.8547237  71510 303B83583      B83484        syn-C2H3C(O)NH2, v=0
  405855.1797  0.0012 -5.1116 3  396.6737109  71510 303541342      531341        syn-C2H3C(O)NH2, v=0
  405967.7310  0.0012 -5.1168 3  403.8261111  71510 303551144      541143        syn-C2H3C(O)NH2, v=0
  405984.1106  0.0035 -4.1276 3   81.7099 53  71510 30326 621      25 322        syn-C2H3C(O)NH2, v=0
  406047.8906  0.0013 -5.4112 3  510.5296111  71510 303552530      542529        syn-C2H3C(O)NH2, v=0
  406047.8906  0.0013 -5.4112 3  510.5296111  71510 303552531      542530        syn-C2H3C(O)NH2, v=0
  406070.4881  0.0200 -3.0910 3  166.9418 69 -71510 303341222      331123        syn-C2H3C(O)NH2, v=0
  406072.2956  0.0021 -4.7042 3  184.7088 73  71510 303361225      36 928        syn-C2H3C(O)NH2, v=0
  406095.5471  0.0325 -5.1867 3 1140.8587181  71510 303902467      892564        syn-C2H3C(O)NH2, v=0
  406179.4830  0.0200 -3.8453 3  755.6191135 -71510 303673037      672938        syn-C2H3C(O)NH2, v=0
  406179.4830  0.0200 -3.8453 3  755.6191135 -71510 303673038      672939        syn-C2H3C(O)NH2, v=0
  406203.5643  0.0021 -4.7874 3  166.9310 69  71510 303341223      34 926        syn-C2H3C(O)NH2, v=0
  406247.0987  0.0112 -4.2167 3  901.6111171  71510 303851174      851075        syn-C2H3C(O)NH2, v=0
  406247.0987  0.0112 -4.2167 3  901.6111171  71510 303851274      851175        syn-C2H3C(O)NH2, v=0
  406266.7247  0.0013 -5.0883 3  382.6089107  71510 303531241      521240        syn-C2H3C(O)NH2, v=0
  406425.8442  0.0330 -4.7270 3 1238.7825195  71510 303971780      971681        syn-C2H3C(O)NH2, v=0
  406425.9433  0.0330 -4.7270 3 1238.7825195  71510 303971880      971781        syn-C2H3C(O)NH2, v=0
  406513.2528  0.0979 -6.0955 3 2007.8283237  71510 303B83584      B83485        syn-C2H3C(O)NH2, v=0
  406576.8197  0.0713 -5.2030 3 1513.2934213  71510 303A62185      A62086        syn-C2H3C(O)NH2, v=0
  406583.3881  0.0713 -5.2030 3 1513.2934213  71510 303A62285      A62186        syn-C2H3C(O)NH2, v=0
  406662.6400  0.0737 -5.5859 3 1372.4974197  71510 303982871      972968        syn-C2H3C(O)NH2, v=0
  406675.0780  0.0013 -5.3776 3  499.2302111  71510 303552431      542430        syn-C2H3C(O)NH2, v=0
  406675.0780  0.0013 -5.3776 3  499.2302111  71510 303552432      542431        syn-C2H3C(O)NH2, v=0
  406806.6340  0.0626 -5.6806 3 1791.3170223  71510 303B13477      B13378        syn-C2H3C(O)NH2, v=0
  406815.3914  0.0077 -4.0157 3  595.7211147  71510 30373 469      73 370        syn-C2H3C(O)NH2, v=0
  406815.3914  0.0077 -4.0157 3  595.7211147  71510 30373 569      73 470        syn-C2H3C(O)NH2, v=0
  406839.6067  0.0200 -3.8204 3  739.1041133 -71510 303663036      662937        syn-C2H3C(O)NH2, v=0
  406839.6067  0.0200 -3.8204 3  739.1041133 -71510 303663037      662938        syn-C2H3C(O)NH2, v=0
  406863.7790  0.0030 -5.0313 3  134.5429 61  71510 303301218      30 921        syn-C2H3C(O)NH2, v=0
  406945.2130  0.0618 -5.6803 3 1791.3116223  71510 303B13478      B13379        syn-C2H3C(O)NH2, v=0
  406952.4417  0.0086 -4.3531 3 1067.9470167  71510 303833152      833053        syn-C2H3C(O)NH2, v=0
  406952.4468  0.0086 -4.3531 3 1067.9470167  71510 303833153      833054        syn-C2H3C(O)NH2, v=0
  406980.0772  0.0133 -4.2878 3  954.7311175  71510 303871275      871176        syn-C2H3C(O)NH2, v=0
  406980.0773  0.0133 -4.2878 3  954.7311175  71510 303871375      871276        syn-C2H3C(O)NH2, v=0
  406985.4007  0.0200 -3.2762 3  403.8261111 -71510 303551244      541143        syn-C2H3C(O)NH2, v=0
  407025.1865  0.0070 -4.0300 3  718.7171157  71510 30378 771      78 672        syn-C2H3C(O)NH2, v=0
  407025.1865  0.0070 -4.0300 3  718.7171157  71510 30378 871      78 772        syn-C2H3C(O)NH2, v=0
  407158.9908  0.0274 -4.6290 3 1179.5364191  71510 303951679      951580        syn-C2H3C(O)NH2, v=0
  407159.0181  0.0274 -4.6290 3 1179.5364191  71510 303951779      951680        syn-C2H3C(O)NH2, v=0
  407266.9445  0.0015 -5.0843 3  376.7851105  71510 303521438      511437        syn-C2H3C(O)NH2, v=0
  407379.0387  0.0012 -5.1755 3  421.4197109  71510 303541738      531737        syn-C2H3C(O)NH2, v=0
  407379.9733  0.0051 -5.3799 3   47.2159 41  71510 30320 614      19 317        syn-C2H3C(O)NH2, v=0
  407392.4573  0.0013 -5.3453 3  488.4380111  71510 303552333      542332        syn-C2H3C(O)NH2, v=0
  407392.4575  0.0013 -5.3453 3  488.4380111  71510 303552332      542331        syn-C2H3C(O)NH2, v=0
  407419.7885  0.1513 -5.8014 3 1840.0938233  71510 303B62591      B62492        syn-C2H3C(O)NH2, v=0
  407453.1993  0.0159 -4.3650 3 1009.0907179  71510 303891376      891277        syn-C2H3C(O)NH2, v=0
  407453.1997  0.0159 -4.3650 3 1009.0907179  71510 303891476      891377        syn-C2H3C(O)NH2, v=0
  407468.7540  0.0200 -3.7963 3  722.8440131 -71510 303653035      652936        syn-C2H3C(O)NH2, v=0
  407468.7540  0.0200 -3.7963 3  722.8440131 -71510 303653036      652937        syn-C2H3C(O)NH2, v=0
  407560.3796  0.0228 -4.5359 3 1121.5007187  71510 303931578      931479        syn-C2H3C(O)NH2, v=0
  407560.3867  0.0228 -4.5359 3 1121.5007187  71510 303931678      931579        syn-C2H3C(O)NH2, v=0
  407574.5460  0.0192 -4.8098 3 1325.2157189  71510 303943262      943163        syn-C2H3C(O)NH2, v=0
  407575.2011  0.0192 -4.8098 3 1325.2156189  71510 303943263      943164        syn-C2H3C(O)NH2, v=0
  407576.6522  0.1500 -5.8011 3 1840.0946233  71510 303B62691      B62592        syn-C2H3C(O)NH2, v=0
  407652.1175  0.0190 -4.4478 3 1064.6830183  71510 303911477      911378        syn-C2H3C(O)NH2, v=0
  407652.1193  0.0190 -4.4478 3 1064.6830183  71510 303911577      911478        syn-C2H3C(O)NH2, v=0
  407655.3877  0.0012 -5.1749 3  421.4317109  71510 303541737      531736        syn-C2H3C(O)NH2, v=0
  407709.1771  0.0359 -5.2460 3 1561.6871207  71510 303A33370      A33271        syn-C2H3C(O)NH2, v=0
  407722.6215  0.0102 -4.1620 3  523.1007141  71510 30370 268      70 169        syn-C2H3C(O)NH2, v=0
  407722.6215  0.0102 -4.1620 3  523.1007141  71510 30370 368      70 269        syn-C2H3C(O)NH2, v=0
  407723.6602  0.0359 -5.2460 3 1561.6866207  71510 303A33371      A33272        syn-C2H3C(O)NH2, v=0
  407789.8285  0.0200 -2.7674 3  122.7755 41 -71510 3032019 1      1918 2        syn-C2H3C(O)NH2, v=0
  407789.8285  0.0200 -2.7674 3  122.7755 41 -71510 3032019 2      1918 1        syn-C2H3C(O)NH2, v=0
  407856.6704  0.1047 -5.4914 3 1673.0540223  71510 303B12388      B12289        syn-C2H3C(O)NH2, v=0
  407862.6728  0.0021 -4.8382 3  158.3887 67  71510 303331222      33 925        syn-C2H3C(O)NH2, v=0
  407890.2241  0.0688 -5.4966 3 1235.2440189  71510 303942471      932568        syn-C2H3C(O)NH2, v=0
  407890.5050  0.1044 -5.4913 3 1673.0541223  71510 303B12488      B12389        syn-C2H3C(O)NH2, v=0
  407971.0318  0.0200 -3.0089 3  155.8126 65 -71510 303321320      311219        syn-C2H3C(O)NH2, v=0
  407996.7004  0.0200 -3.0088 3  155.8118 65 -71510 303321319      311220        syn-C2H3C(O)NH2, v=0
  408068.2400  0.0200 -3.7731 3  706.8384129 -71510 303643034      642935        syn-C2H3C(O)NH2, v=0
  408068.2400  0.0200 -3.7731 3  706.8384129 -71510 303643035      642936        syn-C2H3C(O)NH2, v=0
  408069.2499  0.0022 -4.6733 3  193.9311 75  71510 303371226      37 929        syn-C2H3C(O)NH2, v=0
  408125.8842  0.0019 -5.1081 3   48.0994 39  71510 30319 811      18 514        syn-C2H3C(O)NH2, v=0
  408137.9038  0.0059 -4.6431 3  264.2768 89  71510 303441133      44 836        syn-C2H3C(O)NH2, v=0
  408182.3196  0.0080 -4.3160 3 1047.3290165  71510 303823151      823052        syn-C2H3C(O)NH2, v=0
  408182.3221  0.0080 -4.3160 3 1047.3290165  71510 303823152      823053        syn-C2H3C(O)NH2, v=0
  408215.7789  0.0200 -2.7966 3  124.5085 45 -71510 3032218 4      2117 5        syn-C2H3C(O)NH2, v=0
  408215.7789  0.0200 -2.7966 3  124.5085 45 -71510 3032218 5      2117 4        syn-C2H3C(O)NH2, v=0
  408221.8579  0.0013 -5.3144 3  478.1607111  71510 303552234      542233        syn-C2H3C(O)NH2, v=0
  408221.8613  0.0013 -5.3144 3  478.1607111  71510 303552233      542232        syn-C2H3C(O)NH2, v=0
  408274.2706  0.1226 -6.1302 3 1654.2301215  71510 303A73276      A63373        syn-C2H3C(O)NH2, v=0
  408427.3378  0.1233 -6.1298 3 1654.2298215  71510 303A73275      A63374        syn-C2H3C(O)NH2, v=0
  408517.3664  0.0014 -5.1170 3  395.1532107  71510 303531538      521537        syn-C2H3C(O)NH2, v=0
  408587.3313  0.0017 -3.9928 3   95.0534 55  71510 30327 820      26 521        syn-C2H3C(O)NH2, v=0
  408607.4600  0.0200 -2.8278 3  127.7175 49 -71510 3032417 7      2316 8        syn-C2H3C(O)NH2, v=0
  408607.4600  0.0200 -2.8278 3  127.7175 49 -71510 3032417 8      2316 7        syn-C2H3C(O)NH2, v=0
  408622.2055  0.0041 -6.1733 3  770.9134113  71510 303564115      554114        syn-C2H3C(O)NH2, v=0
  408622.2055  0.0041 -6.1733 3  770.9134113  71510 303564116      554115        syn-C2H3C(O)NH2, v=0
  408639.2000  0.0200 -3.7508 3  691.0869127 -71510 303633033      632934        syn-C2H3C(O)NH2, v=0
  408639.2000  0.0200 -3.7508 3  691.0869127 -71510 303633034      632935        syn-C2H3C(O)NH2, v=0
  408705.0851  0.0078 -4.0702 3  767.4173161  71510 30380 872      80 773        syn-C2H3C(O)NH2, v=0
  408705.0851  0.0078 -4.0702 3  767.4173161  71510 30380 972      80 873        syn-C2H3C(O)NH2, v=0
  408706.5107  0.0014 -5.1236 3  450.3247129  71510 30364 361      63 360        syn-C2H3C(O)NH2, v=0
  408706.4587  0.0200 -2.9721 3  450.3247129 -71510 30364 361      63 460        syn-C2H3C(O)NH2, v=0
  408706.4587  0.0200 -2.9721 3  450.3247129 -71510 30364 461      63 360        syn-C2H3C(O)NH2, v=0
  408706.5107  0.0014 -5.1236 3  450.3247129  71510 30364 461      63 460        syn-C2H3C(O)NH2, v=0
  408707.3206  0.0015 -5.1175 3  451.8799131  71510 30365 263      64 262        syn-C2H3C(O)NH2, v=0
  408707.3396  0.0200 -2.9478 3  451.8799131 -71510 30365 263      64 362        syn-C2H3C(O)NH2, v=0
  408707.3396  0.0200 -2.9478 3  451.8799131 -71510 30365 363      64 262        syn-C2H3C(O)NH2, v=0
  408707.3206  0.0015 -5.1175 3  451.8799131  71510 30365 363      64 362        syn-C2H3C(O)NH2, v=0
  408715.7409  0.0019 -5.1105 3  452.9189133  71510 30366 165      65 164        syn-C2H3C(O)NH2, v=0
  408715.7397  0.0200 -2.9242 3  452.9189133 -71510 30366 165      65 264        syn-C2H3C(O)NH2, v=0
  408715.7397  0.0200 -2.9242 3  452.9189133 -71510 30366 265      65 164        syn-C2H3C(O)NH2, v=0
  408715.7409  0.0019 -5.1105 3  452.9189133  71510 30366 265      65 264        syn-C2H3C(O)NH2, v=0
  408720.2024  0.0014 -5.1286 3  448.2443127  71510 30363 459      62 458        syn-C2H3C(O)NH2, v=0
  408720.2011  0.0200 -2.9975 3  448.2443127 -71510 30363 459      62 558        syn-C2H3C(O)NH2, v=0
  408720.2011  0.0200 -2.9975 3  448.2443127 -71510 30363 559      62 458        syn-C2H3C(O)NH2, v=0
  408720.2024  0.0014 -5.1286 3  448.2443127  71510 30363 559      62 558        syn-C2H3C(O)NH2, v=0
  408726.8747  0.0026 -5.1025 3  453.4486135  71510 30367 067      66 066        syn-C2H3C(O)NH2, v=0
  408726.8598  0.0200 -2.9011 3  453.4486135 -71510 30367 067      66 166        syn-C2H3C(O)NH2, v=0
  408726.8598  0.0200 -2.9011 3  453.4486135 -71510 30367 167      66 066        syn-C2H3C(O)NH2, v=0
  408726.8747  0.0026 -5.1025 3  453.4486135  71510 30367 167      66 166        syn-C2H3C(O)NH2, v=0
  408758.2839  0.0014 -5.1326 3  445.6274125  71510 30362 557      61 556        syn-C2H3C(O)NH2, v=0
  408758.2799  0.0200 -3.0242 3  445.6274125 -71510 30362 557      61 656        syn-C2H3C(O)NH2, v=0
  408758.2799  0.0200 -3.0242 3  445.6274125 -71510 30362 657      61 556        syn-C2H3C(O)NH2, v=0
  408758.2839  0.0014 -5.1326 3  445.6274125  71510 30362 657      61 656        syn-C2H3C(O)NH2, v=0
  408795.5836  0.0036 -6.1098 3  751.8979113  71510 303564016      554015        syn-C2H3C(O)NH2, v=0
  408795.5836  0.0036 -6.1098 3  751.8979113  71510 303564017      554016        syn-C2H3C(O)NH2, v=0
  408805.8343  0.0600 -5.0861 3 1448.6725209  71510 303A42084      A41985        syn-C2H3C(O)NH2, v=0
  408807.9603  0.0599 -5.0861 3 1448.6725209  71510 303A42184      A42085        syn-C2H3C(O)NH2, v=0
  408835.3102  0.0200 -3.0529 3  442.4600123 -71510 30361 655      60 754        syn-C2H3C(O)NH2, v=0
  408835.3041  0.0013 -5.1354 3  442.4600123  71510 30361 655      60 654        syn-C2H3C(O)NH2, v=0
  408835.3041  0.0013 -5.1354 3  442.4600123  71510 30361 755      60 754        syn-C2H3C(O)NH2, v=0
  408835.3102  0.0200 -3.0529 3  442.4600123 -71510 30361 755      60 654        syn-C2H3C(O)NH2, v=0
  408871.7984  0.0200 -2.9492 3  146.4136 61 -71510 303301417      291316        syn-C2H3C(O)NH2, v=0
  408871.7984  0.0200 -2.9492 3  146.4136 61 -71510 303301416      291317        syn-C2H3C(O)NH2, v=0
  408919.1346  0.0200 -2.8624 3  132.4190 53 -71510 303261611      251510        syn-C2H3C(O)NH2, v=0
  408919.1346  0.0200 -2.8624 3  132.4190 53 -71510 303261610      251511        syn-C2H3C(O)NH2, v=0
  408973.3661  0.0200 -3.0842 3  438.7235121 -71510 30360 753      59 852        syn-C2H3C(O)NH2, v=0
  408973.3941  0.0013 -5.1369 3  438.7235121  71510 30360 853      59 852        syn-C2H3C(O)NH2, v=0
  408973.3959  0.0013 -5.1369 3  438.7235121  71510 30360 753      59 752        syn-C2H3C(O)NH2, v=0
  408973.3661  0.0200 -3.0842 3  438.7235121 -71510 30360 853      59 752        syn-C2H3C(O)NH2, v=0
  408978.3179  0.0032 -6.0490 3  733.3561113  71510 303563917      553916        syn-C2H3C(O)NH2, v=0
  408978.3179  0.0032 -6.0490 3  733.3561113  71510 303563918      553917        syn-C2H3C(O)NH2, v=0
  409063.9060  0.0200 -2.9019 3  138.6379 57 -71510 303281514      271413        syn-C2H3C(O)NH2, v=0
  409063.9060  0.0200 -2.9019 3  138.6379 57 -71510 303281513      271414        syn-C2H3C(O)NH2, v=0
  409099.0197  0.0030 -3.9934 3   91.6421 55  71510 30327 721      26 422        syn-C2H3C(O)NH2, v=0
  409102.1935  0.0073 -4.0094 3  641.1900151  71510 30375 570      75 471        syn-C2H3C(O)NH2, v=0
  409102.1935  0.0073 -4.0094 3  641.1900151  71510 30375 670      75 571        syn-C2H3C(O)NH2, v=0
  409171.5484  0.0029 -5.9908 3  715.2886113  71510 303563818      553817        syn-C2H3C(O)NH2, v=0
  409171.5484  0.0029 -5.9908 3  715.2886113  71510 303563819      553818        syn-C2H3C(O)NH2, v=0
  409182.8118  0.0200 -3.7293 3  675.5891125 -71510 303623032      622933        syn-C2H3C(O)NH2, v=0
  409182.8118  0.0200 -3.7293 3  675.5891125 -71510 303623033      622934        syn-C2H3C(O)NH2, v=0
  409193.2718  0.0012 -5.2848 3  468.4085111  71510 303552135      542134        syn-C2H3C(O)NH2, v=0
  409193.3212  0.0012 -5.2848 3  468.4085111  71510 303552134      542133        syn-C2H3C(O)NH2, v=0
  409207.7503  0.0200 -3.1192 3  434.3929119 -71510 30359 851      58 950        syn-C2H3C(O)NH2, v=0
  409207.7518  0.0012 -5.1371 3  434.3929119  71510 30359 951      58 950        syn-C2H3C(O)NH2, v=0
  409207.8111  0.0012 -5.1371 3  434.3929119  71510 30359 851      58 850        syn-C2H3C(O)NH2, v=0
  409207.7503  0.0200 -3.1192 3  434.3929119 -71510 30359 951      58 850        syn-C2H3C(O)NH2, v=0
  409269.1476  0.0640 -5.4672 3 1312.3484193  71510 303962770      952867        syn-C2H3C(O)NH2, v=0
  409356.1952  0.0179 -4.7647 3 1301.7342187  71510 303933261      933162        syn-C2H3C(O)NH2, v=0
  409356.5476  0.0179 -4.7647 3 1301.7342187  71510 303933262      933163        syn-C2H3C(O)NH2, v=0
  409358.1277  0.0074 -4.2796 3 1026.9730163  71510 303813150      813051        syn-C2H3C(O)NH2, v=0
  409358.1289  0.0074 -4.2796 3 1026.9730163  71510 303813151      813052        syn-C2H3C(O)NH2, v=0
  409367.0256  0.0034 -4.4143 3  414.6919109  71510 303541638      541341        syn-C2H3C(O)NH2, v=0
  409376.5788  0.0026 -5.9349 3  697.6961113  71510 303563719      553718        syn-C2H3C(O)NH2, v=0
  409376.5788  0.0026 -5.9349 3  697.6961113  71510 303563720      553719        syn-C2H3C(O)NH2, v=0
  409594.9062  0.0023 -5.8812 3  680.5793113  71510 303563620      553619        syn-C2H3C(O)NH2, v=0
  409594.9062  0.0023 -5.8812 3  680.5793113  71510 303563621      553620        syn-C2H3C(O)NH2, v=0
  409595.6550  0.0012 -3.1596 3  429.4334117  71510 30358 949      571048        syn-C2H3C(O)NH2, v=0
  409597.5079  0.0012 -5.1355 3  429.4334117  71510 303581049      571048        syn-C2H3C(O)NH2, v=0
  409599.0103  0.0012 -5.1355 3  429.4332117  71510 30358 949      57 948        syn-C2H3C(O)NH2, v=0
  409600.8687  0.0200 -3.1596 3  429.4332117 -71510 303581049      57 948        syn-C2H3C(O)NH2, v=0
  409609.5796  0.0012 -5.1510 3  414.5363109  71510 303541639      531638        syn-C2H3C(O)NH2, v=0
  409642.7721  0.0667 -5.3089 3 1230.0672187  71510 303932667      922766        syn-C2H3C(O)NH2, v=0
  409689.8702  0.0941 -6.0333 3 1978.0036235  71510 303B73582      B73483        syn-C2H3C(O)NH2, v=0
  409700.0788  0.0200 -3.7088 3  660.3446123 -71510 303613031      612932        syn-C2H3C(O)NH2, v=0
  409700.0788  0.0200 -3.7088 3  660.3446123 -71510 303613032      612933        syn-C2H3C(O)NH2, v=0
  409791.9627  0.0813 -5.5789 3 1372.4883197  71510 303982870      972969        syn-C2H3C(O)NH2, v=0
  409819.8648  0.0062 -5.9700 3   84.3618 55  71510 30327 423      27 126        syn-C2H3C(O)NH2, v=0
  409828.2584  0.0021 -5.8296 3  663.9393113  71510 303563521      553520        syn-C2H3C(O)NH2, v=0
  409828.2584  0.0021 -5.8296 3  663.9393113  71510 303563522      553521        syn-C2H3C(O)NH2, v=0
  409854.5572  0.0577 -5.6227 3 1763.3411221  71510 303B03476      B03377        syn-C2H3C(O)NH2, v=0
  409897.5799  0.0200 -3.2267 3  179.8500 73 -71510 303361125      351026        syn-C2H3C(O)NH2, v=0
  409937.4799  0.0573 -5.6225 3 1763.3379221  71510 303B03477      B03378        syn-C2H3C(O)NH2, v=0
  409956.8416  0.0045 -4.3873 3  472.7366117  71510 303581642      581345        syn-C2H3C(O)NH2, v=0
  410074.5667  0.0335 -5.1942 3 1535.8376205  71510 303A23369      A23270        syn-C2H3C(O)NH2, v=0
  410078.6385  0.0019 -5.7800 3  647.7769113  71510 303563422      553421        syn-C2H3C(O)NH2, v=0
  410078.6385  0.0019 -5.7800 3  647.7769113  71510 303563423      553422        syn-C2H3C(O)NH2, v=0
  410082.8358  0.0334 -5.1942 3 1535.8373205  71510 303A23370      A23271        syn-C2H3C(O)NH2, v=0
  410105.3794  0.0908 -6.0324 3 1977.9874235  71510 303B73583      B73484        syn-C2H3C(O)NH2, v=0
  410171.5504  0.0089 -4.1202 3  817.3836165  71510 30382 973      82 874        syn-C2H3C(O)NH2, v=0
  410171.5504  0.0089 -4.1202 3  817.3836165  71510 303821073      82 974        syn-C2H3C(O)NH2, v=0
  410174.0089  0.0012 -5.1165 3  402.4502109  71510 303541441      531440        syn-C2H3C(O)NH2, v=0
  410192.1853  0.0020 -3.6891 3  645.3531121  71510 303603030      602931        syn-C2H3C(O)NH2, v=0
  410192.1853  0.0020 -3.6891 3  645.3531121  71510 303603031      602932        syn-C2H3C(O)NH2, v=0
  410203.4424  0.0012 -3.2085 3  423.7938115  71510 303571047      561146        syn-C2H3C(O)NH2, v=0
  410207.9957  0.0061 -5.9694 3   84.3618 55  71510 30327 523      27 226        syn-C2H3C(O)NH2, v=0
  410209.3579  0.0060 -4.5713 3  303.7188 95  71510 303471235      47 938        syn-C2H3C(O)NH2, v=0
  410242.5265  0.0012 -5.1320 3  423.7938115  71510 303571147      561146        syn-C2H3C(O)NH2, v=0
  410253.8402  0.0022 -4.8944 3  150.0866 65  71510 303321221      32 924        syn-C2H3C(O)NH2, v=0
  410271.3009  0.0012 -5.1319 3  423.7915115  71510 303571047      561046        syn-C2H3C(O)NH2, v=0
  410286.2260  0.0057 -3.9689 3  569.6457129  71510 303641648      631747        syn-C2H3C(O)NH2, v=0
  410300.5289  0.0033 -5.7798 3   85.4481 51  71510 30325 916      25 421        syn-C2H3C(O)NH2, v=0
  410310.3851  0.0012 -3.2083 3  423.7915115  71510 303571147      561046        syn-C2H3C(O)NH2, v=0
  410348.3826  0.0018 -5.7323 3  632.0934113  71510 303563323      553322        syn-C2H3C(O)NH2, v=0
  410348.3826  0.0018 -5.7323 3  632.0934113  71510 303563324      553323        syn-C2H3C(O)NH2, v=0
  410349.4462  0.0012 -5.2563 3  459.1948111  71510 303552036      542035        syn-C2H3C(O)NH2, v=0
  410350.0682  0.0012 -5.2563 3  459.1948111  71510 303552035      542034        syn-C2H3C(O)NH2, v=0
  410376.7948  0.0092 -4.0718 3  566.5863145  71510 30372 369      72 270        syn-C2H3C(O)NH2, v=0
  410376.7948  0.0092 -4.0718 3  566.5863145  71510 30372 469      72 370        syn-C2H3C(O)NH2, v=0
  410377.7578  0.1840 -5.9872 3 1940.9911239  71510 303B92693      B92594        syn-C2H3C(O)NH2, v=0
  410471.7940  0.1111 -5.9948 3 1587.8119211  71510 303A53175      A43272        syn-C2H3C(O)NH2, v=0
  410482.3714  0.0069 -4.2440 3 1006.8781161  71510 303803149      803050        syn-C2H3C(O)NH2, v=0
  410482.3719  0.0069 -4.2440 3 1006.8781161  71510 303803150      803051        syn-C2H3C(O)NH2, v=0
  410554.9154  0.0013 -5.0642 3  372.9666105  71510 303521339      511338        syn-C2H3C(O)NH2, v=0
  410585.2466  0.0503 -4.9735 3 1385.2292205  71510 303A21983      A21884        syn-C2H3C(O)NH2, v=0
  410585.9066  0.0503 -4.9735 3 1385.2293205  71510 303A22083      A21984        syn-C2H3C(O)NH2, v=0
  410615.8865  0.0012 -3.2739 3  417.4017113  71510 303561145      551244        syn-C2H3C(O)NH2, v=0
  410635.8445  0.1815 -5.9867 3 1940.9925239  71510 303B92793      B92694        syn-C2H3C(O)NH2, v=0
  410640.2310  0.0017 -5.6865 3  616.8900113  71510 303563224      553223        syn-C2H3C(O)NH2, v=0
  410640.2310  0.0017 -5.6865 3  616.8900113  71510 303563225      553224        syn-C2H3C(O)NH2, v=0
  410660.0191  0.0010 -3.1055 3  175.5354 71  71510 303351224      341123        syn-C2H3C(O)NH2, v=0
  410660.0287  0.0019 -3.6704 3  630.6141119  71510 303593029      592930        syn-C2H3C(O)NH2, v=0
  410660.0287  0.0019 -3.6704 3  630.6141119  71510 303593030      592931        syn-C2H3C(O)NH2, v=0
  410673.4062  0.0046 -3.9853 3   98.0449 57  71510 30328 622      27 523        syn-C2H3C(O)NH2, v=0
  410727.7582  0.0427 -5.2597 3 1196.5000185  71510 303922568      912665        syn-C2H3C(O)NH2, v=0
  410842.6938  0.0013 -5.0992 3  396.1605109  71510 303541242      531241        syn-C2H3C(O)NH2, v=0
  410851.5282  0.1126 -5.9940 3 1587.8110211  71510 303A53174      A43273        syn-C2H3C(O)NH2, v=0
  410925.3343  0.0123 -4.3967 3  494.9543139  71510 30369 168      69 069        syn-C2H3C(O)NH2, v=0
  410925.3343  0.0123 -4.3967 3  494.9543139  71510 30369 268      69 169        syn-C2H3C(O)NH2, v=0
  410957.4197  0.0016 -5.6424 3  602.1681113  71510 303563125      553124        syn-C2H3C(O)NH2, v=0
  410957.4197  0.0016 -5.6424 3  602.1681113  71510 303563126      553125        syn-C2H3C(O)NH2, v=0
  410959.9989  0.0885 -5.3648 3 1605.4861219  71510 303A92287      A92188        syn-C2H3C(O)NH2, v=0
  410971.7043  0.0885 -5.3648 3 1605.4862219  71510 303A92387      A92288        syn-C2H3C(O)NH2, v=0
  411057.6794  0.0168 -4.7203 3 1278.5206185  71510 303923260      923161        syn-C2H3C(O)NH2, v=0
  411057.8670  0.0168 -4.7203 3 1278.5206185  71510 303923261      923162        syn-C2H3C(O)NH2, v=0
  411058.2321  0.0537 -5.3566 3 1253.6754189  71510 303942669      932766        syn-C2H3C(O)NH2, v=0
  411085.9636  0.0033 -4.6883 3  198.5703 77  71510 303381128      38 831        syn-C2H3C(O)NH2, v=0
  411104.6040  0.0019 -3.6527 3  616.1273117  71510 303583028      582929        syn-C2H3C(O)NH2, v=0
  411104.6040  0.0019 -3.6527 3  616.1273117  71510 303583029      582930        syn-C2H3C(O)NH2, v=0
  411132.5465  0.0060 -5.3261 3  120.5513 63  71510 30331 625      31 328        syn-C2H3C(O)NH2, v=0
  411138.9479  0.0012 -5.1300 3  408.2748109  71510 303541540      531539        syn-C2H3C(O)NH2, v=0
  411198.9121  0.0073 -4.0237 3  687.9435155  71510 30377 671      77 572        syn-C2H3C(O)NH2, v=0
  411198.9121  0.0073 -4.0237 3  687.9435155  71510 30377 771      77 672        syn-C2H3C(O)NH2, v=0
  411234.3726  0.0012 -5.1260 3  417.4017113  71510 303561245      551244        syn-C2H3C(O)NH2, v=0
  411303.7985  0.0015 -5.6000 3  587.9296113  71510 303563026      553025        syn-C2H3C(O)NH2, v=0
  411303.7985  0.0015 -5.6000 3  587.9296113  71510 303563027      553026        syn-C2H3C(O)NH2, v=0
  411353.5415  0.0013 -5.1475 3  414.6256109  71510 303541638      531637        syn-C2H3C(O)NH2, v=0
  411416.2384  0.0104 -4.1786 3  868.6098169  71510 303841074      84 975        syn-C2H3C(O)NH2, v=0
  411416.2384  0.0104 -4.1786 3  868.6098169  71510 303841174      841075        syn-C2H3C(O)NH2, v=0
  411424.1720  0.0030 -3.3523 3  266.3103 89  71510 303441233      431132        syn-C2H3C(O)NH2, v=0
  411440.2841  0.0339 -5.2399 3 1163.9271183  71510 303912468      902565        syn-C2H3C(O)NH2, v=0
  411526.8370  0.0018 -3.6360 3  601.8923115  71510 303573027      572928        syn-C2H3C(O)NH2, v=0
  411526.8370  0.0018 -3.6360 3  601.8923115  71510 303573028      572929        syn-C2H3C(O)NH2, v=0
  411557.3928  0.0065 -4.2092 3  987.0440159  71510 303793148      793049        syn-C2H3C(O)NH2, v=0
  411557.3931  0.0065 -4.2092 3  987.0440159  71510 303793149      793050        syn-C2H3C(O)NH2, v=0
  411593.9063  0.1283 -5.6652 3 1769.6135229  71510 303B42490      B42391        syn-C2H3C(O)NH2, v=0
  411633.5470  0.0012 -5.1251 3  417.3678113  71510 303561145      551144        syn-C2H3C(O)NH2, v=0
  411651.7658  0.1279 -5.6651 3 1769.6138229  71510 303B42590      B42491        syn-C2H3C(O)NH2, v=0
  411683.9858  0.0015 -5.5592 3  574.1765113  71510 303562927      552926        syn-C2H3C(O)NH2, v=0
  411683.9858  0.0015 -5.5592 3  574.1765113  71510 303562928      552927        syn-C2H3C(O)NH2, v=0
  411706.5818  0.0024 -4.6502 3  203.3679 77  71510 303381227      38 930        syn-C2H3C(O)NH2, v=0
  411753.0330  0.0012 -5.2289 3  450.5380111  71510 303551937      541936        syn-C2H3C(O)NH2, v=0
  411759.7854  0.0012 -5.2289 3  450.5382111  71510 303551936      541935        syn-C2H3C(O)NH2, v=0
  411873.9983  0.0061 -4.5121 3  345.7870101  71510 303501337      501040        syn-C2H3C(O)NH2, v=0
  411927.6183  0.0018 -3.6203 3  587.9088113  71510 303563026      562927        syn-C2H3C(O)NH2, v=0
  411927.6183  0.0018 -3.6203 3  587.9088113  71510 303563027      562928        syn-C2H3C(O)NH2, v=0
  411956.8819  0.0421 -4.8654 3 1322.9728201  71510 303A01882      A01783        syn-C2H3C(O)NH2, v=0
  411957.0782  0.0421 -4.8654 3 1322.9728201  71510 303A01982      A01883        syn-C2H3C(O)NH2, v=0
  412040.7117  0.0037 -4.5075 3  330.0397 97  71510 303481533      481236        syn-C2H3C(O)NH2, v=0
  412050.0896  0.0012 -5.1186 3  410.2116111  71510 303551343      541342        syn-C2H3C(O)NH2, v=0
  412103.5737  0.0014 -5.5201 3  560.9112113  71510 303562828      552827        syn-C2H3C(O)NH2, v=0
  412103.5737  0.0014 -5.5201 3  560.9112113  71510 303562829      552828        syn-C2H3C(O)NH2, v=0
  412240.4044  0.0060 -5.5970 3  101.8157 59  71510 30329 524      29 227        syn-C2H3C(O)NH2, v=0
  412252.0330  0.0012 -3.2703 3  417.3678113  71510 303561245      551144        syn-C2H3C(O)NH2, v=0
  412307.8056  0.0017 -3.6057 3  574.1765111  71510 303553025      552926        syn-C2H3C(O)NH2, v=0
  412307.8056  0.0017 -3.6057 3  574.1765111  71510 303553026      552927        syn-C2H3C(O)NH2, v=0
  412325.7830  0.0312 -5.1433 3 1510.2621203  71510 303A13368      A13269        syn-C2H3C(O)NH2, v=0
  412330.4572  0.0312 -5.1433 3 1510.2620203  71510 303A13369      A13270        syn-C2H3C(O)NH2, v=0
  412429.7898  0.0123 -4.2444 3  921.0893173  71510 303861175      861076        syn-C2H3C(O)NH2, v=0
  412429.7898  0.0123 -4.2444 3  921.0893173  71510 303861275      861176        syn-C2H3C(O)NH2, v=0
  412569.4070  0.0014 -5.4825 3  548.1365113  71510 303562729      552728        syn-C2H3C(O)NH2, v=0
  412569.4070  0.0014 -5.4825 3  548.1365113  71510 303562730      552729        syn-C2H3C(O)NH2, v=0
  412572.9951  0.0033 -4.9845 3   54.8972 43  71510 30321 714      20 417        syn-C2H3C(O)NH2, v=0
  412585.3864  0.0060 -4.1751 3  967.4699157  71510 303783147      783048        syn-C2H3C(O)NH2, v=0
  412585.3866  0.0060 -4.1751 3  967.4699157  71510 303783148      783049        syn-C2H3C(O)NH2, v=0
  412668.2251  0.0017 -3.5922 3  560.6951109  71510 303543024      542925        syn-C2H3C(O)NH2, v=0
  412668.2251  0.0017 -3.5922 3  560.6951109  71510 303543025      542926        syn-C2H3C(O)NH2, v=0
  412683.4597  0.0156 -4.6767 3 1255.5741183  71510 303913259      913160        syn-C2H3C(O)NH2, v=0
  412683.5585  0.0156 -4.6767 3 1255.5741183  71510 303913260      913161        syn-C2H3C(O)NH2, v=0
  412733.4214  0.0535 -5.5657 3 1735.6462219  71510 303A93475      A93376        syn-C2H3C(O)NH2, v=0
  412774.1763  0.0010 -3.1020 3  175.4770 71  71510 303351223      341124        syn-C2H3C(O)NH2, v=0
  412782.5425  0.0533 -5.5656 3 1735.6443219  71510 303A93476      A93377        syn-C2H3C(O)NH2, v=0
  412853.5478  0.0085 -4.0357 3  611.3685149  71510 30374 470      74 371        syn-C2H3C(O)NH2, v=0
  412853.5478  0.0085 -4.0357 3  611.3685149  71510 30374 570      74 471        syn-C2H3C(O)NH2, v=0
  412954.9008  0.0352 -4.7617 3 1261.9119197  71510 303981781      981682        syn-C2H3C(O)NH2, v=0
  412954.9566  0.0352 -4.7617 3 1261.9119197  71510 303981881      981782        syn-C2H3C(O)NH2, v=0
  412979.3792  0.2228 -6.1798 3 2044.4559245  71510 303C22795      C22696        syn-C2H3C(O)NH2, v=0
  412985.2618  0.1003 -5.8627 3 1522.8386207  71510 303A33074      A23171        syn-C2H3C(O)NH2, v=0
  413004.7840  0.0501 -5.3922 3 1211.1065187  71510 303932470      922567        syn-C2H3C(O)NH2, v=0
  413009.6738  0.0016 -3.5799 3  547.4641107  71510 303533023      532924        syn-C2H3C(O)NH2, v=0
  413009.6738  0.0016 -3.5799 3  547.4641107  71510 303533024      532925        syn-C2H3C(O)NH2, v=0
  413089.9682  0.0014 -5.4464 3  535.8560113  71510 303562630      552629        syn-C2H3C(O)NH2, v=0
  413089.9682  0.0014 -5.4464 3  535.8560113  71510 303562631      552630        syn-C2H3C(O)NH2, v=0
  413099.7548  0.0078 -4.0533 3  735.9757159  71510 30379 772      79 673        syn-C2H3C(O)NH2, v=0
  413099.7548  0.0078 -4.0533 3  735.9757159  71510 30379 872      79 773        syn-C2H3C(O)NH2, v=0
  413138.6804  0.0023 -4.9554 3  142.0310 63  71510 303311220      31 923        syn-C2H3C(O)NH2, v=0
  413201.6669  0.0145 -4.3167 3  974.8158177  71510 303881276      881177        syn-C2H3C(O)NH2, v=0
  413201.6670  0.0145 -4.3167 3  974.8158177  71510 303881376      881277        syn-C2H3C(O)NH2, v=0
  413272.2678  0.0861 -5.9708 3 1948.4421233  71510 303B63581      B63482        syn-C2H3C(O)NH2, v=0
  413332.9208  0.0016 -3.5687 3  534.4834105  71510 303523022      522923        syn-C2H3C(O)NH2, v=0
  413332.9208  0.0016 -3.5687 3  534.4834105  71510 303523023      522924        syn-C2H3C(O)NH2, v=0
  413398.1402  0.2181 -6.1789 3 2044.4583245  71510 303C22895      C22796        syn-C2H3C(O)NH2, v=0
  413489.7106  0.0012 -5.2025 3  442.4642111  71510 303551838      541837        syn-C2H3C(O)NH2, v=0
  413501.8106  0.0078 -4.1023 3  626.1040135  71510 303671750      661849        syn-C2H3C(O)NH2, v=0
  413526.4724  0.0748 -5.2426 3 1539.0781215  71510 303A72186      A72087        syn-C2H3C(O)NH2, v=0
  413527.4853  0.0841 -5.9702 3 1948.4322233  71510 303B63582      B63483        syn-C2H3C(O)NH2, v=0
  413530.3634  0.0748 -5.2426 3 1539.0781215  71510 303A72286      A72187        syn-C2H3C(O)NH2, v=0
  413551.7377  0.0012 -5.2024 3  442.4667111  71510 303551837      541836        syn-C2H3C(O)NH2, v=0
  413568.4126  0.0056 -4.1419 3  948.1552155  71510 303773146      773047        syn-C2H3C(O)NH2, v=0
  413568.4127  0.0056 -4.1419 3  948.1552155  71510 303773147      773048        syn-C2H3C(O)NH2, v=0
  413607.7893  0.0294 -4.6627 3 1202.0547193  71510 303961680      961581        syn-C2H3C(O)NH2, v=0
  413607.8044  0.0294 -4.6627 3 1202.0547193  71510 303961780      961681        syn-C2H3C(O)NH2, v=0
  413638.7087  0.0016 -3.5589 3  521.7526103  71510 303513021      512922        syn-C2H3C(O)NH2, v=0
  413638.7087  0.0016 -3.5589 3  521.7526103  71510 303513022      512923        syn-C2H3C(O)NH2, v=0
  413645.2270  0.0059 -5.5948 3  101.8157 59  71510 30329 624      29 327        syn-C2H3C(O)NH2, v=0
  413675.9234  0.0013 -5.4117 3  524.0739113  71510 303562531      552530        syn-C2H3C(O)NH2, v=0
  413675.9234  0.0013 -5.4117 3  524.0739113  71510 303562532      552531        syn-C2H3C(O)NH2, v=0
  413690.0857  0.0013 -3.3670 3  423.9561113  71510 303561244      551343        syn-C2H3C(O)NH2, v=0
  413719.9531  0.0173 -4.3951 3 1029.7825181  71510 303901377      901278        syn-C2H3C(O)NH2, v=0
  413719.9533  0.0173 -4.3951 3 1029.7825181  71510 303901477      901378        syn-C2H3C(O)NH2, v=0
  413752.4622  0.0111 -4.1799 3  537.7416143  71510 30371 269      71 170        syn-C2H3C(O)NH2, v=0
  413752.4622  0.0111 -4.1799 3  537.7416143  71510 30371 369      71 270        syn-C2H3C(O)NH2, v=0
  413804.0691  0.0028 -5.0980 3  126.8735 59  71510 303291217      29 920        syn-C2H3C(O)NH2, v=0
  413905.3618  0.1036 -5.8607 3 1522.8362207  71510 303A33073      A23172        syn-C2H3C(O)NH2, v=0
  413927.7550  0.0016 -3.5503 3  509.2714101  71510 303503020      502921        syn-C2H3C(O)NH2, v=0
  413927.7550  0.0016 -3.5503 3  509.2714101  71510 303503021      502922        syn-C2H3C(O)NH2, v=0
  413939.6508  0.0246 -4.5684 3 1143.4091189  71510 303941579      941480        syn-C2H3C(O)NH2, v=0
  413939.6547  0.0246 -4.5684 3 1143.4091189  71510 303941679      941580        syn-C2H3C(O)NH2, v=0
  413971.1062  0.0206 -4.4792 3 1085.9826185  71510 303921478      921379        syn-C2H3C(O)NH2, v=0
  413971.1071  0.0206 -4.4792 3 1085.9826185  71510 303921578      921479        syn-C2H3C(O)NH2, v=0
  413976.4890  0.0388 -5.3074 3 1187.3383185  71510 303922469      912566        syn-C2H3C(O)NH2, v=0
  414071.5734  0.0062 -4.4670 3  390.4700107  71510 303531439      531142        syn-C2H3C(O)NH2, v=0
  414095.4548  0.0308 -4.6398 3  878.4480159  71510 303792158      782257        syn-C2H3C(O)NH2, v=0
  414200.7535  0.0015 -3.5432 3  497.0395 99  71510 303493019      492920        syn-C2H3C(O)NH2, v=0
  414200.7535  0.0015 -3.5432 3  497.0395 99  71510 303493020      492921        syn-C2H3C(O)NH2, v=0
  414237.6116  0.0146 -4.6340 3 1232.8937181  71510 303903258      903159        syn-C2H3C(O)NH2, v=0
  414237.6631  0.0146 -4.6340 3 1232.8937181  71510 303903259      903160        syn-C2H3C(O)NH2, v=0
  414276.1558  0.0019 -3.5016 3  444.1816115  71510 303571344      561443        syn-C2H3C(O)NH2, v=0
  414325.9708  0.0394 -4.7726 3  948.1710165  71510 303822260      812359        syn-C2H3C(O)NH2, v=0
  414340.9197  0.0013 -5.3784 3  512.7954113  71510 303562432      552431        syn-C2H3C(O)NH2, v=0
  414340.9197  0.0013 -5.3784 3  512.7954113  71510 303562433      552432        syn-C2H3C(O)NH2, v=0
  414365.1510  0.0055 -5.9652 3   81.7099 51  71510 30325 817      25 322        syn-C2H3C(O)NH2, v=0
  414458.3751  0.0015 -3.5376 3  485.0567 97  71510 303483018      482919        syn-C2H3C(O)NH2, v=0
  414458.3751  0.0015 -3.5376 3  485.0567 97  71510 303483019      482920        syn-C2H3C(O)NH2, v=0
  414470.8750  0.0291 -5.0932 3 1484.9594201  71510 303A03367      A03268        syn-C2H3C(O)NH2, v=0
  414473.4908  0.0291 -5.0932 3 1484.9593201  71510 303A03368      A03269        syn-C2H3C(O)NH2, v=0
  414484.8920  0.0230 -4.5068 3  811.3811153  71510 303762056      752155        syn-C2H3C(O)NH2, v=0
  414508.4096  0.0053 -4.1093 3  929.0995153  71510 303763145      763046        syn-C2H3C(O)NH2, v=0
  414508.4096  0.0053 -4.1093 3  929.0995153  71510 303763146      763047        syn-C2H3C(O)NH2, v=0
  414701.2691  0.0016 -3.5336 3  473.3226 95  71510 303473017      472918        syn-C2H3C(O)NH2, v=0
  414701.2691  0.0016 -3.5336 3  473.3226 95  71510 303473018      472919        syn-C2H3C(O)NH2, v=0
  414746.6695  0.0030 -3.6534 3  479.3740119  71510 303591445      581544        syn-C2H3C(O)NH2, v=0
  414748.1339  0.0014 -5.1326 3  463.9577131  71510 30365 362      64 361        syn-C2H3C(O)NH2, v=0
  414748.1339  0.0014 -2.9801 3  463.9577131  71510 30365 362      64 461        syn-C2H3C(O)NH2, v=0
  414748.1339  0.0014 -2.9801 3  463.9577131  71510 30365 462      64 361        syn-C2H3C(O)NH2, v=0
  414748.1339  0.0014 -5.1326 3  463.9577131  71510 30365 462      64 461        syn-C2H3C(O)NH2, v=0
  414749.5836  0.0016 -5.1267 3  465.5130133  71510 30366 264      65 263        syn-C2H3C(O)NH2, v=0
  414749.5836  0.0016 -2.9563 3  465.5130133  71510 30366 264      65 363        syn-C2H3C(O)NH2, v=0
  414749.5836  0.0016 -2.9563 3  465.5130133  71510 30366 364      65 263        syn-C2H3C(O)NH2, v=0
  414749.5836  0.0016 -5.1267 3  465.5130133  71510 30366 364      65 363        syn-C2H3C(O)NH2, v=0
  414752.0313  0.0009 -3.0137 3  163.7727 67  71510 303331321      321220        syn-C2H3C(O)NH2, v=0
  414758.2606  0.0020 -5.1198 3  466.5521135  71510 30367 166      66 165        syn-C2H3C(O)NH2, v=0
  414758.2606  0.0020 -2.9331 3  466.5521135  71510 30367 166      66 265        syn-C2H3C(O)NH2, v=0
  414758.2606  0.0020 -2.9331 3  466.5521135  71510 30367 266      66 165        syn-C2H3C(O)NH2, v=0
  414758.2606  0.0020 -5.1198 3  466.5521135  71510 30367 266      66 265        syn-C2H3C(O)NH2, v=0
  414760.5010  0.0014 -5.1375 3  461.8777129  71510 30364 460      63 459        syn-C2H3C(O)NH2, v=0
  414760.5010  0.0014 -3.0049 3  461.8777129  71510 30364 460      63 559        syn-C2H3C(O)NH2, v=0
  414760.5010  0.0014 -3.0049 3  461.8777129  71510 30364 560      63 459        syn-C2H3C(O)NH2, v=0
  414760.5010  0.0014 -5.1375 3  461.8777129  71510 30364 560      63 559        syn-C2H3C(O)NH2, v=0
  414769.4538  0.0028 -5.1119 3  467.0823137  71510 30368 068      67 067        syn-C2H3C(O)NH2, v=0
  414769.4538  0.0028 -2.9104 3  467.0823137  71510 30368 068      67 167        syn-C2H3C(O)NH2, v=0
  414769.4538  0.0028 -2.9104 3  467.0823137  71510 30368 168      67 067        syn-C2H3C(O)NH2, v=0
  414769.4538  0.0028 -5.1119 3  467.0823137  71510 30368 168      67 167        syn-C2H3C(O)NH2, v=0
  414796.0756  0.0014 -5.1413 3  459.2621127  71510 30363 558      62 557        syn-C2H3C(O)NH2, v=0
  414796.0756  0.0014 -3.0310 3  459.2621127  71510 30363 558      62 657        syn-C2H3C(O)NH2, v=0
  414796.0756  0.0014 -3.0310 3  459.2621127  71510 30363 658      62 557        syn-C2H3C(O)NH2, v=0
  414796.0756  0.0014 -5.1413 3  459.2621127  71510 30363 658      62 657        syn-C2H3C(O)NH2, v=0
  414798.2963  0.0087 -4.0947 3  785.2804163  71510 30381 873      81 774        syn-C2H3C(O)NH2, v=0
  414798.2963  0.0087 -4.0947 3  785.2804163  71510 30381 973      81 874        syn-C2H3C(O)NH2, v=0
  414806.4412  0.0009 -3.0136 3  163.7711 67  71510 303331320      321221        syn-C2H3C(O)NH2, v=0
  414848.3023  0.0113 -4.2376 3  685.2110141  71510 303701852      691951        syn-C2H3C(O)NH2, v=0
  414868.5662  0.0014 -3.0589 3  456.0973125  71510 30362 656      61 755        syn-C2H3C(O)NH2, v=0
  414868.5663  0.0014 -5.1440 3  456.0973125  71510 30362 656      61 655        syn-C2H3C(O)NH2, v=0
  414868.5663  0.0014 -3.0589 3  456.0973125  71510 30362 756      61 655        syn-C2H3C(O)NH2, v=0
  414868.5663  0.0014 -5.1440 3  456.0973125  71510 30362 756      61 755        syn-C2H3C(O)NH2, v=0
  414930.0641  0.0016 -3.5314 3  461.8370 93  71510 303463016      462917        syn-C2H3C(O)NH2, v=0
  414930.0641  0.0016 -3.5314 3  461.8370 93  71510 303463017      462918        syn-C2H3C(O)NH2, v=0
  414951.6705  0.0164 -4.3727 3  746.9693147  71510 303731954      722053        syn-C2H3C(O)NH2, v=0
  414998.6256  0.0013 -3.0892 3  452.3654123  71510 30361 754      60 853        syn-C2H3C(O)NH2, v=0
  414998.6266  0.0013 -5.1454 3  452.3654123  71510 30361 854      60 853        syn-C2H3C(O)NH2, v=0
  414998.6275  0.0013 -5.1454 3  452.3654123  71510 30361 754      60 753        syn-C2H3C(O)NH2, v=0
  414998.6285  0.0013 -3.0892 3  452.3654123  71510 30361 854      60 753        syn-C2H3C(O)NH2, v=0
  415042.8958  0.1562 -5.8458 3 1868.7544235  71510 303B72592      B72493        syn-C2H3C(O)NH2, v=0
  415074.5304  0.0012 -2.7635 3  127.6463 43  71510 3032119 2      2018 3        syn-C2H3C(O)NH2, v=0
  415074.5304  0.0012 -2.7635 3  127.6463 43  71510 3032119 3      2018 2        syn-C2H3C(O)NH2, v=0
  415091.1748  0.1090 -5.5335 3 1700.2732225  71510 303B22389      B22290        syn-C2H3C(O)NH2, v=0
  415102.7901  0.0013 -5.3465 3  502.0271113  71510 303562334      552333        syn-C2H3C(O)NH2, v=0
  415102.7906  0.0013 -5.3465 3  502.0271113  71510 303562333      552332        syn-C2H3C(O)NH2, v=0
  415111.6937  0.1088 -5.5335 3 1700.2732225  71510 303B22489      B22390        syn-C2H3C(O)NH2, v=0
  415140.3761  0.1554 -5.8457 3 1868.7549235  71510 303B72692      B72593        syn-C2H3C(O)NH2, v=0
  415145.3689  0.0016 -3.5311 3  450.5997 91  71510 303453015      452916        syn-C2H3C(O)NH2, v=0
  415145.3689  0.0016 -3.5311 3  450.5997 91  71510 303453016      452917        syn-C2H3C(O)NH2, v=0
  415148.3047  0.0081 -4.0307 3  657.4414153  71510 30376 571      76 472        syn-C2H3C(O)NH2, v=0
  415148.3047  0.0081 -4.0307 3  657.4414153  71510 30376 671      76 572        syn-C2H3C(O)NH2, v=0
  415218.6777  0.0013 -3.1229 3  448.0426121  71510 30360 852      59 951        syn-C2H3C(O)NH2, v=0
  415218.7136  0.0013 -5.1455 3  448.0426121  71510 30360 952      59 951        syn-C2H3C(O)NH2, v=0
  415218.7454  0.0013 -5.1455 3  448.0426121  71510 30360 852      59 851        syn-C2H3C(O)NH2, v=0
  415218.7813  0.0013 -3.1229 3  448.0426121  71510 30360 952      59 851        syn-C2H3C(O)NH2, v=0
  415347.7730  0.0016 -3.5329 3  439.6104 89  71510 303443014      442915        syn-C2H3C(O)NH2, v=0
  415347.7730  0.0016 -3.5329 3  439.6104 89  71510 303443015      442916        syn-C2H3C(O)NH2, v=0
  415407.2043  0.0049 -4.0776 3  910.3022151  71510 303753144      753045        syn-C2H3C(O)NH2, v=0
  415407.2043  0.0049 -4.0776 3  910.3022151  71510 303753145      753046        syn-C2H3C(O)NH2, v=0
  415444.6742  0.0056 -5.3199 3  120.5514 63  71510 30331 725      31 428        syn-C2H3C(O)NH2, v=0
  415460.2309  0.0497 -5.5097 3 1708.2305217  71510 303A83474      A83375        syn-C2H3C(O)NH2, v=0
  415489.0408  0.0496 -5.5097 3 1708.2294217  71510 303A83475      A83376        syn-C2H3C(O)NH2, v=0
  415493.3029  0.0200 -2.7929 3  129.8744 47 -71510 3032318 5      2217 6        syn-C2H3C(O)NH2, v=0
  415493.3029  0.0200 -2.7929 3  129.8744 47 -71510 3032318 6      2217 5        syn-C2H3C(O)NH2, v=0
  415537.8479  0.0017 -3.5370 3  428.8688 87  71510 303433013      432914        syn-C2H3C(O)NH2, v=0
  415537.8479  0.0017 -3.5370 3  428.8688 87  71510 303433014      432915        syn-C2H3C(O)NH2, v=0
  415550.6554  0.0485 -4.9061 3 1020.5505171  71510 303852362      842461        syn-C2H3C(O)NH2, v=0
  415581.6390  0.0012 -3.1616 3  443.0961119  71510 30359 950      581049        syn-C2H3C(O)NH2, v=0
  415582.6565  0.0012 -5.1439 3  443.0961119  71510 303591050      581049        syn-C2H3C(O)NH2, v=0
  415583.4919  0.0012 -5.1439 3  443.0960119  71510 30359 950      58 949        syn-C2H3C(O)NH2, v=0
  415584.5094  0.0012 -3.1616 3  443.0960119  71510 303591050      58 949        syn-C2H3C(O)NH2, v=0
  415585.1837  0.0013 -5.1101 3  409.8648111  71510 303551243      541242        syn-C2H3C(O)NH2, v=0
  415612.4413  0.0012 -5.1770 3  435.0084111  71510 303551739      541738        syn-C2H3C(O)NH2, v=0
  415616.8102  0.0632 -5.1247 3 1473.8402211  71510 303A52085      A51986        syn-C2H3C(O)NH2, v=0
  415618.0523  0.0631 -5.1247 3 1473.8402211  71510 303A52185      A52086        syn-C2H3C(O)NH2, v=0
  415636.1974  0.0049 -3.8584 3  115.6135 61  71510 30330 723      29 624        syn-C2H3C(O)NH2, v=0
  415716.1473  0.0018 -3.5436 3  418.3747 85  71510 303423012      422913        syn-C2H3C(O)NH2, v=0
  415716.1473  0.0018 -3.5436 3  418.3747 85  71510 303423013      422914        syn-C2H3C(O)NH2, v=0
  415723.8748  0.0137 -4.5920 3 1210.4788179  71510 303893257      893158        syn-C2H3C(O)NH2, v=0
  415723.9014  0.0137 -4.5920 3 1210.4788179  71510 303893258      893159        syn-C2H3C(O)NH2, v=0
  415755.9539  0.0899 -5.7341 3 1459.3159203  71510 303A12973      A03070        syn-C2H3C(O)NH2, v=0
  415867.7318  0.0200 -2.8246 3  133.5829 51 -71510 3032517 8      2416 9        syn-C2H3C(O)NH2, v=0
  415867.7318  0.0200 -2.8246 3  133.5829 51 -71510 3032517 9      2416 8        syn-C2H3C(O)NH2, v=0
  415869.3882  0.0011 -3.1214 3  184.3820 73  71510 303361225      351124        syn-C2H3C(O)NH2, v=0
  415883.1774  0.0200 -3.5533 3  408.1279 83 -71510 303413011      412912        syn-C2H3C(O)NH2, v=0
  415883.1774  0.0200 -3.5533 3  408.1279 83 -71510 303413012      412913        syn-C2H3C(O)NH2, v=0
  415908.9047  0.0009 -2.9505 3  153.8253 63  71510 303311418      301317        syn-C2H3C(O)NH2, v=0
  415909.5952  0.0009 -2.9505 3  153.8253 63  71510 303311417      301318        syn-C2H3C(O)NH2, v=0
  415915.9884  0.1306 -5.7978 3 1367.8656199  71510 303992575      982672        syn-C2H3C(O)NH2, v=0
  415985.4539  0.0013 -5.3159 3  491.7776113  71510 303562235      552234        syn-C2H3C(O)NH2, v=0
  415985.4614  0.0013 -5.3159 3  491.7776113  71510 303562234      552233        syn-C2H3C(O)NH2, v=0
  415996.6519  0.0042 -6.1616 3  784.5436115  71510 303574116      564115        syn-C2H3C(O)NH2, v=0
  415996.6519  0.0042 -6.1616 3  784.5436115  71510 303574117      564116        syn-C2H3C(O)NH2, v=0
  416039.5509  0.0200 -3.5663 3  398.1281 81 -71510 303403010      402911        syn-C2H3C(O)NH2, v=0
  416039.5509  0.0200 -3.5663 3  398.1281 81 -71510 303403011      402912        syn-C2H3C(O)NH2, v=0
  416080.0571  0.0013 -5.1760 3  435.0296111  71510 303551738      541737        syn-C2H3C(O)NH2, v=0
  416118.9865  0.0052 -5.1060 3  140.5539 67  71510 30333 826      33 529        syn-C2H3C(O)NH2, v=0
  416144.7119  0.0200 -2.8601 3  138.7897 55 -71510 303271611      261512        syn-C2H3C(O)NH2, v=0
  416144.7119  0.0200 -2.8601 3  138.7897 55 -71510 303271612      261511        syn-C2H3C(O)NH2, v=0
  416159.9583  0.0012 -3.2079 3  437.4780117  71510 303581048      571147        syn-C2H3C(O)NH2, v=0
  416178.0302  0.0037 -6.0998 3  765.5339115  71510 303574017      564016        syn-C2H3C(O)NH2, v=0
  416178.0302  0.0037 -6.0998 3  765.5339115  71510 303574018      564017        syn-C2H3C(O)NH2, v=0
  416182.3021  0.0012 -5.1404 3  437.4780117  71510 303581148      571147        syn-C2H3C(O)NH2, v=0
  416185.6859  0.0200 -3.5832 3  388.3751 79 -71510 3033930 9      392910        syn-C2H3C(O)NH2, v=0
  416185.6859  0.0200 -3.5832 3  388.3751 79 -71510 303393010      392911        syn-C2H3C(O)NH2, v=0
  416199.0425  0.0012 -5.1403 3  437.4767117  71510 303581048      571047        syn-C2H3C(O)NH2, v=0
  416221.3913  0.0200 -3.2078 3  437.4767117 -71510 303581148      571047        syn-C2H3C(O)NH2, v=0
  416224.0152  0.0200 -2.9011 3  145.5226 59 -71510 303291515      281414        syn-C2H3C(O)NH2, v=0
  416224.0152  0.0200 -2.9011 3  145.5226 59 -71510 303291514      281415        syn-C2H3C(O)NH2, v=0
  416266.5220  0.0046 -4.0467 3  891.7628149  71510 303743143      743044        syn-C2H3C(O)NH2, v=0
  416266.5220  0.0046 -4.0467 3  891.7628149  71510 303743144      743045        syn-C2H3C(O)NH2, v=0
  416287.3911  0.0099 -4.1460 3  835.8515167  71510 30383 974      83 875        syn-C2H3C(O)NH2, v=0
  416287.3911  0.0099 -4.1460 3  835.8515167  71510 303831074      83 975        syn-C2H3C(O)NH2, v=0
  416302.0037  0.0023 -5.0208 3  134.2277 61  71510 303301219      30 922        syn-C2H3C(O)NH2, v=0
  416312.8682  0.0785 -5.4514 3 1312.3260193  71510 303962769      952868        syn-C2H3C(O)NH2, v=0
  416322.0769  0.0200 -3.6049 3  378.8687 77 -71510 3033830 8      3829 9        syn-C2H3C(O)NH2, v=0
  416322.0769  0.0200 -3.6049 3  378.8687 77 -71510 3033830 9      382910        syn-C2H3C(O)NH2, v=0
  416369.3299  0.0033 -6.0405 3  746.9982115  71510 303573918      563917        syn-C2H3C(O)NH2, v=0
  416369.3299  0.0033 -6.0405 3  746.9982115  71510 303573919      563918        syn-C2H3C(O)NH2, v=0
  416408.7909  0.0101 -4.0911 3  581.8312147  71510 30373 370      73 271        syn-C2H3C(O)NH2, v=0
  416408.7909  0.0101 -4.0911 3  581.8312147  71510 30373 470      73 371        syn-C2H3C(O)NH2, v=0
  416409.5914  0.0019 -5.0056 3   52.7859 41  71510 30320 812      19 515        syn-C2H3C(O)NH2, v=0
  416449.2388  0.0200 -3.6322 3  369.6087 75 -71510 3033730 7      3729 8        syn-C2H3C(O)NH2, v=0
  416449.2388  0.0200 -3.6322 3  369.6087 75 -71510 3033730 8      3729 9        syn-C2H3C(O)NH2, v=0
  416516.8903  0.0272 -5.0440 3 1459.9282199  71510 303993366      993267        syn-C2H3C(O)NH2, v=0
  416518.3396  0.0272 -5.0440 3 1459.9281199  71510 303993367      993268        syn-C2H3C(O)NH2, v=0
  416567.5888  0.0200 -3.6667 3  360.5948 73 -71510 3033630 6      3629 7        syn-C2H3C(O)NH2, v=0
  416567.5888  0.0200 -3.6667 3  360.5948 73 -71510 3033630 7      3629 8        syn-C2H3C(O)NH2, v=0
  416571.7575  0.0029 -5.9835 3  728.9371115  71510 303573819      563818        syn-C2H3C(O)NH2, v=0
  416571.7575  0.0029 -5.9835 3  728.9371115  71510 303573820      563819        syn-C2H3C(O)NH2, v=0
  416577.7715  0.0047 -3.7241 3  134.4091 65  71510 30332 824      31 725        syn-C2H3C(O)NH2, v=0
  416590.6374  0.0040 -5.0496 3   58.0963 49  71510 30324 222      23 123        syn-C2H3C(O)NH2, v=0
  416598.9253  0.0040 -5.0495 3   58.0963 49  71510 30324 322      23 023        syn-C2H3C(O)NH2, v=0
  416629.0744  0.0792 -5.9094 3 1919.1671231  71510 303B53580      B53481        syn-C2H3C(O)NH2, v=0
  416674.4152  0.0047 -4.9353 3  161.8079 71  71510 30335 927      35 630        syn-C2H3C(O)NH2, v=0
  416677.6121  0.0200 -3.7104 3  351.8269 71 -71510 3033530 5      3529 6        syn-C2H3C(O)NH2, v=0
  416677.6121  0.0200 -3.7104 3  351.8269 71 -71510 3033530 6      3529 7        syn-C2H3C(O)NH2, v=0
  416757.4009  0.0200 -3.2682 3  431.1190115 -71510 303571146      561245        syn-C2H3C(O)NH2, v=0
  416779.6824  0.0200 -3.7667 3  343.3049 69 -71510 3033430 4      3429 5        syn-C2H3C(O)NH2, v=0
  416779.6824  0.0200 -3.7667 3  343.3049 69 -71510 3033430 5      3429 6        syn-C2H3C(O)NH2, v=0
  416784.2344  0.0781 -5.9091 3 1919.1610231  71510 303B53581      B53482        syn-C2H3C(O)NH2, v=0
  416786.6936  0.0026 -5.9287 3  711.3514115  71510 303573720      563719        syn-C2H3C(O)NH2, v=0
  416786.6936  0.0026 -5.9287 3  711.3514115  71510 303573721      563720        syn-C2H3C(O)NH2, v=0
  416874.2946  0.0200 -3.8409 3  335.0284 67 -71510 3033330 3      3329 4        syn-C2H3C(O)NH2, v=0
  416874.2946  0.0200 -3.8409 3  335.0284 67 -71510 3033330 4      3329 5        syn-C2H3C(O)NH2, v=0
  416935.7504  0.0200 -3.3290 3  254.9887 87 -71510 303431232      421131        syn-C2H3C(O)NH2, v=0
  416945.5642  0.0061 -4.9714 3  170.2086 73  71510 30336 828      36 531        syn-C2H3C(O)NH2, v=0
  416954.8528  0.0133 -4.4139 3  509.1926141  71510 30370 169      70 070        syn-C2H3C(O)NH2, v=0
  416954.8528  0.0133 -4.4139 3  509.1926141  71510 30370 269      70 170        syn-C2H3C(O)NH2, v=0
  416961.7853  0.0200 -3.9434 3  326.9973 65 -71510 3033230 2      3229 3        syn-C2H3C(O)NH2, v=0
  416961.7853  0.0200 -3.9434 3  326.9973 65 -71510 3033230 3      3229 4        syn-C2H3C(O)NH2, v=0
  417015.7245  0.0024 -5.8761 3  694.2419115  71510 303573621      563620        syn-C2H3C(O)NH2, v=0
  417015.7245  0.0024 -5.8761 3  694.2419115  71510 303573622      563621        syn-C2H3C(O)NH2, v=0
  417022.0545  0.0013 -5.2866 3  482.0577113  71510 303562136      552135        syn-C2H3C(O)NH2, v=0
  417022.1572  0.0013 -5.2866 3  482.0577113  71510 303562135      552134        syn-C2H3C(O)NH2, v=0
  417042.5880  0.0200 -4.0972 3  319.2114 63 -71510 3033130 1      3129 2        syn-C2H3C(O)NH2, v=0
  417042.5880  0.0200 -4.0972 3  319.2114 63 -71510 3033130 2      3129 3        syn-C2H3C(O)NH2, v=0
  417068.3623  0.0015 -5.0820 3  390.3700107  71510 303531439      521438        syn-C2H3C(O)NH2, v=0
  417087.9946  0.0043 -4.0165 3  873.4808147  71510 303733142      733043        syn-C2H3C(O)NH2, v=0
  417087.9946  0.0043 -4.0165 3  873.4808147  71510 303733143      733044        syn-C2H3C(O)NH2, v=0
  417100.1166  0.0012 -5.1221 3  416.1321111  71510 303551442      541441        syn-C2H3C(O)NH2, v=0
  417117.0424  0.0029 -4.3761 3  311.6706 61  71510 3033030 0      3029 1        syn-C2H3C(O)NH2, v=0
  417117.0424  0.0029 -4.3761 3  311.6706 61  71510 3033030 1      3029 2        syn-C2H3C(O)NH2, v=0
  417127.9915  0.0026 -4.6352 3  213.0145 79  71510 303391228      39 931        syn-C2H3C(O)NH2, v=0
  417129.2286  0.0012 -5.1345 3  431.1190115  71510 303571246      561245        syn-C2H3C(O)NH2, v=0
  417145.6941  0.0128 -4.5507 3 1188.3284177  71510 303883256      883157        syn-C2H3C(O)NH2, v=0
  417145.7076  0.0128 -4.5507 3 1188.3284177  71510 303883257      883158        syn-C2H3C(O)NH2, v=0
  417251.3371  0.0013 -5.0708 3  386.6612107  71510 303531340      521339        syn-C2H3C(O)NH2, v=0
  417256.0222  0.0082 -4.0463 3  704.7989157  71510 30378 672      78 573        syn-C2H3C(O)NH2, v=0
  417256.0222  0.0082 -4.0463 3  704.7989157  71510 30378 772      78 673        syn-C2H3C(O)NH2, v=0
  417260.6816  0.0022 -5.8254 3  677.6097115  71510 303573522      563521        syn-C2H3C(O)NH2, v=0
  417260.6816  0.0022 -5.8254 3  677.6097115  71510 303573523      563522        syn-C2H3C(O)NH2, v=0
  417274.0500  0.2312 -6.1354 3 1507.3869209  71510 303A42679      A32776        syn-C2H3C(O)NH2, v=0
  417278.0965  0.0532 -5.0111 3 1409.7819207  71510 303A31984      A31885        syn-C2H3C(O)NH2, v=0
  417278.4768  0.0532 -5.0111 3 1409.7819207  71510 303A32084      A31985        syn-C2H3C(O)NH2, v=0
  417297.5474  0.0040 -3.5728 3  154.4342 69  71510 30334 925      33 826        syn-C2H3C(O)NH2, v=0
  417375.8614  0.0012 -5.1339 3  431.0984115  71510 303571146      561145        syn-C2H3C(O)NH2, v=0
  417523.6903  0.0020 -5.7767 3  661.4557115  71510 303573423      563422        syn-C2H3C(O)NH2, v=0
  417523.6903  0.0020 -5.7767 3  661.4557115  71510 303573424      563423        syn-C2H3C(O)NH2, v=0
  417559.0686  0.0115 -4.2057 3  887.6828171  71510 303851075      85 976        syn-C2H3C(O)NH2, v=0
  417559.0686  0.0115 -4.2057 3  887.6828171  71510 303851175      851076        syn-C2H3C(O)NH2, v=0
  417747.6871  0.0200 -3.2660 3  431.0984115 -71510 303571246      561145        syn-C2H3C(O)NH2, v=0
  417799.3723  0.0060 -4.4391 3  437.7553113  71510 303561541      561244        syn-C2H3C(O)NH2, v=0
  417807.2310  0.0018 -5.7298 3  645.7811115  71510 303573324      563323        syn-C2H3C(O)NH2, v=0
  417807.2310  0.0018 -5.7298 3  645.7811115  71510 303573325      563324        syn-C2H3C(O)NH2, v=0
  417833.0962  0.0013 -5.1530 3  428.1994111  71510 303551640      541639        syn-C2H3C(O)NH2, v=0
  417873.1680  0.0041 -3.9871 3  855.4557145  71510 303723141      723042        syn-C2H3C(O)NH2, v=0
  417873.1680  0.0041 -3.9871 3  855.4557145  71510 303723142      723043        syn-C2H3C(O)NH2, v=0
  417925.9104  0.0965 -5.7293 3 1459.3097203  71510 303A12972      A03071        syn-C2H3C(O)NH2, v=0
  417952.2952  0.0581 -5.0416 3 1095.5861177  71510 303882464      872563        syn-C2H3C(O)NH2, v=0
  418011.3359  0.0925 -5.4061 3 1632.0845221  71510 303B02288      B02189        syn-C2H3C(O)NH2, v=0
  418018.3330  0.0925 -5.4061 3 1632.0845221  71510 303B02388      B02289        syn-C2H3C(O)NH2, v=0
  418048.7805  0.0463 -5.4546 3 1681.0923215  71510 303A73473      A73374        syn-C2H3C(O)NH2, v=0
  418065.5121  0.0462 -5.4546 3 1681.0916215  71510 303A73474      A73375        syn-C2H3C(O)NH2, v=0
  418114.2161  0.0017 -5.6846 3  630.5874115  71510 303573225      563224        syn-C2H3C(O)NH2, v=0
  418114.2161  0.0017 -5.6846 3  630.5874115  71510 303573226      563225        syn-C2H3C(O)NH2, v=0
  418129.5173  0.0012 -5.1266 3  423.9561113  71510 303561344      551343        syn-C2H3C(O)NH2, v=0
  418185.9770  0.1892 -6.0332 3 1970.4703241  71510 303C02694      C02595        syn-C2H3C(O)NH2, v=0
  418211.1711  0.0022 -6.0304 3   30.7922 29  71510 30314 9 6      13 6 7        syn-C2H3C(O)NH2, v=0
  418260.2469  0.0012 -5.2583 3  472.8825113  71510 303562037      552036        syn-C2H3C(O)NH2, v=0
  418261.4769  0.0012 -5.2583 3  472.8826113  71510 303562036      552035        syn-C2H3C(O)NH2, v=0
  418282.4414  0.0038 -4.6434 3  254.9887 85  71510 303421428      421131        syn-C2H3C(O)NH2, v=0
  418324.5205  0.0022 -6.0303 3   30.7884 29  71510 30314 9 5      13 6 8        syn-C2H3C(O)NH2, v=0
  418327.6383  0.0035 -4.8075 3  189.7845 73  71510 303361323      361026        syn-C2H3C(O)NH2, v=0
  418347.8765  0.1875 -6.0328 3 1970.4712241  71510 303C02794      C02695        syn-C2H3C(O)NH2, v=0
  418448.0889  0.0016 -5.6412 3  615.8762115  71510 303573126      563125        syn-C2H3C(O)NH2, v=0
  418448.0889  0.0016 -5.6412 3  615.8762115  71510 303573127      563126        syn-C2H3C(O)NH2, v=0
  418470.0741  0.0255 -4.9955 3 1435.1675197  71510 303983365      983266        syn-C2H3C(O)NH2, v=0
  418470.8691  0.0255 -4.9955 3 1435.1675197  71510 303983366      983267        syn-C2H3C(O)NH2, v=0
  418506.2531  0.0119 -4.5103 3 1166.4420175  71510 303873255      873156        syn-C2H3C(O)NH2, v=0
  418506.2599  0.0119 -4.5103 3 1166.4419175  71510 303873256      873157        syn-C2H3C(O)NH2, v=0
  418548.2581  0.0447 -4.9019 3 1346.9121203  71510 303A11883      A11784        syn-C2H3C(O)NH2, v=0
  418548.3698  0.0447 -4.9019 3 1346.9121203  71510 303A11983      A11884        syn-C2H3C(O)NH2, v=0
  418578.4692  0.0794 -5.6100 3 1397.2513199  71510 303992872      982969        syn-C2H3C(O)NH2, v=0
  418584.8593  0.0015 -5.1147 3  408.7799109  71510 303541539      531538        syn-C2H3C(O)NH2, v=0
  418599.8423  0.0041 -4.7998 3  184.2974 75  71510 303371028      37 731        syn-C2H3C(O)NH2, v=0
  418604.4097  0.0135 -4.2727 3  940.7680175  71510 303871176      871077        syn-C2H3C(O)NH2, v=0
  418604.4097  0.0135 -4.2727 3  940.7680175  71510 303871276      871177        syn-C2H3C(O)NH2, v=0
  418623.5097  0.0038 -3.9585 3  837.6870143  71510 303713140      713041        syn-C2H3C(O)NH2, v=0
  418623.5097  0.0038 -3.9585 3  837.6870143  71510 303713141      713042        syn-C2H3C(O)NH2, v=0
  418812.9517  0.0016 -5.5994 3  601.6493115  71510 303573027      563026        syn-C2H3C(O)NH2, v=0
  418812.9517  0.0016 -5.5994 3  601.6493115  71510 303573028      563027        syn-C2H3C(O)NH2, v=0
  418890.2965  0.0094 -4.0563 3  627.2173151  71510 30375 471      75 372        syn-C2H3C(O)NH2, v=0
  418890.2965  0.0094 -4.0563 3  627.2173151  71510 30375 571      75 472        syn-C2H3C(O)NH2, v=0
  418923.4789  0.0012 -5.1335 3  421.9889111  71510 303551541      541540        syn-C2H3C(O)NH2, v=0
  418960.5894  0.1331 -5.7090 3 1797.6484231  71510 303B52491      B52392        syn-C2H3C(O)NH2, v=0
  418995.9991  0.1328 -5.7089 3 1797.6486231  71510 303B52591      B52492        syn-C2H3C(O)NH2, v=0
  419171.1290  0.0087 -4.0771 3  753.4353161  71510 30380 773      80 674        syn-C2H3C(O)NH2, v=0
  419171.1290  0.0087 -4.0771 3  753.4353161  71510 30380 873      80 774        syn-C2H3C(O)NH2, v=0
  419213.7330  0.0015 -5.5592 3  587.9088115  71510 303572928      562927        syn-C2H3C(O)NH2, v=0
  419213.7330  0.0015 -5.5592 3  587.9088115  71510 303572929      562928        syn-C2H3C(O)NH2, v=0
  419340.4139  0.0036 -3.9307 3  820.1743141  71510 303703139      703040        syn-C2H3C(O)NH2, v=0
  419340.4139  0.0036 -3.9307 3  820.1743141  71510 303703140      703041        syn-C2H3C(O)NH2, v=0
  419409.6552  0.0026 -5.1698 3  119.5077 57  71510 303281216      28 919        syn-C2H3C(O)NH2, v=0
  419413.3964  0.0159 -4.3463 3  995.1006179  71510 303891277      891178        syn-C2H3C(O)NH2, v=0
  419413.3965  0.0159 -4.3463 3  995.1006179  71510 303891377      891278        syn-C2H3C(O)NH2, v=0
  419458.6303  0.0376 -4.7971 3 1285.2394199  71510 303991782      991683        syn-C2H3C(O)NH2, v=0
  419458.6616  0.0376 -4.7971 3 1285.2394199  71510 303991882      991783        syn-C2H3C(O)NH2, v=0
  419561.4313  0.0023 -5.0907 3  126.6813 59  71510 303291218      29 921        syn-C2H3C(O)NH2, v=0
  419573.6364  0.1321 -6.1582 3 1681.0923217  71510 303A83277      A73374        syn-C2H3C(O)NH2, v=0
  419613.6851  0.0200 -3.1154 3  184.2799 73 -71510 303361224      351125        syn-C2H3C(O)NH2, v=0
  419650.8394  0.0431 -5.2968 3 1219.9558187  71510 303932569      922666        syn-C2H3C(O)NH2, v=0
  419656.4127  0.0015 -5.5205 3  574.6575115  71510 303572829      562828        syn-C2H3C(O)NH2, v=0
  419656.4127  0.0015 -5.5205 3  574.6575115  71510 303572830      562829        syn-C2H3C(O)NH2, v=0
  419769.6804  0.0012 -5.2312 3  464.2726113  71510 303561938      551937        syn-C2H3C(O)NH2, v=0
  419781.5040  0.0120 -4.1985 3  552.5839145  71510 30372 270      72 171        syn-C2H3C(O)NH2, v=0
  419781.5040  0.0120 -4.1985 3  552.5839145  71510 30372 370      72 271        syn-C2H3C(O)NH2, v=0
  419782.3480  0.0012 -5.2311 3  464.2730113  71510 303561937      551936        syn-C2H3C(O)NH2, v=0
  419789.2431  0.0732 -5.8491 3 1890.1760229  71510 303B43579      B43480        syn-C2H3C(O)NH2, v=0
  419808.5034  0.0112 -4.4706 3 1144.8187173  71510 303863254      863155        syn-C2H3C(O)NH2, v=0
  419808.5068  0.0112 -4.4706 3 1144.8187173  71510 303863255      863156        syn-C2H3C(O)NH2, v=0
  419830.4689  0.1334 -6.1576 3 1681.0916217  71510 303A83276      A73375        syn-C2H3C(O)NH2, v=0
  419838.7531  0.0038 -5.7369 3   91.6421 53  71510 30326 917      26 422        syn-C2H3C(O)NH2, v=0
  419882.6307  0.0725 -5.8489 3 1890.1724229  71510 303B43580      B43481        syn-C2H3C(O)NH2, v=0
  419915.2768  0.0020 -3.9387 3  101.7066 57  71510 30328 821      27 522        syn-C2H3C(O)NH2, v=0
  419974.7306  0.0188 -4.4259 3 1050.6741183  71510 303911378      911279        syn-C2H3C(O)NH2, v=0
  419974.7307  0.0188 -4.4259 3 1050.6741183  71510 303911478      911379        syn-C2H3C(O)NH2, v=0
  420025.2077  0.0034 -3.9037 3  802.9171139  71510 303693138      693039        syn-C2H3C(O)NH2, v=0
  420025.2077  0.0034 -3.9037 3  802.9171139  71510 303693139      693040        syn-C2H3C(O)NH2, v=0
  420035.5542  0.0315 -4.6969 3 1224.7717195  71510 303971681      971582        syn-C2H3C(O)NH2, v=0
  420035.5626  0.0315 -4.6969 3 1224.7717195  71510 303971781      971682        syn-C2H3C(O)NH2, v=0
  420148.3272  0.0014 -5.4834 3  561.8984115  71510 303572730      562729        syn-C2H3C(O)NH2, v=0
  420148.3272  0.0014 -5.4834 3  561.8984115  71510 303572731      562730        syn-C2H3C(O)NH2, v=0
  420275.6105  0.0223 -4.5111 3 1107.4818187  71510 303931479      931380        syn-C2H3C(O)NH2, v=0
  420275.6111  0.0223 -4.5111 3 1107.4818187  71510 303931579      931480        syn-C2H3C(O)NH2, v=0
  420301.4547  0.0265 -4.6015 3 1165.5167191  71510 303951580      951481        syn-C2H3C(O)NH2, v=0
  420301.4568  0.0265 -4.6015 3 1165.5167191  71510 303951680      951581        syn-C2H3C(O)NH2, v=0
  420313.2678  0.0200 -3.1411 3  193.5227 75 -71510 303371226      361125        syn-C2H3C(O)NH2, v=0
  420336.0148  0.0238 -4.9479 3 1410.6764195  71510 303973364      973265        syn-C2H3C(O)NH2, v=0
  420336.4465  0.0238 -4.9479 3 1410.6764195  71510 303973365      973266        syn-C2H3C(O)NH2, v=0
  420425.1365  0.0785 -5.2829 3 1565.0582217  71510 303A82187      A82088        syn-C2H3C(O)NH2, v=0
  420427.4302  0.0785 -5.2829 3 1565.0582217  71510 303A82287      A82188        syn-C2H3C(O)NH2, v=0
  420440.6984  0.0040 -4.1232 3   87.6822 55  71510 30327 522      26 423        syn-C2H3C(O)NH2, v=0
  420481.9220  0.0039 -4.5923 3   67.6842 51  71510 30325 322      24 223        syn-C2H3C(O)NH2, v=0
  420510.5053  0.0432 -5.4004 3 1654.2301213  71510 303A63472      A63373        syn-C2H3C(O)NH2, v=0
  420520.1278  0.0431 -5.4004 3 1654.2298213  71510 303A63473      A63374        syn-C2H3C(O)NH2, v=0
  420538.4234  0.0014 -5.1477 3  428.3469111  71510 303551639      541638        syn-C2H3C(O)NH2, v=0
  420552.3624  0.0013 -5.1209 3  423.7272113  71510 303561244      551243        syn-C2H3C(O)NH2, v=0
  420570.9974  0.0039 -4.5922 3   67.6842 51  71510 30325 422      24 123        syn-C2H3C(O)NH2, v=0
  420615.9259  0.0066 -6.0698 3   39.7839 39  71510 30319 514      18 217        syn-C2H3C(O)NH2, v=0
  420679.1561  0.0033 -3.8775 3  785.9151137  71510 303683137      683038        syn-C2H3C(O)NH2, v=0
  420679.1561  0.0033 -3.8775 3  785.9151137  71510 303683138      683039        syn-C2H3C(O)NH2, v=0
  420698.5939  0.0014 -5.4476 3  549.6352115  71510 303572631      562630        syn-C2H3C(O)NH2, v=0
  420698.5939  0.0014 -5.4476 3  549.6352115  71510 303572632      562631        syn-C2H3C(O)NH2, v=0
  420789.1101  0.0015 -3.2569 3  188.9318 75  71510 303371126      361027        syn-C2H3C(O)NH2, v=0
  420789.2404  0.0015 -5.1423 3  477.7922133  71510 30366 363      65 362        syn-C2H3C(O)NH2, v=0
  420789.2404  0.0015 -2.9889 3  477.7922133  71510 30366 363      65 462        syn-C2H3C(O)NH2, v=0
  420789.2404  0.0015 -2.9889 3  477.7922133  71510 30366 463      65 362        syn-C2H3C(O)NH2, v=0
  420789.2404  0.0015 -5.1423 3  477.7922133  71510 30366 463      65 462        syn-C2H3C(O)NH2, v=0
  420791.3000  0.0017 -5.1365 3  479.3475135  71510 30367 265      66 264        syn-C2H3C(O)NH2, v=0
  420791.2997  0.0200 -2.9655 3  479.3475135 -71510 30367 265      66 364        syn-C2H3C(O)NH2, v=0
  420791.2997  0.0200 -2.9655 3  479.3475135 -71510 30367 365      66 264        syn-C2H3C(O)NH2, v=0
  420791.3000  0.0017 -5.1365 3  479.3475135  71510 30367 365      66 364        syn-C2H3C(O)NH2, v=0
  420800.2225  0.0021 -5.1297 3  480.3870137  71510 30368 167      67 166        syn-C2H3C(O)NH2, v=0
  420800.2905  0.0200 -2.9427 3  480.3870137 -71510 30368 167      67 266        syn-C2H3C(O)NH2, v=0
  420800.2905  0.0200 -2.9427 3  480.3870137 -71510 30368 267      67 166        syn-C2H3C(O)NH2, v=0
  420800.2225  0.0021 -5.1297 3  480.3870137  71510 30368 267      67 266        syn-C2H3C(O)NH2, v=0
  420800.3510  0.0015 -5.1471 3  475.7126131  71510 30365 461      64 460        syn-C2H3C(O)NH2, v=0
  420800.2905  0.0200 -3.0131 3  475.7126131 -71510 30365 461      64 560        syn-C2H3C(O)NH2, v=0
  420800.2905  0.0200 -3.0131 3  475.7126131 -71510 30365 561      64 460        syn-C2H3C(O)NH2, v=0
  420800.3510  0.0015 -5.1471 3  475.7126131  71510 30365 561      64 560        syn-C2H3C(O)NH2, v=0
  420811.4722  0.0030 -5.1220 3  480.9175139  71510 30369 069      68 068        syn-C2H3C(O)NH2, v=0
  420811.4466  0.0200 -2.9204 3  480.9175139 -71510 30369 069      68 168        syn-C2H3C(O)NH2, v=0
  420811.4466  0.0200 -2.9204 3  480.9175139 -71510 30369 169      68 068        syn-C2H3C(O)NH2, v=0
  420811.4722  0.0030 -5.1220 3  480.9175139  71510 30369 169      68 168        syn-C2H3C(O)NH2, v=0
  420833.5613  0.0015 -5.1507 3  473.0983129  71510 30364 559      63 558        syn-C2H3C(O)NH2, v=0
  420833.5722  0.0200 -3.0386 3  473.0983129 -71510 30364 559      63 658        syn-C2H3C(O)NH2, v=0
  420833.5722  0.0200 -3.0386 3  473.0983129 -71510 30364 659      63 558        syn-C2H3C(O)NH2, v=0
  420833.5613  0.0015 -5.1507 3  473.0983129  71510 30364 659      63 658        syn-C2H3C(O)NH2, v=0
  420887.4572  0.0096 -4.1199 3  803.3443165  71510 30382 874      82 775        syn-C2H3C(O)NH2, v=0
  420887.4572  0.0096 -4.1199 3  803.3443165  71510 30382 974      82 875        syn-C2H3C(O)NH2, v=0
  420901.7968  0.0200 -3.0657 3  469.9358127 -71510 30363 657      62 756        syn-C2H3C(O)NH2, v=0
  420901.8080  0.0015 -5.1533 3  469.9358127  71510 30363 657      62 656        syn-C2H3C(O)NH2, v=0
  420901.7968  0.0200 -3.0657 3  469.9358127 -71510 30363 757      62 656        syn-C2H3C(O)NH2, v=0
  420901.8080  0.0015 -5.1533 3  469.9358127  71510 30363 757      62 756        syn-C2H3C(O)NH2, v=0
  420959.3801  0.0682 -5.4924 3 1336.6561195  71510 303972771      962868        syn-C2H3C(O)NH2, v=0
  421024.4123  0.0200 -3.0950 3  466.2083125 -71510 30362 755      61 854        syn-C2H3C(O)NH2, v=0
  421024.4045  0.0014 -5.1546 3  466.2083125  71510 30362 855      61 854        syn-C2H3C(O)NH2, v=0
  421024.4050  0.0014 -5.1546 3  466.2083125  71510 30362 755      61 754        syn-C2H3C(O)NH2, v=0
  421024.4123  0.0200 -3.0950 3  466.2083125 -71510 30362 855      61 754        syn-C2H3C(O)NH2, v=0
  421055.1886  0.0104 -4.4316 3 1123.4579171  71510 303853253      853154        syn-C2H3C(O)NH2, v=0
  421055.1903  0.0104 -4.4316 3 1123.4579171  71510 303853254      853155        syn-C2H3C(O)NH2, v=0
  421099.9016  0.0039 -4.4614 3  400.5792107  71510 303531637      531340        syn-C2H3C(O)NH2, v=0
  421192.5601  0.0090 -4.0526 3  673.8940155  71510 30377 572      77 473        syn-C2H3C(O)NH2, v=0
  421192.5601  0.0090 -4.0526 3  673.8940155  71510 30377 672      77 573        syn-C2H3C(O)NH2, v=0
  421231.3495  0.0200 -3.1276 3  461.8928123 -71510 30361 853      60 952        syn-C2H3C(O)NH2, v=0
  421231.3579  0.0014 -5.1546 3  461.8928123  71510 30361 953      60 952        syn-C2H3C(O)NH2, v=0
  421231.3748  0.0014 -5.1546 3  461.8928123  71510 30361 853      60 852        syn-C2H3C(O)NH2, v=0
  421231.3495  0.0200 -3.1276 3  461.8928123 -71510 30361 953      60 852        syn-C2H3C(O)NH2, v=0
  421240.0812  0.0200 -3.3600 3  396.1605109 -71510 303541342      531241        syn-C2H3C(O)NH2, v=0
  421300.4516  0.0200 -3.3505 3  437.9034115 -71510 303571245      561344        syn-C2H3C(O)NH2, v=0
  421303.4660  0.0031 -3.8522 3  769.1678135  71510 303673136      673037        syn-C2H3C(O)NH2, v=0
  421303.4660  0.0031 -3.8522 3  769.1678135  71510 303673137      673038        syn-C2H3C(O)NH2, v=0
  421318.7184  0.0014 -5.4134 3  537.8726115  71510 303572532      562531        syn-C2H3C(O)NH2, v=0
  421318.7184  0.0014 -5.4134 3  537.8726115  71510 303572533      562532        syn-C2H3C(O)NH2, v=0
  421438.4139  0.0200 -3.0200 3  171.9967 69 -71510 303341322      331221        syn-C2H3C(O)NH2, v=0
  421504.2777  0.0200 -3.2983 3  243.9519 85 -71510 303421231      411130        syn-C2H3C(O)NH2, v=0
  421542.6302  0.0035 -4.4092 3  508.6850121  71510 303601743      601446        syn-C2H3C(O)NH2, v=0
  421545.8256  0.0682 -5.1799 3 1173.2770183  71510 303912566      902665        syn-C2H3C(O)NH2, v=0
  421550.2529  0.0200 -3.0198 3  171.9935 69 -71510 303341321      331222        syn-C2H3C(O)NH2, v=0
  421571.2010  0.0200 -3.1646 3  456.9584121 -71510 30360 951      591050        syn-C2H3C(O)NH2, v=0
  421571.7827  0.0013 -5.1530 3  456.9584121  71510 303601051      591050        syn-C2H3C(O)NH2, v=0
  421572.2444  0.0013 -5.1530 3  456.9584121  71510 30360 951      59 950        syn-C2H3C(O)NH2, v=0
  421572.7885  0.0200 -3.1646 3  456.9584121 -71510 303601051      59 950        syn-C2H3C(O)NH2, v=0
  421638.7413  0.0012 -5.2049 3  456.2567113  71510 303561839      551838        syn-C2H3C(O)NH2, v=0
  421651.6505  0.0200 -3.3701 3  382.6089107 -71510 303531341      521240        syn-C2H3C(O)NH2, v=0
  421748.6160  0.0013 -5.2047 3  456.2613113  71510 303561838      551837        syn-C2H3C(O)NH2, v=0
  421899.2907  0.0029 -3.8277 3  752.6748133  71510 303663135      663036        syn-C2H3C(O)NH2, v=0
  421899.2907  0.0029 -3.8277 3  752.6748133  71510 303663136      663037        syn-C2H3C(O)NH2, v=0
  421904.1795  0.0558 -5.3854 3 1277.5478191  71510 303952670      942767        syn-C2H3C(O)NH2, v=0
  421925.3063  0.0200 -2.7320 3  131.5095 41 -71510 3032020 0      1919 1        syn-C2H3C(O)NH2, v=0
  421925.3063  0.0200 -2.7320 3  131.5095 41 -71510 3032020 1      1919 0        syn-C2H3C(O)NH2, v=0
  422023.4866  0.0014 -5.3805 3  526.6163115  71510 303572434      562433        syn-C2H3C(O)NH2, v=0
  422023.4867  0.0014 -5.3805 3  526.6163115  71510 303572433      562432        syn-C2H3C(O)NH2, v=0
  422028.7753  0.1200 -6.0219 3 1614.2135213  71510 303A63176      A53273        syn-C2H3C(O)NH2, v=0
  422044.9261  0.0029 -3.4212 3  175.7066 73  71510 303361026      35 927        syn-C2H3C(O)NH2, v=0
  422116.8891  0.0200 -3.2086 3  451.3603119 -71510 303591049      581148        syn-C2H3C(O)NH2, v=0
  422119.7528  0.0223 -4.9011 3 1386.4538193  71510 303963363      963264        syn-C2H3C(O)NH2, v=0
  422119.9849  0.0223 -4.9011 3 1386.4538193  71510 303963364      963265        syn-C2H3C(O)NH2, v=0
  422129.5344  0.0012 -5.1495 3  451.3603119  71510 303591149      581148        syn-C2H3C(O)NH2, v=0
  422139.1937  0.0012 -5.1494 3  451.3596119  71510 303591049      581048        syn-C2H3C(O)NH2, v=0
  422151.8743  0.0200 -3.2085 3  451.3596119 -71510 303591149      581048        syn-C2H3C(O)NH2, v=0
  422248.8659  0.0098 -4.3935 3 1102.3591169  71510 303843252      843153        syn-C2H3C(O)NH2, v=0
  422248.8667  0.0098 -4.3935 3 1102.3591169  71510 303843253      843154        syn-C2H3C(O)NH2, v=0
  422253.3540  0.1135 -5.5764 3 1727.6857227  71510 303B32390      B32291        syn-C2H3C(O)NH2, v=0
  422265.7298  0.1134 -5.5764 3 1727.6857227  71510 303B32490      B32391        syn-C2H3C(O)NH2, v=0
  422357.2421  0.0200 -2.7601 3  132.7627 45 -71510 3032219 3      2118 4        syn-C2H3C(O)NH2, v=0
  422357.2421  0.0200 -2.7601 3  132.7627 45 -71510 3032219 4      2118 3        syn-C2H3C(O)NH2, v=0
  422364.8872  0.0038 -4.3147 3   77.5535 53  71510 30326 422      25 323        syn-C2H3C(O)NH2, v=0
  422386.0733  0.0665 -5.1640 3 1499.2041213  71510 303A62086      A61987        syn-C2H3C(O)NH2, v=0
  422386.7956  0.0665 -5.1640 3 1499.2041213  71510 303A62186      A62087        syn-C2H3C(O)NH2, v=0
  422398.1602  0.0109 -4.1724 3  854.5201169  71510 30384 975      84 876        syn-C2H3C(O)NH2, v=0
  422398.1602  0.0109 -4.1724 3  854.5201169  71510 303841075      84 976        syn-C2H3C(O)NH2, v=0
  422439.7378  0.0110 -4.1109 3  597.2774149  71510 30374 371      74 272        syn-C2H3C(O)NH2, v=0
  422439.7378  0.0110 -4.1109 3  597.2774149  71510 30374 471      74 372        syn-C2H3C(O)NH2, v=0
  422447.4522  0.0200 -3.3502 3  409.8648111 -71510 303551343      541242        syn-C2H3C(O)NH2, v=0
  422467.7335  0.0028 -3.8041 3  736.4357131  71510 303653134      653035        syn-C2H3C(O)NH2, v=0
  422467.7335  0.0028 -3.8041 3  736.4357131  71510 303653135      653036        syn-C2H3C(O)NH2, v=0
  422556.4470  0.1615 -5.8912 3 1897.6059237  71510 303B82593      B82494        syn-C2H3C(O)NH2, v=0
  422616.6499  0.1610 -5.8910 3 1897.6062237  71510 303B82693      B82594        syn-C2H3C(O)NH2, v=0
  422656.5595  0.1228 -6.0205 3 1614.2118213  71510 303A63175      A53274        syn-C2H3C(O)NH2, v=0
  422766.4786  0.0200 -2.7897 3  135.4872 49 -71510 3032418 6      2317 7        syn-C2H3C(O)NH2, v=0
  422766.4786  0.0200 -2.7897 3  135.4872 49 -71510 3032418 7      2317 6        syn-C2H3C(O)NH2, v=0
  422772.9332  0.0024 -5.1652 3  119.3954 57  71510 303281217      28 920        syn-C2H3C(O)NH2, v=0
  422775.2282  0.0679 -5.7897 3 1861.4668227  71510 303B33578      B33479        syn-C2H3C(O)NH2, v=0
  422801.8939  0.0200 -3.2646 3  445.0329117 -71510 303581147      571246        syn-C2H3C(O)NH2, v=0
  422830.8850  0.0675 -5.7896 3 1861.4647227  71510 303B33579      B33480        syn-C2H3C(O)NH2, v=0
  422832.3290  0.0013 -5.3489 3  515.8735115  71510 303572335      562334        syn-C2H3C(O)NH2, v=0
  422832.3301  0.0013 -5.3489 3  515.8735115  71510 303572334      562333        syn-C2H3C(O)NH2, v=0
  422855.0754  0.0403 -5.3471 3 1627.6427211  71510 303A53471      A53372        syn-C2H3C(O)NH2, v=0
  422860.5559  0.0403 -5.3471 3 1627.6424211  71510 303A53472      A53373        syn-C2H3C(O)NH2, v=0
  422903.9829  0.0200 -2.9530 3  161.4941 65 -71510 303321419      311318        syn-C2H3C(O)NH2, v=0
  422905.6420  0.0200 -2.9530 3  161.4941 65 -71510 303321418      311319        syn-C2H3C(O)NH2, v=0
  422983.7378  0.0143 -4.4317 3  523.6324143  71510 30371 170      71 071        syn-C2H3C(O)NH2, v=0
  422983.7378  0.0143 -4.4317 3  523.6324143  71510 30371 270      71 171        syn-C2H3C(O)NH2, v=0
  423009.8512  0.0027 -3.7813 3  720.4501129  71510 303643133      643034        syn-C2H3C(O)NH2, v=0
  423009.8512  0.0027 -3.7813 3  720.4501129  71510 303643134      643035        syn-C2H3C(O)NH2, v=0
  423023.2623  0.0012 -5.1437 3  445.0329117  71510 303581247      571246        syn-C2H3C(O)NH2, v=0
  423045.8277  0.0038 -4.3137 3   77.5533 53  71510 30326 522      25 223        syn-C2H3C(O)NH2, v=0
  423086.4175  0.0013 -5.0806 3  400.5792109  71510 303541341      531340        syn-C2H3C(O)NH2, v=0
  423119.9216  0.0200 -2.8221 3  139.6966 53 -71510 3032617 9      251610        syn-C2H3C(O)NH2, v=0
  423119.9216  0.0200 -2.8221 3  139.6966 53 -71510 303261710      2516 9        syn-C2H3C(O)NH2, v=0
  423173.7386  0.0012 -5.1433 3  445.0205117  71510 303581147      571146        syn-C2H3C(O)NH2, v=0
  423310.7190  0.0091 -4.0695 3  721.8555159  71510 30379 673      79 574        syn-C2H3C(O)NH2, v=0
  423310.7190  0.0091 -4.0695 3  721.8555159  71510 30379 773      79 674        syn-C2H3C(O)NH2, v=0
  423356.2167  0.0200 -2.8586 3  145.4108 57 -71510 303281613      271512        syn-C2H3C(O)NH2, v=0
  423356.2167  0.0200 -2.8586 3  145.4108 57 -71510 303281612      271513        syn-C2H3C(O)NH2, v=0
  423360.1031  0.0200 -2.9012 3  152.6604 61 -71510 303301516      291415        syn-C2H3C(O)NH2, v=0
  423360.1031  0.0200 -2.9012 3  152.6604 61 -71510 303301515      291416        syn-C2H3C(O)NH2, v=0
  423375.2478  0.0043 -6.1523 3  798.4197117  71510 303584117      574116        syn-C2H3C(O)NH2, v=0
  423375.2478  0.0043 -6.1523 3  798.4197117  71510 303584118      574117        syn-C2H3C(O)NH2, v=0
  423391.9242  0.0092 -4.3560 3 1081.5215167  71510 303833251      833152        syn-C2H3C(O)NH2, v=0
  423391.9246  0.0092 -4.3560 3 1081.5215167  71510 303833252      833153        syn-C2H3C(O)NH2, v=0
  423395.1069  0.0200 -3.2633 3  445.0205117 -71510 303581247      571146        syn-C2H3C(O)NH2, v=0
  423526.6568  0.0026 -3.7594 3  704.7176127  71510 303633132      633033        syn-C2H3C(O)NH2, v=0
  423526.6568  0.0026 -3.7594 3  704.7176127  71510 303633133      633034        syn-C2H3C(O)NH2, v=0
  423535.7720  0.0923 -5.5992 3 1397.2360199  71510 303992871      982970        syn-C2H3C(O)NH2, v=0
  423564.8960  0.0038 -6.0919 3  779.4161117  71510 303584018      574017        syn-C2H3C(O)NH2, v=0
  423564.8960  0.0038 -6.0919 3  779.4161117  71510 303584019      574018        syn-C2H3C(O)NH2, v=0
  423670.1554  0.0036 -4.6975 3  208.0067 79  71510 303391129      39 832        syn-C2H3C(O)NH2, v=0
  423695.6172  0.0126 -4.2334 3  906.9564173  71510 303861076      86 977        syn-C2H3C(O)NH2, v=0
  423695.6172  0.0126 -4.2334 3  906.9564173  71510 303861176      861077        syn-C2H3C(O)NH2, v=0
  423702.7712  0.0200 -3.1653 3  202.9678 77 -71510 303381227      371126        syn-C2H3C(O)NH2, v=0
  423765.0541  0.0034 -6.0339 3  760.8867117  71510 303583919      573918        syn-C2H3C(O)NH2, v=0
  423765.0541  0.0034 -6.0339 3  760.8867117  71510 303583920      573919        syn-C2H3C(O)NH2, v=0
  423771.4957  0.0013 -5.3185 3  505.6533115  71510 303572236      562235        syn-C2H3C(O)NH2, v=0
  423771.5117  0.0013 -5.3185 3  505.6533115  71510 303572235      562234        syn-C2H3C(O)NH2, v=0
  423801.9530  0.0012 -5.1291 3  430.0451113  71510 303561443      551442        syn-C2H3C(O)NH2, v=0
  423825.8640  0.0209 -4.8551 3 1362.4989191  71510 303953362      953263        syn-C2H3C(O)NH2, v=0
  423825.9875  0.0209 -4.8551 3 1362.4989191  71510 303953363      953264        syn-C2H3C(O)NH2, v=0
  423846.5342  0.0025 -3.3793 3  369.2094105  71510 303521340      511239        syn-C2H3C(O)NH2, v=0
  423877.1962  0.0013 -5.1796 3  448.8717113  71510 303561740      551739        syn-C2H3C(O)NH2, v=0
  423936.5099  0.0562 -5.0493 3 1434.5315209  71510 303A41985      A41886        syn-C2H3C(O)NH2, v=0
  423936.7282  0.0562 -5.0493 3 1434.5315209  71510 303A42085      A41986        syn-C2H3C(O)NH2, v=0
  423946.3668  0.0025 -5.2472 3  112.4350 55  71510 303271215      27 918        syn-C2H3C(O)NH2, v=0
  423976.9983  0.0030 -5.9781 3  742.8324117  71510 303583820      573819        syn-C2H3C(O)NH2, v=0
  423976.9983  0.0030 -5.9781 3  742.8324117  71510 303583821      573820        syn-C2H3C(O)NH2, v=0
  424019.1227  0.0025 -3.7384 3  689.2380125  71510 303623131      623032        syn-C2H3C(O)NH2, v=0
  424019.1227  0.0025 -3.7384 3  689.2380125  71510 303623132      623033        syn-C2H3C(O)NH2, v=0
  424046.7613  0.0057 -4.4315 3  487.6286119  71510 303591643      591346        syn-C2H3C(O)NH2, v=0
  424123.9526  0.0012 -5.1356 3  437.9034115  71510 303571345      561344        syn-C2H3C(O)NH2, v=0
  424126.6736  0.0035 -4.4214 3  493.2085119  71510 303591742      591445        syn-C2H3C(O)NH2, v=0
  424202.1895  0.0027 -5.9244 3  725.2539117  71510 303583721      573720        syn-C2H3C(O)NH2, v=0
  424202.1895  0.0027 -5.9244 3  725.2539117  71510 303583722      573721        syn-C2H3C(O)NH2, v=0
  424263.7643  0.0036 -4.1185 3   87.6806 55  71510 30327 622      26 323        syn-C2H3C(O)NH2, v=0
  424421.2038  0.0029 -4.6282 3  222.8669 81  71510 303401229      40 932        syn-C2H3C(O)NH2, v=0
  424438.3972  0.0022 -5.8484 3   34.2586 31  71510 30315 9 7      14 6 8        syn-C2H3C(O)NH2, v=0
  424442.3073  0.0025 -5.8727 3  708.1521117  71510 303583622      573621        syn-C2H3C(O)NH2, v=0
  424442.3073  0.0025 -5.8727 3  708.1521117  71510 303583623      573622        syn-C2H3C(O)NH2, v=0
  424486.6005  0.0086 -4.3194 3 1060.9445165  71510 303823250      823151        syn-C2H3C(O)NH2, v=0
  424486.6007  0.0086 -4.3194 3 1060.9445165  71510 303823251      823152        syn-C2H3C(O)NH2, v=0
  424488.1831  0.0024 -3.7183 3  674.0107123  71510 303613130      613031        syn-C2H3C(O)NH2, v=0
  424488.1831  0.0024 -3.7183 3  674.0107123  71510 303613131      613032        syn-C2H3C(O)NH2, v=0
  424651.3975  0.0013 -5.1781 3  448.9085113  71510 303561739      551738        syn-C2H3C(O)NH2, v=0
  424653.3055  0.0024 -3.2633 3  233.2214 83  71510 303411230      401129        syn-C2H3C(O)NH2, v=0
  424657.8496  0.0041 -4.4176 3  524.3061123  71510 303611744      611447        syn-C2H3C(O)NH2, v=0
  424699.2921  0.0023 -5.8229 3  691.5280117  71510 303583523      573522        syn-C2H3C(O)NH2, v=0
  424699.2921  0.0023 -5.8229 3  691.5280117  71510 303583524      573523        syn-C2H3C(O)NH2, v=0
  424712.2855  0.0022 -5.8481 3   34.2495 31  71510 30315 9 6      14 6 9        syn-C2H3C(O)NH2, v=0
  424771.3187  0.0147 -4.3016 3  960.6470177  71510 303881177      881078        syn-C2H3C(O)NH2, v=0
  424771.3187  0.0147 -4.3016 3  960.6470177  71510 303881277      881178        syn-C2H3C(O)NH2, v=0
  424786.6627  0.1085 -5.8888 3 1548.7822209  71510 303A43075      A33172        syn-C2H3C(O)NH2, v=0
  424877.6853  0.0013 -5.2894 3  495.9681115  71510 303572137      562136        syn-C2H3C(O)NH2, v=0
  424877.8949  0.0013 -5.2894 3  495.9681115  71510 303572136      562135        syn-C2H3C(O)NH2, v=0
  424925.6600  0.0103 -4.0775 3  643.2674153  71510 30376 472      76 373        syn-C2H3C(O)NH2, v=0
  424925.6600  0.0103 -4.0775 3  643.2674153  71510 30376 572      76 473        syn-C2H3C(O)NH2, v=0
  424934.7364  0.0023 -3.6991 3  659.0356121  71510 303603129      603030        syn-C2H3C(O)NH2, v=0
  424934.7364  0.0023 -3.6991 3  659.0356121  71510 303603130      603031        syn-C2H3C(O)NH2, v=0
  424975.3977  0.0021 -5.7749 3  675.3828117  71510 303583424      573423        syn-C2H3C(O)NH2, v=0
  424975.3977  0.0021 -5.7749 3  675.3828117  71510 303583425      573424        syn-C2H3C(O)NH2, v=0
  424991.7940  0.0015 -3.3417 3  423.7272113  71510 303561344      551243        syn-C2H3C(O)NH2, v=0
  425004.9267  0.0967 -5.4481 3 1658.8774223  71510 303B12289      B12190        syn-C2H3C(O)NH2, v=0
  425009.0883  0.0967 -5.4481 3 1658.8774223  71510 303B12389      B12290        syn-C2H3C(O)NH2, v=0
  425090.8131  0.0378 -5.2946 3 1601.3286209  71510 303A43470      A43371        syn-C2H3C(O)NH2, v=0
  425093.9044  0.0377 -5.2946 3 1601.3285209  71510 303A43471      A43372        syn-C2H3C(O)NH2, v=0
  425111.0530  0.0475 -4.9390 3 1371.0491205  71510 303A21884      A21785        syn-C2H3C(O)NH2, v=0
  425111.1162  0.0475 -4.9390 3 1371.0491205  71510 303A21984      A21885        syn-C2H3C(O)NH2, v=0
  425239.4113  0.0097 -4.1016 3  771.0959163  71510 30381 774      81 675        syn-C2H3C(O)NH2, v=0
  425239.4113  0.0097 -4.1016 3  771.0959163  71510 30381 874      81 775        syn-C2H3C(O)NH2, v=0
  425273.2561  0.0019 -5.7287 3  659.7177117  71510 303583325      573324        syn-C2H3C(O)NH2, v=0
  425273.2561  0.0019 -5.7287 3  659.7177117  71510 303583326      573325        syn-C2H3C(O)NH2, v=0
  425359.6472  0.0022 -3.6810 3  644.3122119  71510 303593128      593029        syn-C2H3C(O)NH2, v=0
  425359.6472  0.0022 -3.6810 3  644.3122119  71510 303593129      593030        syn-C2H3C(O)NH2, v=0
  425458.5247  0.0196 -4.8098 3 1338.8109189  71510 303943361      943262        syn-C2H3C(O)NH2, v=0
  425458.5897  0.0196 -4.8098 3 1338.8109189  71510 303943362      943263        syn-C2H3C(O)NH2, v=0
  425534.9936  0.0080 -4.2835 3 1040.6277163  71510 303813249      813150        syn-C2H3C(O)NH2, v=0
  425534.9937  0.0080 -4.2835 3 1040.6277163  71510 303813250      813151        syn-C2H3C(O)NH2, v=0
  425595.9618  0.0018 -5.6842 3  644.5342117  71510 303583226      573225        syn-C2H3C(O)NH2, v=0
  425595.9618  0.0018 -5.6842 3  644.5342117  71510 303583227      573226        syn-C2H3C(O)NH2, v=0
  425604.8037  0.0631 -5.7313 3 1833.0376225  71510 303B23577      B23478        syn-C2H3C(O)NH2, v=0
  425615.7298  0.0173 -4.3764 3 1015.5855181  71510 303901278      901179        syn-C2H3C(O)NH2, v=0
  425615.7298  0.0173 -4.3764 3 1015.5855181  71510 303901378      901279        syn-C2H3C(O)NH2, v=0
  425637.6533  0.0629 -5.7313 3 1833.0363225  71510 303B23578      B23479        syn-C2H3C(O)NH2, v=0
  425718.7760  0.0017 -3.1943 3  212.7279 79  71510 303391228      381127        syn-C2H3C(O)NH2, v=0
  425739.8901  0.0013 -5.1319 3  437.7553115  71510 303571245      561244        syn-C2H3C(O)NH2, v=0
  425760.4190  0.0016 -3.4648 3  458.5348117  71510 303581345      571444        syn-C2H3C(O)NH2, v=0
  425763.7483  0.0021 -3.6638 3  629.8402117  71510 303583127      583028        syn-C2H3C(O)NH2, v=0
  425763.7483  0.0021 -3.6638 3  629.8402117  71510 303583128      583029        syn-C2H3C(O)NH2, v=0
  425764.6382  0.0040 -3.7713 3  531.3360125  71510 303621547      611646        syn-C2H3C(O)NH2, v=0
  425780.2028  0.0020 -4.9184 3   57.6990 43  71510 30321 813      20 516        syn-C2H3C(O)NH2, v=0
  425809.7462  0.0131 -4.2176 3  567.6277147  71510 30373 271      73 172        syn-C2H3C(O)NH2, v=0
  425809.7462  0.0131 -4.2176 3  567.6277147  71510 30373 371      73 272        syn-C2H3C(O)NH2, v=0
  425831.9653  0.0024 -5.2445 3  112.3721 55  71510 303271216      27 919        syn-C2H3C(O)NH2, v=0
  425864.3141  0.1949 -6.0800 3 2000.1392243  71510 303C12695      C12596        syn-C2H3C(O)NH2, v=0
  425938.5695  0.0400 -4.8332 3 1308.7650201  71510 303A01783      A01684        syn-C2H3C(O)NH2, v=0
  425938.5870  0.0400 -4.8332 3 1308.7650201  71510 303A01883      A01784        syn-C2H3C(O)NH2, v=0
  425947.1771  0.0017 -5.6413 3  629.8341117  71510 303583127      573126        syn-C2H3C(O)NH2, v=0
  425947.1771  0.0017 -5.6413 3  629.8341117  71510 303583128      573127        syn-C2H3C(O)NH2, v=0
  425965.2191  0.1938 -6.0798 3 2000.1397243  71510 303C12795      C12696        syn-C2H3C(O)NH2, v=0
  426003.3693  0.0013 -5.1563 3  442.1368113  71510 303561641      551640        syn-C2H3C(O)NH2, v=0
  426017.0012  0.0032 -3.9786 3   98.0319 57  71510 30328 722      27 423        syn-C2H3C(O)NH2, v=0
  426082.6791  0.0200 -3.2276 3  222.8115 81 -71510 303401229      391128        syn-C2H3C(O)NH2, v=0
  426147.8429  0.0021 -3.6477 3  615.6193115  71510 303573126      573027        syn-C2H3C(O)NH2, v=0
  426147.8429  0.0021 -3.6477 3  615.6193115  71510 303573127      573028        syn-C2H3C(O)NH2, v=0
  426170.8931  0.0059 -4.8562 3  202.5302 79  71510 30339 930      39 633        syn-C2H3C(O)NH2, v=0
  426204.0696  0.0013 -5.2614 3  486.8342115  71510 303572038      562037        syn-C2H3C(O)NH2, v=0
  426206.4593  0.0013 -5.2614 3  486.8343115  71510 303572037      562036        syn-C2H3C(O)NH2, v=0
  426218.1246  0.0204 -4.4573 3 1071.7655185  71510 303921379      921280        syn-C2H3C(O)NH2, v=0
  426218.1247  0.0204 -4.4573 3 1071.7655185  71510 303921479      921380        syn-C2H3C(O)NH2, v=0
  426231.3512  0.0794 -5.3220 3 1253.6220189  71510 303942668      932767        syn-C2H3C(O)NH2, v=0
  426244.1579  0.1382 -5.7535 3 1825.8758233  71510 303B62492      B62393        syn-C2H3C(O)NH2, v=0
  426265.7061  0.1380 -5.7535 3 1825.8759233  71510 303B62592      B62493        syn-C2H3C(O)NH2, v=0
  426282.9981  0.1141 -5.8857 3 1548.7781209  71510 303A43074      A33173        syn-C2H3C(O)NH2, v=0
  426284.2242  0.0014 -5.0824 3  404.2819109  71510 303541440      531439        syn-C2H3C(O)NH2, v=0
  426331.2717  0.0017 -5.6001 3  615.6193117  71510 303583028      573027        syn-C2H3C(O)NH2, v=0
  426331.2717  0.0017 -5.6001 3  615.6193117  71510 303583029      573028        syn-C2H3C(O)NH2, v=0
  426360.1756  0.0992 -6.1486 3 2051.3976239  71510 303B93683      B93584        syn-C2H3C(O)NH2, v=0
  426443.4953  0.0337 -4.7319 3 1247.6873197  71510 303981682      981583        syn-C2H3C(O)NH2, v=0
  426443.4999  0.0337 -4.7319 3 1247.6873197  71510 303981782      981683        syn-C2H3C(O)NH2, v=0
  426498.3289  0.0956 -5.6694 3 1342.2990197  71510 303982574      972671        syn-C2H3C(O)NH2, v=0
  426512.7057  0.0020 -3.6326 3  601.6493113  71510 303563125      563026        syn-C2H3C(O)NH2, v=0
  426512.7057  0.0020 -3.6326 3  601.6493113  71510 303563126      563027        syn-C2H3C(O)NH2, v=0
  426516.1017  0.0012 -5.1384 3  435.9627113  71510 303561542      551541        syn-C2H3C(O)NH2, v=0
  426533.0849  0.0976 -6.1482 3 2051.3908239  71510 303B93684      B93585        syn-C2H3C(O)NH2, v=0
  426539.0768  0.0075 -4.2483 3 1020.5704161  71510 303803248      803149        syn-C2H3C(O)NH2, v=0
  426539.0768  0.0075 -4.2483 3 1020.5704161  71510 303803249      803150        syn-C2H3C(O)NH2, v=0
  426566.3839  0.0240 -4.5437 3 1129.1804189  71510 303941480      941381        syn-C2H3C(O)NH2, v=0
  426566.3842  0.0240 -4.5437 3 1129.1804189  71510 303941580      941481        syn-C2H3C(O)NH2, v=0
  426646.7460  0.0285 -4.6353 3 1187.8233193  71510 303961581      961482        syn-C2H3C(O)NH2, v=0
  426646.7471  0.0285 -4.6353 3 1187.8233193  71510 303961681      961582        syn-C2H3C(O)NH2, v=0
  426738.2388  0.0010 -3.1315 3  193.3497 75  71510 303371225      361126        syn-C2H3C(O)NH2, v=0
  426753.5047  0.0016 -5.5604 3  601.8923117  71510 303582929      572928        syn-C2H3C(O)NH2, v=0
  426753.5047  0.0016 -5.5604 3  601.8923117  71510 303582930      572929        syn-C2H3C(O)NH2, v=0
  426829.8191  0.0016 -5.1527 3  491.8282135  71510 30367 364      66 363        syn-C2H3C(O)NH2, v=0
  426829.8058  0.0200 -2.9984 3  491.8282135 -71510 30367 364      66 463        syn-C2H3C(O)NH2, v=0
  426829.8058  0.0200 -2.9984 3  491.8282135 -71510 30367 464      66 363        syn-C2H3C(O)NH2, v=0
  426829.8191  0.0016 -5.1527 3  491.8282135  71510 30367 464      66 463        syn-C2H3C(O)NH2, v=0
  426832.4608  0.0018 -5.1470 3  493.3836137  71510 30368 266      67 265        syn-C2H3C(O)NH2, v=0
  426832.4580  0.0200 -2.9754 3  493.3836137 -71510 30368 266      67 365        syn-C2H3C(O)NH2, v=0
  426832.4580  0.0200 -2.9754 3  493.3836137 -71510 30368 366      67 265        syn-C2H3C(O)NH2, v=0
  426832.4608  0.0018 -5.1470 3  493.3836137  71510 30368 366      67 365        syn-C2H3C(O)NH2, v=0
  426839.7364  0.0016 -5.1573 3  489.7490133  71510 30366 462      65 461        syn-C2H3C(O)NH2, v=0
  426839.7259  0.0200 -3.0221 3  489.7490133 -71510 30366 462      65 561        syn-C2H3C(O)NH2, v=0
  426839.7259  0.0200 -3.0221 3  489.7490133 -71510 30366 562      65 461        syn-C2H3C(O)NH2, v=0
  426839.7364  0.0016 -5.1573 3  489.7490133  71510 30366 562      65 561        syn-C2H3C(O)NH2, v=0
  426841.6185  0.0023 -5.1404 3  494.4234139  71510 30369 168      68 167        syn-C2H3C(O)NH2, v=0
  426841.6158  0.0200 -2.9531 3  494.4234139 -71510 30369 168      68 267        syn-C2H3C(O)NH2, v=0
  426841.6158  0.0200 -2.9531 3  494.4234139 -71510 30369 268      68 167        syn-C2H3C(O)NH2, v=0
  426841.6185  0.0023 -5.1404 3  494.4234139  71510 30369 268      68 267        syn-C2H3C(O)NH2, v=0
  426852.9215  0.0033 -5.1328 3  494.9543141  71510 30370 070      69 069        syn-C2H3C(O)NH2, v=0
  426852.9439  0.0200 -2.9311 3  494.9543141 -71510 30370 070      69 169        syn-C2H3C(O)NH2, v=0
  426852.9439  0.0200 -2.9311 3  494.9543141 -71510 30370 170      69 069        syn-C2H3C(O)NH2, v=0
  426852.9215  0.0033 -5.1328 3  494.9543141  71510 30370 170      69 169        syn-C2H3C(O)NH2, v=0
  426859.0845  0.0019 -3.6186 3  587.9296111  71510 303553124      553025        syn-C2H3C(O)NH2, v=0
  426859.0845  0.0019 -3.6186 3  587.9296111  71510 303553125      553026        syn-C2H3C(O)NH2, v=0
  426870.7135  0.0016 -5.1609 3  487.1358131  71510 30365 560      64 559        syn-C2H3C(O)NH2, v=0
  426870.7093  0.0200 -3.0469 3  487.1358131 -71510 30365 560      64 659        syn-C2H3C(O)NH2, v=0
  426870.7093  0.0200 -3.0469 3  487.1358131 -71510 30365 660      64 559        syn-C2H3C(O)NH2, v=0
  426870.7135  0.0016 -5.1609 3  487.1358131  71510 30365 660      64 659        syn-C2H3C(O)NH2, v=0
  426917.4262  0.0432 -5.3428 3 1243.7314189  71510 303942570      932667        syn-C2H3C(O)NH2, v=0
  426934.9772  0.0016 -5.1633 3  483.9756129  71510 30364 658      63 657        syn-C2H3C(O)NH2, v=0
  426934.9777  0.0200 -3.0733 3  483.9756129 -71510 30364 658      63 757        syn-C2H3C(O)NH2, v=0
  426934.9777  0.0200 -3.0733 3  483.9756129 -71510 30364 758      63 657        syn-C2H3C(O)NH2, v=0
  426934.9772  0.0016 -5.1633 3  483.9756129  71510 30364 758      63 757        syn-C2H3C(O)NH2, v=0
  426972.7107  0.0107 -4.1457 3  821.6092167  71510 30383 875      83 776        syn-C2H3C(O)NH2, v=0
  426972.7107  0.0107 -4.1457 3  821.6092167  71510 30383 975      83 876        syn-C2H3C(O)NH2, v=0
  427021.5639  0.0184 -4.7653 3 1315.3888187  71510 303933360      933261        syn-C2H3C(O)NH2, v=0
  427021.5978  0.0184 -4.7653 3 1315.3888187  71510 303933361      933262        syn-C2H3C(O)NH2, v=0
  427050.6216  0.0015 -3.1018 3  480.2521127  71510 30363 756      62 855        syn-C2H3C(O)NH2, v=0
  427050.6219  0.0015 -5.1645 3  480.2521127  71510 30363 856      62 855        syn-C2H3C(O)NH2, v=0
  427050.6222  0.0015 -5.1645 3  480.2521127  71510 30363 756      62 755        syn-C2H3C(O)NH2, v=0
  427050.6224  0.0015 -3.1018 3  480.2521127  71510 30363 856      62 755        syn-C2H3C(O)NH2, v=0
  427187.7021  0.0019 -3.6058 3  574.4602109  71510 303543123      543024        syn-C2H3C(O)NH2, v=0
  427187.7021  0.0019 -3.6058 3  574.4602109  71510 303543124      543025        syn-C2H3C(O)NH2, v=0
  427220.2699  0.0016 -5.5222 3  588.6557117  71510 303582830      572829        syn-C2H3C(O)NH2, v=0
  427220.2699  0.0016 -5.5222 3  588.6557117  71510 303582831      572830        syn-C2H3C(O)NH2, v=0
  427224.9886  0.0354 -5.2429 3 1575.2868207  71510 303A33469      A33370        syn-C2H3C(O)NH2, v=0
  427226.7154  0.0354 -5.2429 3 1575.2868207  71510 303A33470      A33371        syn-C2H3C(O)NH2, v=0
  427235.0002  0.0100 -4.0751 3  690.5479157  71510 30378 573      78 474        syn-C2H3C(O)NH2, v=0
  427235.0002  0.0100 -4.0751 3  690.5479157  71510 30378 673      78 574        syn-C2H3C(O)NH2, v=0
  427245.4477  0.0014 -3.1332 3  475.9436125  71510 30362 854      61 953        syn-C2H3C(O)NH2, v=0
  427245.4577  0.0014 -5.1644 3  475.9436125  71510 30362 954      61 953        syn-C2H3C(O)NH2, v=0
  427245.4667  0.0014 -5.1644 3  475.9436125  71510 30362 854      61 853        syn-C2H3C(O)NH2, v=0
  427245.4767  0.0014 -3.1332 3  475.9436125  71510 30362 954      61 853        syn-C2H3C(O)NH2, v=0
  427276.7802  0.0823 -5.3239 3 1591.2337219  71510 303A92188      A92089        syn-C2H3C(O)NH2, v=0
  427278.1261  0.0823 -5.3239 3 1591.2337219  71510 303A92288      A92189        syn-C2H3C(O)NH2, v=0
  427361.7302  0.0059 -5.1351 3  148.3426 69  71510 30334 727      34 430        syn-C2H3C(O)NH2, v=0
  427499.2570  0.0019 -3.5942 3  561.2406107  71510 303533122      533023        syn-C2H3C(O)NH2, v=0
  427499.2570  0.0019 -3.5942 3  561.2406107  71510 303533123      533024        syn-C2H3C(O)NH2, v=0
  427500.7090  0.0071 -4.2139 3 1000.7721159  71510 303793247      793148        syn-C2H3C(O)NH2, v=0
  427500.7090  0.0071 -4.2139 3 1000.7721159  71510 303793248      793149        syn-C2H3C(O)NH2, v=0
  427564.1107  0.0014 -3.1687 3  471.0205123  71510 30361 952      601051        syn-C2H3C(O)NH2, v=0
  427564.4128  0.0014 -5.1627 3  471.0205123  71510 303611052      601051        syn-C2H3C(O)NH2, v=0
  427564.6665  0.0014 -5.1627 3  471.0205123  71510 30361 952      60 951        syn-C2H3C(O)NH2, v=0
  427564.9686  0.0014 -3.1687 3  471.0205123  71510 303611052      60 951        syn-C2H3C(O)NH2, v=0
  427654.8589  0.0025 -5.3306 3  105.6464 53  71510 303261214      26 917        syn-C2H3C(O)NH2, v=0
  427721.5889  0.0970 -5.7598 3 1484.8053205  71510 303A22974      A13071        syn-C2H3C(O)NH2, v=0
  427739.4310  0.0015 -5.4854 3  575.9130117  71510 303582731      572730        syn-C2H3C(O)NH2, v=0
  427739.4310  0.0015 -5.4854 3  575.9130117  71510 303582732      572731        syn-C2H3C(O)NH2, v=0
  427783.4664  0.0028 -3.3853 3  355.9693103  71510 303511339      501238        syn-C2H3C(O)NH2, v=0
  427794.4249  0.0018 -3.5838 3  548.2707105  71510 303523121      523022        syn-C2H3C(O)NH2, v=0
  427794.4249  0.0018 -3.5838 3  548.2707105  71510 303523122      523023        syn-C2H3C(O)NH2, v=0
  427827.4359  0.0013 -5.2344 3  478.2746115  71510 303571939      561938        syn-C2H3C(O)NH2, v=0
  427850.7783  0.0013 -5.2344 3  478.2755115  71510 303571938      561937        syn-C2H3C(O)NH2, v=0
  427952.5384  0.0039 -4.5643 3  317.4019 95  71510 303471532      471235        syn-C2H3C(O)NH2, v=0
  428005.0732  0.0010 -3.0280 3  180.4868 71  71510 303351323      341222        syn-C2H3C(O)NH2, v=0
  428073.8597  0.0018 -3.5748 3  535.5501103  71510 303513120      513021        syn-C2H3C(O)NH2, v=0
  428073.8597  0.0018 -3.5748 3  535.5501103  71510 303513121      513022        syn-C2H3C(O)NH2, v=0
  428076.6242  0.0013 -3.2106 3  465.4410121  71510 303601050      591149        syn-C2H3C(O)NH2, v=0
  428083.7779  0.0013 -5.1592 3  465.4410121  71510 303601150      591149        syn-C2H3C(O)NH2, v=0
  428089.3087  0.0013 -5.1592 3  465.4406121  71510 303601050      591049        syn-C2H3C(O)NH2, v=0
  428096.4624  0.0013 -3.2105 3  465.4406121  71510 303601150      591049        syn-C2H3C(O)NH2, v=0
  428206.9616  0.0014 -5.0927 3  414.6919111  71510 303551342      541341        syn-C2H3C(O)NH2, v=0
  428228.2258  0.0200 -3.0277 3  180.4805 71 -71510 303351322      341223        syn-C2H3C(O)NH2, v=0
  428290.6453  0.0012 -3.3389 3  452.0507117  71510 303581246      571345        syn-C2H3C(O)NH2, v=0
  428292.3474  0.0589 -5.6739 3 1804.8866223  71510 303B13576      B13477        syn-C2H3C(O)NH2, v=0
  428311.5507  0.0588 -5.6738 3 1804.8859223  71510 303B13577      B13478        syn-C2H3C(O)NH2, v=0
  428320.7910  0.0015 -5.4501 3  563.6682117  71510 303582632      572631        syn-C2H3C(O)NH2, v=0
  428320.7910  0.0015 -5.4501 3  563.6682117  71510 303582633      572632        syn-C2H3C(O)NH2, v=0
  428338.1947  0.0018 -3.5672 3  523.0785101  71510 303503119      503020        syn-C2H3C(O)NH2, v=0
  428338.1947  0.0018 -3.5672 3  523.0785101  71510 303503120      503021        syn-C2H3C(O)NH2, v=0
  428421.6445  0.0066 -4.1803 3  981.2322157  71510 303783246      783147        syn-C2H3C(O)NH2, v=0
  428421.6445  0.0066 -4.1803 3  981.2322157  71510 303783247      783148        syn-C2H3C(O)NH2, v=0
  428469.6435  0.0121 -4.1314 3  612.9251151  71510 30375 372      75 273        syn-C2H3C(O)NH2, v=0
  428469.6435  0.0121 -4.1314 3  612.9251151  71510 30375 472      75 373        syn-C2H3C(O)NH2, v=0
  428504.0517  0.0121 -4.1995 3  873.3894171  71510 30385 976      85 877        syn-C2H3C(O)NH2, v=0
  428504.0517  0.0121 -4.1995 3  873.3894171  71510 303851076      85 977        syn-C2H3C(O)NH2, v=0
  428518.5059  0.0173 -4.7216 3 1292.2320185  71510 303923359      923260        syn-C2H3C(O)NH2, v=0
  428518.5234  0.0173 -4.7216 3 1292.2320185  71510 303923360      923261        syn-C2H3C(O)NH2, v=0
  428534.8151  0.0062 -5.9842 3   90.3251 57  71510 30328 424      28 127        syn-C2H3C(O)NH2, v=0
  428563.3842  0.0014 -3.3346 3  437.7553115  71510 303571345      561244        syn-C2H3C(O)NH2, v=0
  428588.0430  0.0018 -3.5612 3  510.8557 99  71510 303493118      493019        syn-C2H3C(O)NH2, v=0
  428588.0430  0.0018 -3.5612 3  510.8557 99  71510 303493119      493020        syn-C2H3C(O)NH2, v=0
  428670.6170  0.0024 -5.3291 3  105.6125 53  71510 303261215      26 918        syn-C2H3C(O)NH2, v=0
  428754.2202  0.0062 -5.9839 3   90.3251 57  71510 30328 524      28 227        syn-C2H3C(O)NH2, v=0
  428790.7605  0.0200 -3.2629 3  459.1435119 -71510 303591148      581247        syn-C2H3C(O)NH2, v=0
  428823.9989  0.0018 -3.5567 3  498.8815 97  71510 303483117      483018        syn-C2H3C(O)NH2, v=0
  428823.9989  0.0018 -3.5567 3  498.8815 97  71510 303483118      483019        syn-C2H3C(O)NH2, v=0
  428838.7761  0.0015 -5.1132 3  422.7424111  71510 303551540      541539        syn-C2H3C(O)NH2, v=0
  428921.3930  0.0013 -5.1535 3  459.1435119  71510 303591248      581247        syn-C2H3C(O)NH2, v=0
  428976.7671  0.0014 -5.4162 3  551.9263117  71510 303582533      572532        syn-C2H3C(O)NH2, v=0
  428976.7671  0.0014 -5.4162 3  551.9263117  71510 303582534      572533        syn-C2H3C(O)NH2, v=0
  429011.9836  0.0155 -4.4501 3  538.2736145  71510 30372 171      72 072        syn-C2H3C(O)NH2, v=0
  429011.9836  0.0155 -4.4501 3  538.2736145  71510 30372 271      72 172        syn-C2H3C(O)NH2, v=0
  429012.1679  0.0013 -5.1533 3  459.1361119  71510 303591148      581147        syn-C2H3C(O)NH2, v=0
  429046.6387  0.0018 -3.5540 3  487.1555 95  71510 303473116      473017        syn-C2H3C(O)NH2, v=0
  429046.6387  0.0018 -3.5540 3  487.1555 95  71510 303473117      473018        syn-C2H3C(O)NH2, v=0
  429116.5898  0.0700 -5.2040 3 1524.7643215  71510 303A72087      A71988        syn-C2H3C(O)NH2, v=0
  429117.0081  0.0700 -5.2040 3 1524.7643215  71510 303A72187      A72088        syn-C2H3C(O)NH2, v=0
  429142.7601  0.0200 -3.2622 3  459.1361119 -71510 303591248      581147        syn-C2H3C(O)NH2, v=0
  429210.0581  0.0200 -2.7290 3  136.3779 43 -71510 3032120 1      2019 2        syn-C2H3C(O)NH2, v=0
  429210.0581  0.0200 -2.7290 3  136.3779 43 -71510 3032120 2      2019 1        syn-C2H3C(O)NH2, v=0
  429256.4911  0.0200 -3.5533 3  475.6776 93 -71510 303463115      463016        syn-C2H3C(O)NH2, v=0
  429256.4911  0.0200 -3.5533 3  475.6776 93 -71510 303463116      463017        syn-C2H3C(O)NH2, v=0
  429264.0315  0.0332 -5.1921 3 1549.5163205  71510 303A23468      A23369        syn-C2H3C(O)NH2, v=0
  429264.9869  0.0332 -5.1921 3 1549.5162205  71510 303A23469      A23370        syn-C2H3C(O)NH2, v=0
  429303.5415  0.0062 -4.1474 3  961.9504155  71510 303773245      773146        syn-C2H3C(O)NH2, v=0
  429303.5415  0.0062 -4.1474 3  961.9504155  71510 303773246      773147        syn-C2H3C(O)NH2, v=0
  429349.9765  0.1182 -5.6201 3 1755.2919229  71510 303B42391      B42292        syn-C2H3C(O)NH2, v=0
  429357.4021  0.1182 -5.6201 3 1755.2920229  71510 303B42491      B42392        syn-C2H3C(O)NH2, v=0
  429363.0672  0.0101 -4.0933 3  739.1133161  71510 30380 674      80 575        syn-C2H3C(O)NH2, v=0
  429363.0672  0.0101 -4.0933 3  739.1133161  71510 30380 774      80 675        syn-C2H3C(O)NH2, v=0
  429454.1871  0.0019 -3.5546 3  464.4475 91  71510 303453114      453015        syn-C2H3C(O)NH2, v=0
  429454.1871  0.0019 -3.5546 3  464.4475 91  71510 303453115      453016        syn-C2H3C(O)NH2, v=0
  429632.0052  0.0917 -6.0859 3 2021.3922237  71510 303B83682      B83583        syn-C2H3C(O)NH2, v=0
  429637.4016  0.0200 -2.7571 3  138.1251 47 -71510 3032319 4      2218 5        syn-C2H3C(O)NH2, v=0
  429637.4016  0.0200 -2.7571 3  138.1251 47 -71510 3032319 5      2218 4        syn-C2H3C(O)NH2, v=0
  429640.1540  0.0200 -3.5582 3  453.4649 89 -71510 303443113      443014        syn-C2H3C(O)NH2, v=0
  429640.1540  0.0200 -3.5582 3  453.4649 89 -71510 303443114      443015        syn-C2H3C(O)NH2, v=0
  429715.0030  0.0033 -4.8581 3  180.4309 71  71510 303351322      351025        syn-C2H3C(O)NH2, v=0
  429723.3926  0.0014 -5.3836 3  540.6935117  71510 303582435      572434        syn-C2H3C(O)NH2, v=0
  429723.3928  0.0014 -5.3836 3  540.6935117  71510 303582434      572433        syn-C2H3C(O)NH2, v=0
  429736.6520  0.0908 -6.0857 3 2021.3881237  71510 303B83683      B83584        syn-C2H3C(O)NH2, v=0
  429814.9562  0.0200 -3.5644 3  442.7296 87 -71510 303433112      433013        syn-C2H3C(O)NH2, v=0
  429814.9562  0.0200 -3.5644 3  442.7296 87 -71510 303433113      433014        syn-C2H3C(O)NH2, v=0
  429826.1406  0.0139 -4.2617 3  926.4305175  71510 303871077      87 978        syn-C2H3C(O)NH2, v=0
  429826.1406  0.0139 -4.2617 3  926.4305175  71510 303871177      871078        syn-C2H3C(O)NH2, v=0
  429833.3536  0.0013 -5.2083 3  470.3211115  71510 303571840      561839        syn-C2H3C(O)NH2, v=0
  429851.3446  0.0200 -2.9567 3  169.4211 67 -71510 303331420      321319        syn-C2H3C(O)NH2, v=0
  429855.1220  0.0200 -2.9566 3  169.4210 67 -71510 303331419      321320        syn-C2H3C(O)NH2, v=0
  429952.6058  0.0162 -4.6786 3 1269.3397183  71510 303913358      913259        syn-C2H3C(O)NH2, v=0
  429952.6147  0.0162 -4.6786 3 1269.3397183  71510 303913359      913260        syn-C2H3C(O)NH2, v=0
  429973.7707  0.1671 -5.9373 3 1926.6487239  71510 303B92594      B92495        syn-C2H3C(O)NH2, v=0
  429979.0702  0.0200 -3.5736 3  432.2415 85 -71510 303423111      423012        syn-C2H3C(O)NH2, v=0
  429979.0702  0.0200 -3.5736 3  432.2415 85 -71510 303423112      423013        syn-C2H3C(O)NH2, v=0
  430010.7334  0.1668 -5.9372 3 1926.6489239  71510 303B92694      B92595        syn-C2H3C(O)NH2, v=0
  430024.3056  0.0013 -5.2079 3  470.3293115  71510 303571839      561838        syn-C2H3C(O)NH2, v=0
  430034.4516  0.0200 -2.7871 3  141.3472 51 -71510 3032518 7      2417 8        syn-C2H3C(O)NH2, v=0
  430034.4516  0.0200 -2.7871 3  141.3472 51 -71510 3032518 8      2417 7        syn-C2H3C(O)NH2, v=0
  430060.1066  0.0013 -5.1454 3  452.0507117  71510 303581346      571345        syn-C2H3C(O)NH2, v=0
  430065.4837  0.0014 -5.1484 3  442.3745113  71510 303561640      551639        syn-C2H3C(O)NH2, v=0
  430132.9806  0.0200 -3.5862 3  422.0002 83 -71510 303413110      413011        syn-C2H3C(O)NH2, v=0
  430132.9806  0.0200 -3.5862 3  422.0002 83 -71510 303413111      413012        syn-C2H3C(O)NH2, v=0
  430147.9704  0.0058 -4.1153 3  942.9260153  71510 303763244      763145        syn-C2H3C(O)NH2, v=0
  430147.9704  0.0058 -4.1153 3  942.9260153  71510 303763245      763146        syn-C2H3C(O)NH2, v=0
  430277.1711  0.0200 -3.6027 3  412.0056 81 -71510 3034031 9      403010        syn-C2H3C(O)NH2, v=0
  430277.1711  0.0200 -3.6027 3  412.0056 81 -71510 303403110      403011        syn-C2H3C(O)NH2, v=0
  430297.9081  0.0012 -5.1375 3  444.1816115  71510 303571444      561443        syn-C2H3C(O)NH2, v=0
  430307.6718  0.0022 -5.6844 3   37.9871 33  71510 30316 9 8      15 6 9        syn-C2H3C(O)NH2, v=0
  430362.7637  0.0200 -2.8203 3  146.0591 55 -71510 303271710      261611        syn-C2H3C(O)NH2, v=0
  430362.7637  0.0200 -2.8203 3  146.0591 55 -71510 303271711      261610        syn-C2H3C(O)NH2, v=0
  430412.0126  0.0200 -3.6239 3  402.2575 79 -71510 3033931 8      3930 9        syn-C2H3C(O)NH2, v=0
  430412.0126  0.0200 -3.6239 3  402.2575 79 -71510 3033931 9      393010        syn-C2H3C(O)NH2, v=0
  430469.2455  0.0200 -2.9024 3  160.0521 63 -71510 303311517      301416        syn-C2H3C(O)NH2, v=0
  430469.2455  0.0200 -2.9024 3  160.0521 63 -71510 303311516      301417        syn-C2H3C(O)NH2, v=0
  430491.5985  0.0849 -5.6362 3 1422.2922201  71510 303A02873      992970        syn-C2H3C(O)NH2, v=0
  430538.0717  0.0200 -3.6509 3  392.7557 77 -71510 3033831 7      3830 8        syn-C2H3C(O)NH2, v=0
  430538.0717  0.0200 -3.6509 3  392.7557 77 -71510 3033831 8      3830 9        syn-C2H3C(O)NH2, v=0
  430551.7611  0.0200 -2.8580 3  152.2828 59 -71510 303291614      281513        syn-C2H3C(O)NH2, v=0
  430551.7611  0.0200 -2.8580 3  152.2828 59 -71510 303291613      281514        syn-C2H3C(O)NH2, v=0
  430562.7638  0.0594 -5.0883 3 1459.4782211  71510 303A51986      A51887        syn-C2H3C(O)NH2, v=0
  430562.8886  0.0594 -5.0883 3 1459.4782211  71510 303A52086      A51987        syn-C2H3C(O)NH2, v=0
  430581.8643  0.0014 -5.3523 3  529.9776117  71510 303582336      572335        syn-C2H3C(O)NH2, v=0
  430581.8667  0.0014 -5.3523 3  529.9776117  71510 303582335      572334        syn-C2H3C(O)NH2, v=0
  430655.6558  0.0200 -3.6850 3  383.4999 75 -71510 3033731 6      3730 7        syn-C2H3C(O)NH2, v=0
  430655.6558  0.0200 -3.6850 3  383.4999 75 -71510 3033731 7      3730 8        syn-C2H3C(O)NH2, v=0
  430726.0520  0.0025 -5.4204 3   99.1343 51  71510 303251213      25 916        syn-C2H3C(O)NH2, v=0
  430758.0715  0.0044 -6.1452 3  812.5420119  71510 303594118      584117        syn-C2H3C(O)NH2, v=0
  430758.0715  0.0044 -6.1452 3  812.5420119  71510 303594119      584118        syn-C2H3C(O)NH2, v=0
  430765.2493  0.0200 -3.7283 3  374.4900 73 -71510 3033631 5      3630 6        syn-C2H3C(O)NH2, v=0
  430765.2493  0.0200 -3.7283 3  374.4900 73 -71510 3033631 6      3630 7        syn-C2H3C(O)NH2, v=0
  430782.8996  0.0025 -3.5982 3  494.3156121  71510 303601446      591545        syn-C2H3C(O)NH2, v=0
  430849.7428  0.0550 -5.6173 3 1777.0124221  71510 303B03575      B03476        syn-C2H3C(O)NH2, v=0
  430860.8624  0.0549 -5.6172 3 1777.0119221  71510 303B03576      B03477        syn-C2H3C(O)NH2, v=0
  430867.2388  0.0200 -3.7841 3  365.7258 71 -71510 3033531 4      3530 5        syn-C2H3C(O)NH2, v=0
  430867.2388  0.0200 -3.7841 3  365.7258 71 -71510 3033531 5      3530 6        syn-C2H3C(O)NH2, v=0
  430919.6660  0.0022 -5.6838 3   37.9667 33  71510 30316 9 7      15 610        syn-C2H3C(O)NH2, v=0
  430930.8507  0.0161 -4.3312 3  980.7263179  71510 303891178      891079        syn-C2H3C(O)NH2, v=0
  430930.8507  0.0161 -4.3312 3  980.7263179  71510 303891278      891179        syn-C2H3C(O)NH2, v=0
  430939.0709  0.0028 -6.1463 3   34.7408 35  71510 30317 711      16 214        syn-C2H3C(O)NH2, v=0
  430956.2654  0.0039 -6.0861 3  793.5447119  71510 303594019      584018        syn-C2H3C(O)NH2, v=0
  430956.2654  0.0039 -6.0861 3  793.5447119  71510 303594020      584019        syn-C2H3C(O)NH2, v=0
  430956.4203  0.0055 -4.0839 3  924.1587151  71510 303753243      753144        syn-C2H3C(O)NH2, v=0
  430956.4203  0.0055 -4.0839 3  924.1587151  71510 303753244      753145        syn-C2H3C(O)NH2, v=0
  430959.6585  0.0114 -4.0993 3  659.5188155  71510 30377 473      77 374        syn-C2H3C(O)NH2, v=0
  430959.6585  0.0114 -4.0993 3  659.5188155  71510 30377 573      77 474        syn-C2H3C(O)NH2, v=0
  430961.9718  0.0200 -3.8580 3  357.2071 69 -71510 3033431 3      3430 4        syn-C2H3C(O)NH2, v=0
  430961.9718  0.0200 -3.8580 3  357.2071 69 -71510 3033431 4      3430 5        syn-C2H3C(O)NH2, v=0
  431049.9235  0.0200 -3.9601 3  348.9338 67 -71510 3033331 2      3330 3        syn-C2H3C(O)NH2, v=0
  431049.9235  0.0200 -3.9601 3  348.9338 67 -71510 3033331 3      3330 4        syn-C2H3C(O)NH2, v=0
  431114.1393  0.0013 -5.1430 3  451.9565117  71510 303581246      571245        syn-C2H3C(O)NH2, v=0
  431131.3419  0.0032 -4.1136 3  340.9056 65  71510 3033231 1      3230 2        syn-C2H3C(O)NH2, v=0
  431131.3419  0.0032 -4.1136 3  340.9056 65  71510 3033231 2      3230 3        syn-C2H3C(O)NH2, v=0
  431165.5818  0.0035 -6.0293 3  775.0220119  71510 303593920      583919        syn-C2H3C(O)NH2, v=0
  431165.5818  0.0035 -6.0293 3  775.0220119  71510 303593921      583920        syn-C2H3C(O)NH2, v=0
  431185.3934  0.1082 -5.7525 3 1484.7949205  71510 303A22973      A13072        syn-C2H3C(O)NH2, v=0
  431206.6443  0.0034 -4.3922 3  333.1225 63  71510 3033131 0      3130 1        syn-C2H3C(O)NH2, v=0
  431206.6443  0.0034 -4.3922 3  333.1225 63  71510 3033131 1      3130 2        syn-C2H3C(O)NH2, v=0
  431213.6863  0.0311 -5.1420 3 1524.0158203  71510 303A13467      A13368        syn-C2H3C(O)NH2, v=0
  431214.2097  0.0311 -5.1420 3 1524.0158203  71510 303A13468      A13369        syn-C2H3C(O)NH2, v=0
  431251.8693  0.0024 -5.4197 3   99.1167 51  71510 303251214      25 917        syn-C2H3C(O)NH2, v=0
  431304.6964  0.0107 -4.1267 3  788.9576165  71510 30382 775      82 676        syn-C2H3C(O)NH2, v=0
  431304.6964  0.0107 -4.1267 3  788.9576165  71510 30382 875      82 776        syn-C2H3C(O)NH2, v=0
  431326.8792  0.0152 -4.6364 3 1246.7112181  71510 303903357      903258        syn-C2H3C(O)NH2, v=0
  431326.8837  0.0152 -4.6364 3 1246.7112181  71510 303903358      903259        syn-C2H3C(O)NH2, v=0
  431387.3698  0.0032 -5.9745 3  756.9748119  71510 303593821      583820        syn-C2H3C(O)NH2, v=0
  431387.3698  0.0032 -5.9745 3  756.9748119  71510 303593822      583821        syn-C2H3C(O)NH2, v=0
  431523.8217  0.0040 -4.9977 3   59.8544 45  71510 30322 715      21 418        syn-C2H3C(O)NH2, v=0
  431573.8771  0.0060 -5.6124 3  108.3860 61  71510 30330 525      30 228        syn-C2H3C(O)NH2, v=0
  431581.0406  0.0013 -5.3222 3  519.7888117  71510 303582237      572236        syn-C2H3C(O)NH2, v=0
  431581.0743  0.0013 -5.3222 3  519.7888117  71510 303582236      572235        syn-C2H3C(O)NH2, v=0
  431623.1741  0.0029 -5.9217 3  739.4038119  71510 303593722      583721        syn-C2H3C(O)NH2, v=0
  431623.1741  0.0029 -5.9217 3  739.4038119  71510 303593723      583722        syn-C2H3C(O)NH2, v=0
  431639.2729  0.0059 -5.3419 3  127.7300 65  71510 30332 626      32 329        syn-C2H3C(O)NH2, v=0
  431647.0424  0.0503 -4.9769 3 1395.3837207  71510 303A31885      A31786        syn-C2H3C(O)NH2, v=0
  431647.0781  0.0503 -4.9769 3 1395.3837207  71510 303A31985      A31886        syn-C2H3C(O)NH2, v=0
  431730.3056  0.0052 -4.0534 3  905.6479149  71510 303743242      743143        syn-C2H3C(O)NH2, v=0
  431730.3056  0.0052 -4.0534 3  905.6479149  71510 303743243      743144        syn-C2H3C(O)NH2, v=0
  431794.0416  0.0043 -5.7188 3   98.0319 55  71510 30327 918      27 423        syn-C2H3C(O)NH2, v=0
  431809.0965  0.0188 -4.4072 3 1036.2705183  71510 303911279      911180        syn-C2H3C(O)NH2, v=0
  431809.0965  0.0188 -4.4072 3 1036.2705183  71510 303911379      911280        syn-C2H3C(O)NH2, v=0
  431837.1877  0.0142 -4.2374 3  582.8729149  71510 30374 272      74 173        syn-C2H3C(O)NH2, v=0
  431837.1877  0.0142 -4.2374 3  582.8729149  71510 30374 372      74 273        syn-C2H3C(O)NH2, v=0
  431851.1536  0.0918 -5.4684 3 1336.6193195  71510 303972770      962869        syn-C2H3C(O)NH2, v=0
  431861.3205  0.0039 -4.4506 3  477.8825117  71510 303581741      581444        syn-C2H3C(O)NH2, v=0
  431874.7722  0.0026 -5.8709 3  722.3100119  71510 303593623      583622        syn-C2H3C(O)NH2, v=0
  431874.7722  0.0026 -5.8709 3  722.3100119  71510 303593624      583623        syn-C2H3C(O)NH2, v=0
  431921.8579  0.0449 -5.4002 3 1267.8395191  71510 303952571      942668        syn-C2H3C(O)NH2, v=0
  431932.9972  0.0568 -5.4196 3 1301.7241193  71510 303962671      952768        syn-C2H3C(O)NH2, v=0
  431945.4991  0.1011 -5.4908 3 1685.8650225  71510 303B22290      B22191        syn-C2H3C(O)NH2, v=0
  431947.9623  0.1011 -5.4908 3 1685.8650225  71510 303B22390      B22291        syn-C2H3C(O)NH2, v=0
  432144.2189  0.0024 -5.8219 3  705.6945119  71510 303593524      583523        syn-C2H3C(O)NH2, v=0
  432144.2189  0.0024 -5.8219 3  705.6945119  71510 303593525      583524        syn-C2H3C(O)NH2, v=0
  432159.8636  0.0013 -5.1832 3  463.0108115  71510 303571741      561740        syn-C2H3C(O)NH2, v=0
  432357.3731  0.0715 -5.5209 3 1361.2573197  71510 303982772      972869        syn-C2H3C(O)NH2, v=0
  432380.7569  0.0689 -5.5610 3 1317.1102195  71510 303972573      962670        syn-C2H3C(O)NH2, v=0
  432396.1165  0.0426 -4.8699 3 1332.4890203  71510 303A11784      A11685        syn-C2H3C(O)NH2, v=0
  432396.1262  0.0426 -4.8699 3 1332.4890203  71510 303A11884      A11785        syn-C2H3C(O)NH2, v=0
  432405.5574  0.0059 -5.6111 3  108.3860 61  71510 30330 625      30 328        syn-C2H3C(O)NH2, v=0
  432433.9026  0.0022 -5.7746 3  689.5584119  71510 303593425      583424        syn-C2H3C(O)NH2, v=0
  432433.9026  0.0022 -5.7746 3  689.5584119  71510 303593426      583425        syn-C2H3C(O)NH2, v=0
  432450.6826  0.0220 -4.4893 3 1093.0568187  71510 303931380      931281        syn-C2H3C(O)NH2, v=0
  432450.6826  0.0220 -4.4893 3 1093.0568187  71510 303931480      931381        syn-C2H3C(O)NH2, v=0
  432470.9718  0.0049 -4.0236 3  887.3933147  71510 303733241      733142        syn-C2H3C(O)NH2, v=0
  432470.9718  0.0049 -4.0236 3  887.3933147  71510 303733242      733143        syn-C2H3C(O)NH2, v=0
  432631.3695  0.0059 -4.7644 3  237.5095 85  71510 303421032      42 735        syn-C2H3C(O)NH2, v=0
  432644.1277  0.0143 -4.5950 3 1224.3458179  71510 303893356      893257        syn-C2H3C(O)NH2, v=0
  432644.1299  0.0143 -4.5950 3 1224.3458179  71510 303893357      893258        syn-C2H3C(O)NH2, v=0
  432724.4837  0.0851 -6.0242 3 1991.6694235  71510 303B73681      B73582        syn-C2H3C(O)NH2, v=0
  432746.6156  0.0021 -5.7290 3  673.9033119  71510 303593326      583325        syn-C2H3C(O)NH2, v=0
  432746.6156  0.0021 -5.7290 3  673.9033119  71510 303593327      583326        syn-C2H3C(O)NH2, v=0
  432761.6362  0.0013 -5.2934 3  510.1405117  71510 303582138      572137        syn-C2H3C(O)NH2, v=0
  432762.0570  0.0013 -5.2934 3  510.1405117  71510 303582137      572136        syn-C2H3C(O)NH2, v=0
  432787.2095  0.0846 -6.0240 3 1991.6670235  71510 303B73682      B73583        syn-C2H3C(O)NH2, v=0
  432832.7182  0.0361 -4.7674 3 1270.8016199  71510 303991683      991584        syn-C2H3C(O)NH2, v=0
  432832.7208  0.0361 -4.7674 3 1270.8016199  71510 303991783      991684        syn-C2H3C(O)NH2, v=0
  432844.1200  0.0259 -4.5769 3 1151.0785191  71510 303951481      951382        syn-C2H3C(O)NH2, v=0
  432844.1201  0.0259 -4.5769 3 1151.0785191  71510 303951581      951482        syn-C2H3C(O)NH2, v=0
  432851.8126  0.0014 -5.1063 3  428.9753113  71510 303561343      551342        syn-C2H3C(O)NH2, v=0
  432869.8591  0.0017 -5.1638 3  506.0657137  71510 30368 365      67 364        syn-C2H3C(O)NH2, v=0
  432869.8399  0.0200 -3.0086 3  506.0657137 -71510 30368 365      67 464        syn-C2H3C(O)NH2, v=0
  432869.8399  0.0200 -3.0086 3  506.0657137 -71510 30368 465      67 364        syn-C2H3C(O)NH2, v=0
  432869.8591  0.0017 -5.1638 3  506.0657137  71510 30368 465      67 464        syn-C2H3C(O)NH2, v=0
  432873.0569  0.0019 -5.1583 3  507.6212139  71510 30369 267      68 266        syn-C2H3C(O)NH2, v=0
  432873.0493  0.0200 -2.9861 3  507.6212139 -71510 30369 267      68 366        syn-C2H3C(O)NH2, v=0
  432873.0493  0.0200 -2.9861 3  507.6212139 -71510 30369 367      68 266        syn-C2H3C(O)NH2, v=0
  432873.0569  0.0019 -5.1583 3  507.6212139  71510 30369 367      68 366        syn-C2H3C(O)NH2, v=0
  432878.6417  0.0017 -5.1683 3  503.9868135  71510 30367 463      66 462        syn-C2H3C(O)NH2, v=0
  432878.6406  0.0200 -3.0318 3  503.9868135 -71510 30367 463      66 562        syn-C2H3C(O)NH2, v=0
  432878.6406  0.0200 -3.0318 3  503.9868135 -71510 30367 563      66 462        syn-C2H3C(O)NH2, v=0
  432878.6417  0.0017 -5.1683 3  503.9868135  71510 30367 563      66 562        syn-C2H3C(O)NH2, v=0
  432882.4399  0.0025 -5.1518 3  508.6613141  71510 30370 169      69 168        syn-C2H3C(O)NH2, v=0
  432882.4318  0.0200 -2.9641 3  508.6613141 -71510 30370 169      69 268        syn-C2H3C(O)NH2, v=0
  432882.4318  0.0200 -2.9641 3  508.6613141 -71510 30370 269      69 168        syn-C2H3C(O)NH2, v=0
  432882.4399  0.0025 -5.1518 3  508.6613141  71510 30370 269      69 268        syn-C2H3C(O)NH2, v=0
  432883.6006  0.0013 -3.3291 3  451.9565117  71510 303581346      571245        syn-C2H3C(O)NH2, v=0
  432893.7936  0.0035 -5.1443 3  509.1926143  71510 30371 071      70 070        syn-C2H3C(O)NH2, v=0
  432893.7902  0.0200 -2.9424 3  509.1926143 -71510 30371 071      70 170        syn-C2H3C(O)NH2, v=0
  432893.7902  0.0200 -2.9424 3  509.1926143 -71510 30371 171      70 070        syn-C2H3C(O)NH2, v=0
  432893.7936  0.0035 -5.1443 3  509.1926143  71510 30371 171      70 170        syn-C2H3C(O)NH2, v=0
  432907.5069  0.0017 -5.1717 3  501.3746133  71510 30366 561      65 560        syn-C2H3C(O)NH2, v=0
  432907.5014  0.0200 -3.0560 3  501.3746133 -71510 30366 561      65 660        syn-C2H3C(O)NH2, v=0
  432907.5014  0.0200 -3.0560 3  501.3746133 -71510 30366 661      65 560        syn-C2H3C(O)NH2, v=0
  432907.5069  0.0017 -5.1717 3  501.3746133  71510 30366 661      65 660        syn-C2H3C(O)NH2, v=0
  432968.0264  0.0017 -5.1741 3  498.2166131  71510 30365 659      64 658        syn-C2H3C(O)NH2, v=0
  432968.0237  0.0200 -3.0817 3  498.2166131 -71510 30365 659      64 758        syn-C2H3C(O)NH2, v=0
  432968.0237  0.0200 -3.0817 3  498.2166131 -71510 30365 759      64 658        syn-C2H3C(O)NH2, v=0
  432968.0264  0.0017 -5.1741 3  498.2166131  71510 30365 759      64 758        syn-C2H3C(O)NH2, v=0
  432976.4007  0.0306 -4.6697 3 1210.3291195  71510 303971582      971483        syn-C2H3C(O)NH2, v=0
  432976.4014  0.0306 -4.6697 3 1210.3291195  71510 303971682      971583        syn-C2H3C(O)NH2, v=0
  433054.1897  0.0118 -4.1720 3  840.0750169  71510 30384 876      84 777        syn-C2H3C(O)NH2, v=0
  433054.1897  0.0118 -4.1720 3  840.0750169  71510 30384 976      84 877        syn-C2H3C(O)NH2, v=0
  433077.1852  0.0200 -3.1093 3  494.4970129 -71510 30364 757      63 856        syn-C2H3C(O)NH2, v=0
  433077.1835  0.0016 -5.1751 3  494.4970129  71510 30364 857      63 856        syn-C2H3C(O)NH2, v=0
  433077.1837  0.0016 -5.1751 3  494.4970129  71510 30364 757      63 756        syn-C2H3C(O)NH2, v=0
  433077.1852  0.0200 -3.1093 3  494.4970129 -71510 30364 857      63 756        syn-C2H3C(O)NH2, v=0
  433079.1270  0.0293 -5.0928 3 1498.7846201  71510 303A03466      A03367        syn-C2H3C(O)NH2, v=0
  433079.4110  0.0293 -5.0928 3 1498.7846201  71510 303A03467      A03368        syn-C2H3C(O)NH2, v=0
  433085.6439  0.0019 -5.6851 3  658.7306119  71510 303593227      583226        syn-C2H3C(O)NH2, v=0
  433085.6439  0.0019 -5.6851 3  658.7306119  71510 303593228      583227        syn-C2H3C(O)NH2, v=0
  433134.9714  0.0024 -3.9013 3  108.5428 59  71510 30329 822      28 523        syn-C2H3C(O)NH2, v=0
  433178.5101  0.0030 -3.3857 3  342.9048101  71510 303501338      491237        syn-C2H3C(O)NH2, v=0
  433179.7004  0.0046 -3.9946 3  869.3944145  71510 303723240      723141        syn-C2H3C(O)NH2, v=0
  433179.7004  0.0046 -3.9946 3  869.3944145  71510 303723241      723142        syn-C2H3C(O)NH2, v=0
  433182.9225  0.0044 -3.9763 3  104.6268 59  71510 30329 623      28 524        syn-C2H3C(O)NH2, v=0
  433260.7735  0.0200 -3.1397 3  490.1950127 -71510 30363 855      62 954        syn-C2H3C(O)NH2, v=0
  433260.8124  0.0015 -5.1749 3  490.1950127  71510 30363 955      62 954        syn-C2H3C(O)NH2, v=0
  433260.8172  0.0015 -5.1749 3  490.1950127  71510 30363 855      62 854        syn-C2H3C(O)NH2, v=0
  433260.7735  0.0200 -3.1397 3  490.1950127 -71510 30363 955      62 854        syn-C2H3C(O)NH2, v=0
  433275.6626  0.0111 -4.0982 3  707.4030159  71510 30379 574      79 475        syn-C2H3C(O)NH2, v=0
  433275.6626  0.0111 -4.0982 3  707.4030159  71510 30379 674      79 575        syn-C2H3C(O)NH2, v=0
  433287.0103  0.0515 -5.5615 3 1749.4135219  71510 303A93574      A93475        syn-C2H3C(O)NH2, v=0
  433293.3885  0.0514 -5.5615 3 1749.4133219  71510 303A93575      A93476        syn-C2H3C(O)NH2, v=0
  433301.0830  0.0025 -5.5173 3   92.8929 49  71510 303241212      24 915        syn-C2H3C(O)NH2, v=0
  433412.3629  0.0013 -5.1809 3  463.0734115  71510 303571740      561739        syn-C2H3C(O)NH2, v=0
  433430.1745  0.2010 -6.1277 3 2029.9983245  71510 303C22696      C22597        syn-C2H3C(O)NH2, v=0
  433453.0108  0.1435 -5.7988 3 1854.2959235  71510 303B72493      B72394        syn-C2H3C(O)NH2, v=0
  433454.8820  0.0018 -5.6428 3  644.0422119  71510 303593128      583127        syn-C2H3C(O)NH2, v=0
  433454.8820  0.0018 -5.6428 3  644.0422119  71510 303593129      583128        syn-C2H3C(O)NH2, v=0
  433466.0532  0.1434 -5.7988 3 1854.2960235  71510 303B72593      B72494        syn-C2H3C(O)NH2, v=0
  433492.6804  0.2003 -6.1276 3 2029.9986245  71510 303C22796      C22697        syn-C2H3C(O)NH2, v=0
  433522.8923  0.0037 -4.6942 3  243.9519 83  71510 303411427      411130        syn-C2H3C(O)NH2, v=0
  433560.2261  0.0200 -3.1739 3  485.2825125 -71510 30362 953      611052        syn-C2H3C(O)NH2, v=0
  433560.1220  0.0015 -5.1732 3  485.2825125  71510 303621053      611052        syn-C2H3C(O)NH2, v=0
  433560.2607  0.0015 -5.1732 3  485.2825125  71510 30362 953      61 952        syn-C2H3C(O)NH2, v=0
  433560.2261  0.0200 -3.1739 3  485.2825125 -71510 303621053      61 952        syn-C2H3C(O)NH2, v=0
  433562.4316  0.0025 -5.5168 3   92.8842 49  71510 303241213      24 916        syn-C2H3C(O)NH2, v=0
  433595.3231  0.1778 -5.9855 3 1480.3932207  71510 303A32678      A22775        syn-C2H3C(O)NH2, v=0
  433612.6721  0.0031 -4.6287 3  232.9225 83  71510 303411230      41 933        syn-C2H3C(O)NH2, v=0
  433722.8570  0.0053 -4.4470 3  540.0739125  71510 303621745      621448        syn-C2H3C(O)NH2, v=0
  433726.6931  0.0200 -3.2946 3  198.2603 77 -71510 303381127      371028        syn-C2H3C(O)NH2, v=0
  433776.7921  0.0056 -3.9010 3  585.9338131  71510 303651649      641748        syn-C2H3C(O)NH2, v=0
  433782.0879  0.1296 -6.0501 3 1640.8934215  71510 303A73177      A63274        syn-C2H3C(O)NH2, v=0
  433857.7136  0.0044 -3.9664 3  851.6508143  71510 303713239      713140        syn-C2H3C(O)NH2, v=0
  433857.7136  0.0044 -3.9664 3  851.6508143  71510 303713240      713141        syn-C2H3C(O)NH2, v=0
  433858.9832  0.0018 -5.6020 3  629.8402119  71510 303593029      583028        syn-C2H3C(O)NH2, v=0
  433858.9832  0.0018 -5.6020 3  629.8402119  71510 303593030      583029        syn-C2H3C(O)NH2, v=0
  433890.8533  0.0013 -5.1449 3  450.1897115  71510 303571543      561542        syn-C2H3C(O)NH2, v=0
  433906.9608  0.0134 -4.5542 3 1202.2429177  71510 303883355      883256        syn-C2H3C(O)NH2, v=0
  433906.9619  0.0134 -4.5542 3 1202.2429177  71510 303883356      883257        syn-C2H3C(O)NH2, v=0
  433978.8862  0.0523 -5.4720 3 1292.2943193  71510 303962572      952669        syn-C2H3C(O)NH2, v=0
  434040.4421  0.0200 -3.2137 3  479.7204123 -71510 303611051      601150        syn-C2H3C(O)NH2, v=0
  434044.4492  0.0014 -5.1697 3  479.7204123  71510 303611151      601150        syn-C2H3C(O)NH2, v=0
  434047.5934  0.0014 -5.1697 3  479.7201123  71510 303611051      601050        syn-C2H3C(O)NH2, v=0
  434051.6315  0.0200 -3.2137 3  479.7201123 -71510 303611151      601050        syn-C2H3C(O)NH2, v=0
  434063.3534  0.0063 -6.0161 3   87.6806 53  71510 30326 818      26 323        syn-C2H3C(O)NH2, v=0
  434084.1046  0.0013 -5.1609 3  456.3467115  71510 303571642      561641        syn-C2H3C(O)NH2, v=0
  434084.8779  0.0864 -5.3657 3 1617.6050221  71510 303B02189      B02090        syn-C2H3C(O)NH2, v=0
  434085.6641  0.0864 -5.3657 3 1617.6050221  71510 303B02289      B02190        syn-C2H3C(O)NH2, v=0
  434182.9620  0.0013 -5.2656 3  501.0508117  71510 303582039      572038        syn-C2H3C(O)NH2, v=0
  434187.5247  0.0013 -5.2656 3  501.0510117  71510 303582038      572037        syn-C2H3C(O)NH2, v=0
  434290.2072  0.0060 -5.4727 3   51.7673 43  71510 30321 615      20 318        syn-C2H3C(O)NH2, v=0
  434303.5585  0.0017 -5.5628 3  616.1273119  71510 303592930      582929        syn-C2H3C(O)NH2, v=0
  434303.5585  0.0017 -5.5628 3  616.1273119  71510 303592931      582930        syn-C2H3C(O)NH2, v=0
  434327.6346  0.0056 -5.3380 3  127.7300 65  71510 30332 726      32 429        syn-C2H3C(O)NH2, v=0
  434368.4692  0.0200 -3.1509 3  202.6850 77 -71510 303381226      371127        syn-C2H3C(O)NH2, v=0
  434414.6847  0.0010 -3.0379 3  189.2457 73  71510 303361324      351223        syn-C2H3C(O)NH2, v=0
  434498.5147  0.0132 -4.1525 3  628.7741153  71510 30376 373      76 274        syn-C2H3C(O)NH2, v=0
  434498.5147  0.0132 -4.1525 3  628.7741153  71510 30376 473      76 374        syn-C2H3C(O)NH2, v=0
  434506.1787  0.0042 -3.9390 3  834.1620141  71510 303703238      703139        syn-C2H3C(O)NH2, v=0
  434506.1787  0.0042 -3.9390 3  834.1620141  71510 303703239      703140        syn-C2H3C(O)NH2, v=0
  434605.2457  0.0133 -4.2271 3  892.4595173  71510 30386 977      86 878        syn-C2H3C(O)NH2, v=0
  434605.2457  0.0133 -4.2271 3  892.4595173  71510 303861077      86 978        syn-C2H3C(O)NH2, v=0
  434677.8948  0.0047 -4.9555 3  170.2095 73  71510 30336 928      36 631        syn-C2H3C(O)NH2, v=0
  434707.7198  0.0014 -5.0862 3  418.5013111  71510 303551441      541440        syn-C2H3C(O)NH2, v=0
  434749.9373  0.0200 -3.2629 3  473.4508121 -71510 303601149      591248        syn-C2H3C(O)NH2, v=0
  434795.4443  0.0016 -5.5250 3  602.9063119  71510 303592831      582830        syn-C2H3C(O)NH2, v=0
  434795.4443  0.0016 -5.5250 3  602.9063119  71510 303592832      582831        syn-C2H3C(O)NH2, v=0
  434808.7324  0.1343 -6.0480 3 1640.8906215  71510 303A73176      A63275        syn-C2H3C(O)NH2, v=0
  434824.0334  0.0041 -5.0416 3   63.0492 51  71510 30325 223      24 124        syn-C2H3C(O)NH2, v=0
  434826.3877  0.0013 -5.1641 3  473.4508121  71510 303601249      591248        syn-C2H3C(O)NH2, v=0
  434828.2878  0.0041 -5.0416 3   63.0492 51  71510 30325 323      24 024        syn-C2H3C(O)NH2, v=0
  434834.0061  0.0052 -5.1256 3  148.3428 69  71510 30334 827      34 530        syn-C2H3C(O)NH2, v=0
  434847.2549  0.0200 -3.0372 3  189.2335 73 -71510 303361323      351224        syn-C2H3C(O)NH2, v=0
  434865.0455  0.0275 -5.0443 3 1473.8217199  71510 303993465      993366        syn-C2H3C(O)NH2, v=0
  434865.1613  0.0013 -3.3313 3  466.3959119  71510 303591247      581346        syn-C2H3C(O)NH2, v=0
  434865.1981  0.0275 -5.0443 3 1473.8217199  71510 303993466      993367        syn-C2H3C(O)NH2, v=0
  434880.5865  0.0013 -5.1640 3  473.4464121  71510 303601149      591148        syn-C2H3C(O)NH2, v=0
  434957.0253  0.0200 -3.2625 3  473.4464121 -71510 303601249      591148        syn-C2H3C(O)NH2, v=0
  435039.5845  0.0167 -4.4692 3  553.1163147  71510 30373 172      73 073        syn-C2H3C(O)NH2, v=0
  435039.5845  0.0167 -4.4692 3  553.1163147  71510 30373 272      73 173        syn-C2H3C(O)NH2, v=0
  435117.8150  0.0126 -4.5143 3 1180.4018175  71510 303873354      873255        syn-C2H3C(O)NH2, v=0
  435117.8156  0.0126 -4.5143 3 1180.4018175  71510 303873355      873256        syn-C2H3C(O)NH2, v=0
  435124.6076  0.0043 -4.8186 3  193.3148 77  71510 303381029      38 732        syn-C2H3C(O)NH2, v=0
  435126.1731  0.0200 -3.9124 3  816.9277139 -71510 303693237      693138        syn-C2H3C(O)NH2, v=0
  435126.1731  0.0200 -3.9124 3  816.9277139 -71510 303693238      693139        syn-C2H3C(O)NH2, v=0
  435343.0713  0.0016 -5.4886 3  590.1809119  71510 303592732      582731        syn-C2H3C(O)NH2, v=0
  435343.0713  0.0016 -5.4886 3  590.1809119  71510 303592733      582732        syn-C2H3C(O)NH2, v=0
  435413.1266  0.0112 -4.1177 3  756.5721163  71510 30381 675      81 576        syn-C2H3C(O)NH2, v=0
  435413.1266  0.0112 -4.1177 3  756.5721163  71510 30381 775      81 676        syn-C2H3C(O)NH2, v=0
  435481.0444  0.0025 -5.6218 3   86.9180 47  71510 303231211      23 914        syn-C2H3C(O)NH2, v=0
  435596.0230  0.0014 -3.4380 3  473.0987119  71510 303591346      581445        syn-C2H3C(O)NH2, v=0
  435605.5589  0.0025 -5.6216 3   86.9138 47  71510 303231212      23 915        syn-C2H3C(O)NH2, v=0
  435612.7511  0.0483 -5.5067 3 1722.0887217  71510 303A83573      A83474        syn-C2H3C(O)NH2, v=0
  435616.3755  0.0482 -5.5066 3 1722.0886217  71510 303A83574      A83475        syn-C2H3C(O)NH2, v=0
  435656.1731  0.0793 -5.9634 3 1962.2274233  71510 303B63680      B63581        syn-C2H3C(O)NH2, v=0
  435684.7557  0.0022 -5.5349 3   41.9832 35  71510 30317 9 9      16 610        syn-C2H3C(O)NH2, v=0
  435693.4163  0.0790 -5.9633 3 1962.2259233  71510 303B63681      B63582        syn-C2H3C(O)NH2, v=0
  435718.8805  0.0038 -3.8866 3  799.9475137  71510 303683236      683137        syn-C2H3C(O)NH2, v=0
  435718.8805  0.0038 -3.8866 3  799.9475137  71510 303683237      683138        syn-C2H3C(O)NH2, v=0
  435811.0007  0.0736 -5.2447 3 1550.5211217  71510 303A82088      A81989        syn-C2H3C(O)NH2, v=0
  435811.2419  0.0736 -5.2447 3 1550.5211217  71510 303A82188      A82089        syn-C2H3C(O)NH2, v=0
  435894.6653  0.0042 -4.5132 3  386.6612105  71510 303521636      521339        syn-C2H3C(O)NH2, v=0
  435928.4477  0.0013 -5.2387 3  492.5454117  71510 303581940      571939        syn-C2H3C(O)NH2, v=0
  435950.8775  0.0152 -4.2906 3  946.1052177  71510 303881078      88 979        syn-C2H3C(O)NH2, v=0
  435950.8775  0.0152 -4.2906 3  946.1052177  71510 303881178      881079        syn-C2H3C(O)NH2, v=0
  435956.9832  0.0015 -5.4537 3  577.9555119  71510 303592633      582632        syn-C2H3C(O)NH2, v=0
  435956.9832  0.0015 -5.4537 3  577.9555119  71510 303592634      582633        syn-C2H3C(O)NH2, v=0
  435959.7572  0.0013 -5.1560 3  466.3959119  71510 303591347      581346        syn-C2H3C(O)NH2, v=0
  435970.7013  0.0013 -5.2386 3  492.5470117  71510 303581939      571938        syn-C2H3C(O)NH2, v=0
  436278.9704  0.0119 -4.4751 3 1158.8220173  71510 303863353      863254        syn-C2H3C(O)NH2, v=0
  436278.9707  0.0119 -4.4751 3 1158.8220173  71510 303863354      863255        syn-C2H3C(O)NH2, v=0
  436285.2091  0.0036 -3.8617 3  783.2210135  71510 303673235      673136        syn-C2H3C(O)NH2, v=0
  436285.2091  0.0036 -3.8617 3  783.2210135  71510 303673236      673137        syn-C2H3C(O)NH2, v=0
  436386.7342  0.1232 -5.6645 3 1783.0921231  71510 303B52392      B52293        syn-C2H3C(O)NH2, v=0
  436391.1674  0.1232 -5.6645 3 1783.0922231  71510 303B52492      B52393        syn-C2H3C(O)NH2, v=0
  436493.4365  0.0200 -2.7264 3  141.4917 45 -71510 3032220 2      2119 3        syn-C2H3C(O)NH2, v=0
  436493.4365  0.0200 -2.7264 3  141.4917 45 -71510 3032220 3      2119 2        syn-C2H3C(O)NH2, v=0
  436525.8363  0.0022 -4.8485 3   62.8329 45  71510 30322 814      21 517        syn-C2H3C(O)NH2, v=0
  436575.7199  0.0259 -4.9966 3 1449.1262197  71510 303983464      983365        syn-C2H3C(O)NH2, v=0
  436575.8010  0.0259 -4.9966 3 1449.1262197  71510 303983465      983366        syn-C2H3C(O)NH2, v=0
  436614.5161  0.0013 -5.1470 3  458.5348117  71510 303581445      571444        syn-C2H3C(O)NH2, v=0
  436634.6226  0.0013 -5.1545 3  466.3369119  71510 303591247      581246        syn-C2H3C(O)NH2, v=0
  436635.5612  0.0059 -4.6895 3  275.1378 91  71510 303451134      45 837        syn-C2H3C(O)NH2, v=0
  436650.5891  0.0015 -5.4201 3  566.2354119  71510 303592535      582534        syn-C2H3C(O)NH2, v=0
  436650.5892  0.0015 -5.4201 3  566.2354119  71510 303592534      582533        syn-C2H3C(O)NH2, v=0
  436744.2842  0.0200 -2.9616 3  177.6076 69 -71510 303341421      331320        syn-C2H3C(O)NH2, v=0
  436752.7190  0.0200 -2.9615 3  177.6074 69 -71510 303341420      331321        syn-C2H3C(O)NH2, v=0
  436755.6251  0.1170 -5.9164 3 1575.0071211  71510 303A53076      A43173        syn-C2H3C(O)NH2, v=0
  436826.1701  0.0200 -3.8376 3  766.7478133 -71510 303663234      663135        syn-C2H3C(O)NH2, v=0
  436826.1701  0.0200 -3.8376 3  766.7478133 -71510 303663235      663136        syn-C2H3C(O)NH2, v=0
  436914.3280  0.0200 -2.7546 3  143.7338 49 -71510 3032419 5      2318 6        syn-C2H3C(O)NH2, v=0
  436914.3280  0.0200 -2.7546 3  143.7338 49 -71510 3032419 6      2318 5        syn-C2H3C(O)NH2, v=0
  436959.1503  0.0021 -5.5339 3   41.9407 35  71510 30317 9 8      16 611        syn-C2H3C(O)NH2, v=0
  436992.3110  0.0125 -4.1217 3  675.9714157  71510 30378 474      78 375        syn-C2H3C(O)NH2, v=0
  436992.3110  0.0125 -4.1217 3  675.9714157  71510 30378 574      78 475        syn-C2H3C(O)NH2, v=0
  437083.3160  0.0176 -4.3613 3 1001.0060181  71510 303901179      901080        syn-C2H3C(O)NH2, v=0
  437083.3160  0.0176 -4.3613 3 1001.0060181  71510 303901279      901180        syn-C2H3C(O)NH2, v=0
  437158.9082  0.0627 -5.1279 3 1484.6220213  71510 303A61987      A61888        syn-C2H3C(O)NH2, v=0
  437158.9793  0.0627 -5.1279 3 1484.6220213  71510 303A62087      A61988        syn-C2H3C(O)NH2, v=0
  437296.2614  0.0200 -2.7852 3  147.4547 53 -71510 3032618 8      2517 9        syn-C2H3C(O)NH2, v=0
  437296.2614  0.0200 -2.7852 3  147.4547 53 -71510 3032618 9      2517 8        syn-C2H3C(O)NH2, v=0
  437297.9259  0.0014 -5.1206 3  443.4137115  71510 303571344      561343        syn-C2H3C(O)NH2, v=0
  437305.4578  0.1730 -5.9842 3 1955.8834241  71510 303C02595      C02496        syn-C2H3C(O)NH2, v=0
  437328.0252  0.1728 -5.9842 3 1955.8835241  71510 303C02695      C02596        syn-C2H3C(O)NH2, v=0
  437338.1196  0.0026 -5.7350 3   81.2061 45  71510 303221210      22 913        syn-C2H3C(O)NH2, v=0
  437342.7348  0.0033 -3.8143 3  750.5277131  71510 303653233      653134        syn-C2H3C(O)NH2, v=0
  437342.7348  0.0033 -3.8143 3  750.5277131  71510 303653234      653135        syn-C2H3C(O)NH2, v=0
  437367.0728  0.0119 -4.1524 3  807.0202167  71510 30383 776      83 677        syn-C2H3C(O)NH2, v=0
  437367.0728  0.0119 -4.1524 3  807.0202167  71510 30383 876      83 777        syn-C2H3C(O)NH2, v=0
  437392.5650  0.0111 -4.4366 3 1137.5028171  71510 303853352      853253        syn-C2H3C(O)NH2, v=0
  437392.5652  0.0111 -4.4366 3 1137.5028171  71510 303853353      853254        syn-C2H3C(O)NH2, v=0
  437394.8434  0.0026 -5.7350 3   81.2042 45  71510 303221211      22 914        syn-C2H3C(O)NH2, v=0
  437441.2917  0.0015 -5.3878 3  555.0275119  71510 303592436      582435        syn-C2H3C(O)NH2, v=0
  437441.2920  0.0015 -5.3878 3  555.0275119  71510 303592435      582434        syn-C2H3C(O)NH2, v=0
  437548.2284  0.0200 -2.9045 3  167.6986 65 -71510 303321518      311417        syn-C2H3C(O)NH2, v=0
  437548.2284  0.0200 -2.9045 3  167.6986 65 -71510 303321517      311418        syn-C2H3C(O)NH2, v=0
  437594.9189  0.0200 -2.8193 3  152.6708 57 -71510 303281711      271612        syn-C2H3C(O)NH2, v=0
  437594.9189  0.0200 -2.8193 3  152.6708 57 -71510 303281712      271611        syn-C2H3C(O)NH2, v=0
  437729.2184  0.0013 -3.3252 3  466.3369119  71510 303591347      581246        syn-C2H3C(O)NH2, v=0
  437729.3746  0.0009 -2.8583 3  159.4064 61  71510 303301615      291514        syn-C2H3C(O)NH2, v=0
  437729.3750  0.0009 -2.8583 3  159.4064 61  71510 303301614      291515        syn-C2H3C(O)NH2, v=0
  437834.4620  0.0453 -5.4526 3 1695.0369215  71510 303A73572      A73473        syn-C2H3C(O)NH2, v=0
  437835.7463  0.0200 -3.7920 3  734.5602129 -71510 303643232      643133        syn-C2H3C(O)NH2, v=0
  437835.7463  0.0200 -3.7920 3  734.5602129 -71510 303643233      643134        syn-C2H3C(O)NH2, v=0
  437836.5022  0.0453 -5.4526 3 1695.0368215  71510 303A73573      A73474        syn-C2H3C(O)NH2, v=0
  437850.0838  0.0038 -4.7120 3  217.6430 81  71510 303401130      40 833        syn-C2H3C(O)NH2, v=0
  437863.8271  0.0154 -4.2577 3  598.3195151  71510 30375 273      75 174        syn-C2H3C(O)NH2, v=0
  437863.8271  0.0154 -4.2577 3  598.3195151  71510 30375 373      75 274        syn-C2H3C(O)NH2, v=0
  437993.8946  0.0204 -4.4386 3 1057.1556185  71510 303921280      921181        syn-C2H3C(O)NH2, v=0
  437993.8946  0.0204 -4.4386 3 1057.1556185  71510 303921380      921281        syn-C2H3C(O)NH2, v=0
  438071.4398  0.0013 -5.2127 3  484.6588117  71510 303581841      571840        syn-C2H3C(O)NH2, v=0
  438145.2022  0.0046 -6.1401 3  826.9106121  71510 303604119      594118        syn-C2H3C(O)NH2, v=0
  438145.2022  0.0046 -6.1401 3  826.9106121  71510 303604120      594119        syn-C2H3C(O)NH2, v=0
  438157.8374  0.0534 -5.0154 3 1419.9161209  71510 303A41886      A41787        syn-C2H3C(O)NH2, v=0
  438157.8574  0.0534 -5.0154 3 1419.9161209  71510 303A41986      A41887        syn-C2H3C(O)NH2, v=0
  438215.0694  0.0243 -4.9497 3 1424.6973195  71510 303973463      973364        syn-C2H3C(O)NH2, v=0
  438215.1121  0.0243 -4.9497 3 1424.6973195  71510 303973464      973365        syn-C2H3C(O)NH2, v=0
  438233.5115  0.1061 -5.6197 3 1422.2669201  71510 303A02872      992971        syn-C2H3C(O)NH2, v=0
  438282.3336  0.0022 -4.6712 3  217.6307 79  71510 303391327      391030        syn-C2H3C(O)NH2, v=0
  438306.1909  0.0030 -3.7705 3  718.8450127  71510 303633231      633132        syn-C2H3C(O)NH2, v=0
  438306.1909  0.0030 -3.7705 3  718.8450127  71510 303633232      633133        syn-C2H3C(O)NH2, v=0
  438352.2239  0.0041 -6.0822 3  807.9199121  71510 303604020      594019        syn-C2H3C(O)NH2, v=0
  438352.2239  0.0041 -6.0822 3  807.9199121  71510 303604021      594020        syn-C2H3C(O)NH2, v=0
  438352.2469  0.0014 -5.3568 3  544.3403119  71510 303592337      582336        syn-C2H3C(O)NH2, v=0
  438352.2520  0.0014 -5.3568 3  544.3403119  71510 303592336      582335        syn-C2H3C(O)NH2, v=0
  438396.9082  0.0013 -5.2121 3  484.6734117  71510 303581840      571839        syn-C2H3C(O)NH2, v=0
  438442.0487  0.0740 -5.9036 3 1933.0643231  71510 303B53679      B53580        syn-C2H3C(O)NH2, v=0
  438460.6080  0.0105 -4.3988 3 1116.4438169  71510 303843351      843252        syn-C2H3C(O)NH2, v=0
  438460.6081  0.0105 -4.3988 3 1116.4438169  71510 303843352      843253        syn-C2H3C(O)NH2, v=0
  438463.9556  0.0739 -5.9035 3 1933.0635231  71510 303B53680      B53581        syn-C2H3C(O)NH2, v=0
  438571.0055  0.0037 -6.0264 3  789.4042121  71510 303603921      593920        syn-C2H3C(O)NH2, v=0
  438571.0055  0.0037 -6.0264 3  789.4042121  71510 303603922      593921        syn-C2H3C(O)NH2, v=0
  438672.9107  0.0238 -4.5219 3 1114.5478189  71510 303941381      941282        syn-C2H3C(O)NH2, v=0
  438672.9107  0.0238 -4.5219 3 1114.5478189  71510 303941481      941382        syn-C2H3C(O)NH2, v=0
  438690.9442  0.0023 -4.6412 3  227.6586 81  71510 303401328      401031        syn-C2H3C(O)NH2, v=0
  438699.8122  0.0062 -4.6272 3  315.4063 97  71510 303481236      48 939        syn-C2H3C(O)NH2, v=0
  438754.8358  0.0200 -3.7500 3  703.3817125 -71510 303623230      623131        syn-C2H3C(O)NH2, v=0
  438754.8358  0.0200 -3.7500 3  703.3817125 -71510 303623231      623132        syn-C2H3C(O)NH2, v=0
  438802.9721  0.0033 -5.9726 3  771.3643121  71510 303603822      593821        syn-C2H3C(O)NH2, v=0
  438802.9721  0.0033 -5.9726 3  771.3643121  71510 303603823      593822        syn-C2H3C(O)NH2, v=0
  438832.5464  0.0454 -4.9072 3 1356.4112205  71510 303A21785      A21686        syn-C2H3C(O)NH2, v=0
  438832.5518  0.0454 -4.9072 3 1356.4112205  71510 303A21885      A21786        syn-C2H3C(O)NH2, v=0
  438837.1468  0.1057 -5.5342 3 1713.0477227  71510 303B32291      B32192        syn-C2H3C(O)NH2, v=0
  438838.5980  0.1057 -5.5342 3 1713.0477227  71510 303B32391      B32292        syn-C2H3C(O)NH2, v=0
  438873.3548  0.0039 -4.5849 3   73.0413 53  71510 30326 323      25 224        syn-C2H3C(O)NH2, v=0
  438909.3498  0.0019 -5.1756 3  520.5047139  71510 30369 366      68 365        syn-C2H3C(O)NH2, v=0
  438909.3498  0.0200 -3.0195 3  520.5047139 -71510 30369 366      68 465        syn-C2H3C(O)NH2, v=0
  438909.3498  0.0200 -3.0195 3  520.5047139 -71510 30369 466      68 365        syn-C2H3C(O)NH2, v=0
  438909.3498  0.0019 -5.1756 3  520.5047139  71510 30369 466      68 465        syn-C2H3C(O)NH2, v=0
  438913.0793  0.0021 -5.1702 3  522.0603141  71510 30370 268      69 267        syn-C2H3C(O)NH2, v=0
  438913.0845  0.0200 -2.9974 3  522.0603141 -71510 30370 268      69 367        syn-C2H3C(O)NH2, v=0
  438913.0845  0.0200 -2.9974 3  522.0603141 -71510 30370 368      69 267        syn-C2H3C(O)NH2, v=0
  438913.0793  0.0021 -5.1702 3  522.0603141  71510 30370 368      69 367        syn-C2H3C(O)NH2, v=0
  438917.0522  0.0018 -5.1800 3  518.4261137  71510 30368 464      67 463        syn-C2H3C(O)NH2, v=0
  438917.0699  0.0200 -3.0422 3  518.4261137 -71510 30368 464      67 563        syn-C2H3C(O)NH2, v=0
  438917.0699  0.0200 -3.0422 3  518.4261137 -71510 30368 564      67 463        syn-C2H3C(O)NH2, v=0
  438917.0522  0.0018 -5.1800 3  518.4261137  71510 30368 564      67 563        syn-C2H3C(O)NH2, v=0
  438921.5217  0.0039 -4.5849 3   73.0413 53  71510 30326 423      25 124        syn-C2H3C(O)NH2, v=0
  438922.6786  0.0028 -5.1638 3  523.1007143  71510 30371 170      70 169        syn-C2H3C(O)NH2, v=0
  438922.6776  0.0200 -2.9758 3  523.1007143 -71510 30371 170      70 269        syn-C2H3C(O)NH2, v=0
  438922.6776  0.0200 -2.9758 3  523.1007143 -71510 30371 270      70 169        syn-C2H3C(O)NH2, v=0
  438922.6786  0.0028 -5.1638 3  523.1007143  71510 30371 270      70 269        syn-C2H3C(O)NH2, v=0
  438924.8235  0.0026 -5.8584 3   75.7548 43  71510 3032112 9      21 912        syn-C2H3C(O)NH2, v=0
  438934.0803  0.0039 -5.1564 3  523.6324145  71510 30372 072      71 071        syn-C2H3C(O)NH2, v=0
  438934.0633  0.0200 -2.9545 3  523.6324145 -71510 30372 072      71 171        syn-C2H3C(O)NH2, v=0
  438934.0633  0.0200 -2.9545 3  523.6324145 -71510 30372 172      71 071        syn-C2H3C(O)NH2, v=0
  438934.0803  0.0039 -5.1564 3  523.6324145  71510 30372 172      71 171        syn-C2H3C(O)NH2, v=0
  438943.9173  0.0018 -5.1833 3  515.8149135  71510 30367 562      66 561        syn-C2H3C(O)NH2, v=0
  438943.9619  0.0200 -3.0659 3  515.8149135 -71510 30367 562      66 661        syn-C2H3C(O)NH2, v=0
  438943.9619  0.0200 -3.0659 3  515.8149135 -71510 30367 662      66 561        syn-C2H3C(O)NH2, v=0
  438943.9173  0.0018 -5.1833 3  515.8149135  71510 30367 662      66 661        syn-C2H3C(O)NH2, v=0
  438948.8079  0.0082 -4.0390 3  643.1703137  71510 303681751      671850        syn-C2H3C(O)NH2, v=0
  438949.4518  0.0026 -5.8584 3   75.7540 43  71510 303211210      21 913        syn-C2H3C(O)NH2, v=0
  439000.9119  0.0018 -5.1855 3  512.6589133  71510 30366 660      65 659        syn-C2H3C(O)NH2, v=0
  439000.9223  0.0200 -3.0909 3  512.6589133 -71510 30366 660      65 759        syn-C2H3C(O)NH2, v=0
  439000.9223  0.0200 -3.0909 3  512.6589133 -71510 30366 760      65 659        syn-C2H3C(O)NH2, v=0
  439000.9119  0.0018 -5.1855 3  512.6589133  71510 30366 760      65 759        syn-C2H3C(O)NH2, v=0
  439036.8749  0.0016 -5.1131 3  437.0469113  71510 303561541      551540        syn-C2H3C(O)NH2, v=0
  439049.7564  0.0030 -5.9207 3  753.8012121  71510 303603723      593722        syn-C2H3C(O)NH2, v=0
  439049.7564  0.0030 -5.9207 3  753.8012121  71510 303603724      593723        syn-C2H3C(O)NH2, v=0
  439103.9916  0.0200 -3.1177 3  508.9429131 -71510 30365 758      64 857        syn-C2H3C(O)NH2, v=0
  439104.0035  0.0018 -5.1865 3  508.9429131  71510 30365 858      64 857        syn-C2H3C(O)NH2, v=0
  439104.0036  0.0018 -5.1865 3  508.9429131  71510 30365 758      64 757        syn-C2H3C(O)NH2, v=0
  439103.9916  0.0200 -3.1177 3  508.9429131 -71510 30365 858      64 757        syn-C2H3C(O)NH2, v=0
  439109.4585  0.0279 -4.6107 3 1173.1762193  71510 303961482      961383        syn-C2H3C(O)NH2, v=0
  439109.4586  0.0279 -4.6107 3 1173.1762193  71510 303961582      961483        syn-C2H3C(O)NH2, v=0
  439132.0183  0.0130 -4.1990 3  858.7416171  71510 30385 877      85 778        syn-C2H3C(O)NH2, v=0
  439132.0183  0.0130 -4.1990 3  858.7416171  71510 30385 977      85 878        syn-C2H3C(O)NH2, v=0
  439160.5302  0.1265 -5.9115 3 1575.0001211  71510 303A53075      A43174        syn-C2H3C(O)NH2, v=0
  439168.1223  0.0022 -4.7070 3  207.8290 77  71510 303381326      381029        syn-C2H3C(O)NH2, v=0
  439172.6377  0.0595 -4.8996 3 1042.1650173  71510 303862363      852462        syn-C2H3C(O)NH2, v=0
  439182.4287  0.0028 -3.7304 3  688.1701123  71510 303613229      613130        syn-C2H3C(O)NH2, v=0
  439182.4287  0.0028 -3.7304 3  688.1701123  71510 303613230      613131        syn-C2H3C(O)NH2, v=0
  439204.2361  0.0385 -4.8036 3 1294.1148201  71510 303A01684      A01585        syn-C2H3C(O)NH2, v=0
  439204.2375  0.0385 -4.8036 3 1294.1148201  71510 303A01784      A01685        syn-C2H3C(O)NH2, v=0
  439277.2302  0.0200 -3.1471 3  504.6470129 -71510 30364 856      63 955        syn-C2H3C(O)NH2, v=0
  439277.2441  0.0017 -5.1861 3  504.6470129  71510 30364 956      63 955        syn-C2H3C(O)NH2, v=0
  439277.2466  0.0017 -5.1861 3  504.6470129  71510 30364 856      63 855        syn-C2H3C(O)NH2, v=0
  439277.2302  0.0200 -3.1471 3  504.6470129 -71510 30364 956      63 855        syn-C2H3C(O)NH2, v=0
  439291.2246  0.0328 -4.7047 3 1233.0341197  71510 303981583      981484        syn-C2H3C(O)NH2, v=0
  439291.2249  0.0328 -4.7047 3 1233.0341197  71510 303981683      981584        syn-C2H3C(O)NH2, v=0
  439313.2384  0.0028 -5.8706 3  736.7158121  71510 303603624      593623        syn-C2H3C(O)NH2, v=0
  439313.2384  0.0028 -5.8706 3  736.7158121  71510 303603625      593624        syn-C2H3C(O)NH2, v=0
  439314.5821  0.0122 -4.1218 3  724.4593161  71510 30380 575      80 476        syn-C2H3C(O)NH2, v=0
  439314.5821  0.0122 -4.1218 3  724.4593161  71510 30380 675      80 576        syn-C2H3C(O)NH2, v=0
  439368.9784  0.0030 -4.9091 3  171.3992 69  71510 303341321      341024        syn-C2H3C(O)NH2, v=0
  439415.2402  0.0014 -5.3270 3  534.1848119  71510 303592238      582237        syn-C2H3C(O)NH2, v=0
  439415.3099  0.0014 -5.3270 3  534.1848119  71510 303592237      582236        syn-C2H3C(O)NH2, v=0
  439484.9908  0.0099 -4.3618 3 1095.6443167  71510 303833350      833251        syn-C2H3C(O)NH2, v=0
  439484.9909  0.0099 -4.3618 3 1095.6443167  71510 303833351      833252        syn-C2H3C(O)NH2, v=0
  439522.1767  0.0066 -4.5753 3  358.3057103  71510 303511338      511041        syn-C2H3C(O)NH2, v=0
  439542.3860  0.0032 -3.3782 3  330.0397 99  71510 303491337      481236        syn-C2H3C(O)NH2, v=0
  439558.5691  0.0200 -3.1799 3  499.7446127 -71510 30363 954      621053        syn-C2H3C(O)NH2, v=0
  439558.5326  0.0016 -5.1844 3  499.7446127  71510 303631054      621053        syn-C2H3C(O)NH2, v=0
  439558.6080  0.0016 -5.1844 3  499.7445127  71510 30363 954      62 953        syn-C2H3C(O)NH2, v=0
  439558.5691  0.0200 -3.1799 3  499.7445127 -71510 303631054      62 953        syn-C2H3C(O)NH2, v=0
  439589.8465  0.0027 -3.7117 3  673.2099121  71510 303603228      603129        syn-C2H3C(O)NH2, v=0
  439589.8465  0.0027 -3.7117 3  673.2099121  71510 303603229      603130        syn-C2H3C(O)NH2, v=0
  439595.5929  0.0025 -5.8223 3  720.1092121  71510 303603525      593524        syn-C2H3C(O)NH2, v=0
  439595.5929  0.0025 -5.8223 3  720.1092121  71510 303603526      593525        syn-C2H3C(O)NH2, v=0
  439625.7683  0.0479 -4.7575 3  969.0387167  71510 303832261      822360        syn-C2H3C(O)NH2, v=0
  439754.3452  0.0714 -5.0423 3 1117.9446179  71510 303892465      882564        syn-C2H3C(O)NH2, v=0
  439762.0832  0.1040 -5.7874 3 1510.5798207  71510 303A32975      A23072        syn-C2H3C(O)NH2, v=0
  439786.6986  0.0229 -4.9035 3 1400.5342193  71510 303963462      963363        syn-C2H3C(O)NH2, v=0
  439786.7209  0.0229 -4.9035 3 1400.5342193  71510 303963463      963364        syn-C2H3C(O)NH2, v=0
  439899.3500  0.0024 -5.7756 3  703.9829121  71510 303603426      593425        syn-C2H3C(O)NH2, v=0
  439899.3500  0.0024 -5.7756 3  703.9829121  71510 303603427      593426        syn-C2H3C(O)NH2, v=0
  439949.2427  0.0069 -4.5339 3  403.8261109  71510 303541440      541143        syn-C2H3C(O)NH2, v=0
  439957.6612  0.0015 -5.1496 3  456.7200115  71510 303571641      561640        syn-C2H3C(O)NH2, v=0
  439958.7601  0.0426 -5.3993 3 1668.2568213  71510 303A63571      A63472        syn-C2H3C(O)NH2, v=0
  439959.8979  0.0426 -5.3993 3 1668.2568213  71510 303A63572      A63473        syn-C2H3C(O)NH2, v=0
  439977.8129  0.0200 -3.6941 3  658.5007119 -71510 303593227      593128        syn-C2H3C(O)NH2, v=0
  439977.8129  0.0200 -3.6941 3  658.5007119 -71510 303593228      593129        syn-C2H3C(O)NH2, v=0
  440008.7021  0.0200 -3.2180 3  494.1986125 -71510 303621052      611151        syn-C2H3C(O)NH2, v=0
  440010.9219  0.0015 -5.1809 3  494.1986125  71510 303621152      611151        syn-C2H3C(O)NH2, v=0
  440012.6973  0.0015 -5.1809 3  494.1984125  71510 303621052      611051        syn-C2H3C(O)NH2, v=0
  440014.9546  0.0200 -3.2180 3  494.1984125 -71510 303621152      611051        syn-C2H3C(O)NH2, v=0
  440158.3170  0.0048 -3.8604 3  122.8095 63  71510 30331 724      30 625        syn-C2H3C(O)NH2, v=0
  440227.4704  0.0022 -5.7307 3  688.3381121  71510 303603327      593326        syn-C2H3C(O)NH2, v=0
  440227.4704  0.0022 -5.7307 3  688.3381121  71510 303603328      593327        syn-C2H3C(O)NH2, v=0
  440280.6887  0.0026 -5.9936 3   70.5618 41  71510 3032012 8      20 911        syn-C2H3C(O)NH2, v=0
  440290.8376  0.0026 -5.9936 3   70.5615 41  71510 3032012 9      20 912        syn-C2H3C(O)NH2, v=0
  440347.0271  0.0200 -3.6775 3  644.0422117 -71510 303583226      583127        syn-C2H3C(O)NH2, v=0
  440347.0271  0.0200 -3.6775 3  644.0422117 -71510 303583227      583128        syn-C2H3C(O)NH2, v=0
  440384.9760  0.0022 -5.3974 3   46.2542 37  71510 30318 910      17 611        syn-C2H3C(O)NH2, v=0
  440390.2630  0.0039 -4.1144 3   93.8530 57  71510 30328 523      27 424        syn-C2H3C(O)NH2, v=0
  440440.8857  0.0013 -5.1881 3  477.4261117  71510 303581742      571741        syn-C2H3C(O)NH2, v=0
  440467.4974  0.0093 -4.3256 3 1075.1039165  71510 303823349      823250        syn-C2H3C(O)NH2, v=0
  440467.4975  0.0093 -4.3256 3 1075.1039165  71510 303823350      823251        syn-C2H3C(O)NH2, v=0
  440526.3577  0.0144 -4.1741 3  644.8244155  71510 30377 374      77 275        syn-C2H3C(O)NH2, v=0
  440526.3577  0.0144 -4.1741 3  644.8244155  71510 30377 474      77 375        syn-C2H3C(O)NH2, v=0
  440583.4427  0.0021 -5.6873 3  673.1768121  71510 303603228      593227        syn-C2H3C(O)NH2, v=0
  440583.4427  0.0021 -5.6873 3  673.1768121  71510 303603229      593228        syn-C2H3C(O)NH2, v=0
  440594.0888  0.1491 -5.8449 3 1882.9092237  71510 303B82494      B82395        syn-C2H3C(O)NH2, v=0
  440601.9423  0.1490 -5.8449 3 1882.9093237  71510 303B82594      B82495        syn-C2H3C(O)NH2, v=0
  440610.5830  0.0200 -3.0498 3  198.2767 75 -71510 303371325      361224        syn-C2H3C(O)NH2, v=0
  440619.4452  0.0024 -4.6179 3  237.9060 83  71510 303411329      411032        syn-C2H3C(O)NH2, v=0
  440675.5232  0.0014 -5.2983 3  524.5759119  71510 303592139      582138        syn-C2H3C(O)NH2, v=0
  440676.3533  0.0014 -5.2983 3  524.5759119  71510 303592138      582137        syn-C2H3C(O)NH2, v=0
  440695.1772  0.0200 -3.2644 3  487.9550123 -71510 303611150      601249        syn-C2H3C(O)NH2, v=0
  440698.2641  0.0024 -3.6619 3  629.8341115  71510 303573225      573126        syn-C2H3C(O)NH2, v=0
  440698.2641  0.0024 -3.6619 3  629.8341115  71510 303573226      573127        syn-C2H3C(O)NH2, v=0
  440701.9102  0.0146 -4.2554 3  911.7303175  71510 30387 978      87 879        syn-C2H3C(O)NH2, v=0
  440701.9102  0.0146 -4.2554 3  911.7303175  71510 303871078      87 979        syn-C2H3C(O)NH2, v=0
  440712.8737  0.0369 -4.6149 3  898.5652161  71510 303802159      792258        syn-C2H3C(O)NH2, v=0
  440725.9272  0.0566 -5.4607 3 1326.2127195  71510 303972672      962769        syn-C2H3C(O)NH2, v=0
  440739.5534  0.0014 -5.1753 3  487.9550123  71510 303611250      601249        syn-C2H3C(O)NH2, v=0
  440771.6094  0.0014 -5.1753 3  487.9525123  71510 303611150      601149        syn-C2H3C(O)NH2, v=0
  440815.9731  0.0200 -3.2641 3  487.9525123 -71510 303611250      601149        syn-C2H3C(O)NH2, v=0
  440852.5004  0.0905 -5.4081 3 1644.1721223  71510 303B12190      B12091        syn-C2H3C(O)NH2, v=0
  440852.9576  0.0905 -5.4081 3 1644.1721223  71510 303B12290      B12191        syn-C2H3C(O)NH2, v=0
  440938.5142  0.0070 -4.5046 3  451.9565115  71510 303571542      571245        syn-C2H3C(O)NH2, v=0
  440955.0990  0.0044 -3.6172 3  162.8473 71  71510 30335 926      34 827        syn-C2H3C(O)NH2, v=0
  440971.4068  0.0020 -5.6455 3  658.5007121  71510 303603129      593128        syn-C2H3C(O)NH2, v=0
  440971.4068  0.0020 -5.6455 3  658.5007121  71510 303603130      593129        syn-C2H3C(O)NH2, v=0
  441032.1432  0.0200 -3.6475 3  615.8762113 -71510 303563224      563125        syn-C2H3C(O)NH2, v=0
  441032.1432  0.0200 -3.6475 3  615.8762113 -71510 303563225      563126        syn-C2H3C(O)NH2, v=0
  441032.4123  0.0013 -5.1529 3  464.6628117  71510 303581544      571543        syn-C2H3C(O)NH2, v=0
  441044.9093  0.0057 -4.9900 3  178.8114 75  71510 30337 829      37 532        syn-C2H3C(O)NH2, v=0
  441066.5344  0.0180 -4.4888 3  568.1605149  71510 30374 173      74 074        syn-C2H3C(O)NH2, v=0
  441066.5344  0.0180 -4.4888 3  568.1605149  71510 30374 273      74 174        syn-C2H3C(O)NH2, v=0
  441094.4524  0.0692 -5.8446 3 1904.1787229  71510 303B43678      B43579        syn-C2H3C(O)NH2, v=0
  441100.6188  0.0022 -4.7482 3  198.2603 75  71510 303371325      371028        syn-C2H3C(O)NH2, v=0
  441107.2194  0.0692 -5.8446 3 1904.1782229  71510 303B43679      B43580        syn-C2H3C(O)NH2, v=0
  441164.5485  0.0039 -4.3073 3   83.3162 55  71510 30327 423      26 324        syn-C2H3C(O)NH2, v=0
  441170.2446  0.0200 -3.3267 3  480.9380121 -71510 303601248      591347        syn-C2H3C(O)NH2, v=0
  441293.9348  0.0216 -4.8580 3 1376.6363191  71510 303953461      953362        syn-C2H3C(O)NH2, v=0
  441293.9463  0.0216 -4.8580 3 1376.6363191  71510 303953462      953363        syn-C2H3C(O)NH2, v=0
  441349.3440  0.0200 -3.6342 3  602.1681111 -71510 303553223      553124        syn-C2H3C(O)NH2, v=0
  441349.3440  0.0200 -3.6342 3  602.1681111 -71510 303553224      553125        syn-C2H3C(O)NH2, v=0
  441396.3176  0.0019 -5.6052 3  644.3122121  71510 303603030      593029        syn-C2H3C(O)NH2, v=0
  441396.3176  0.0019 -5.6052 3  644.3122121  71510 303603031      593030        syn-C2H3C(O)NH2, v=0
  441409.8133  0.0087 -4.2901 3 1054.8220163  71510 303813348      813249        syn-C2H3C(O)NH2, v=0
  441409.8133  0.0087 -4.2901 3 1054.8220163  71510 303813349      813250        syn-C2H3C(O)NH2, v=0
  441425.8824  0.0200 -3.0484 3  198.2539 75 -71510 303371324      361225        syn-C2H3C(O)NH2, v=0
  441436.7491  0.0027 -6.1429 3   65.6254 39  71510 3031912 7      19 910        syn-C2H3C(O)NH2, v=0
  441440.6976  0.0027 -6.1429 3   65.6252 39  71510 3031912 8      19 911        syn-C2H3C(O)NH2, v=0
  441460.9531  0.0124 -4.1427 3  774.2320165  71510 30382 676      82 577        syn-C2H3C(O)NH2, v=0
  441460.9531  0.0124 -4.1427 3  774.2320165  71510 30382 776      82 677        syn-C2H3C(O)NH2, v=0
  441554.8732  0.0038 -4.3068 3   83.3162 55  71510 30327 523      26 224        syn-C2H3C(O)NH2, v=0
  441574.7273  0.0833 -5.1868 3 1196.3772185  71510 303922567      912666        syn-C2H3C(O)NH2, v=0
  441648.9746  0.0125 -4.1819 3  703.0488143  71510 303711853      701952        syn-C2H3C(O)NH2, v=0
  441650.4645  0.0200 -3.6221 3  588.7096109 -71510 303543222      543123        syn-C2H3C(O)NH2, v=0
  441650.4645  0.0200 -3.6221 3  588.7096109 -71510 303543223      543124        syn-C2H3C(O)NH2, v=0
  441752.8550  0.0048 -3.7476 3  142.2176 67  71510 30333 825      32 726        syn-C2H3C(O)NH2, v=0
  441782.1712  0.0014 -5.1350 3  458.0004117  71510 303581345      571344        syn-C2H3C(O)NH2, v=0
  441839.5277  0.0013 -5.1673 3  480.9380121  71510 303601348      591347        syn-C2H3C(O)NH2, v=0
  441863.9476  0.0270 -4.4713 3  830.7437155  71510 303772057      762156        syn-C2H3C(O)NH2, v=0
  441864.1610  0.0018 -5.5664 3  630.6141121  71510 303602931      592930        syn-C2H3C(O)NH2, v=0
  441864.1610  0.0018 -5.5664 3  630.6141121  71510 303602932      592931        syn-C2H3C(O)NH2, v=0
  441936.2341  0.0200 -3.6113 3  575.5005107 -71510 303533221      533122        syn-C2H3C(O)NH2, v=0
  441936.2341  0.0200 -3.6113 3  575.5005107 -71510 303533222      533123        syn-C2H3C(O)NH2, v=0
  441991.5479  0.0400 -5.3469 3 1641.7476211  71510 303A53570      A53471        syn-C2H3C(O)NH2, v=0
  441992.1764  0.0400 -5.3469 3 1641.7476211  71510 303A53571      A53472        syn-C2H3C(O)NH2, v=0
  442036.4703  0.0013 -5.1669 3  470.8262117  71510 303581643      571642        syn-C2H3C(O)NH2, v=0
  442070.0498  0.0166 -4.3201 3  965.9804179  71510 303891079      89 980        syn-C2H3C(O)NH2, v=0
  442070.0498  0.0166 -4.3201 3  965.9804179  71510 303891179      891080        syn-C2H3C(O)NH2, v=0
  442108.4192  0.0035 -3.4733 3  184.7088 75  71510 303371027      36 928        syn-C2H3C(O)NH2, v=0
  442199.1126  0.0013 -5.2707 3  515.5336119  71510 303592040      582039        syn-C2H3C(O)NH2, v=0
  442207.0439  0.0200 -3.6018 3  562.5404105 -71510 303523220      523121        syn-C2H3C(O)NH2, v=0
  442207.0439  0.0200 -3.6018 3  562.5404105 -71510 303523221      523122        syn-C2H3C(O)NH2, v=0
  442207.6765  0.0013 -5.2707 3  515.5339119  71510 303592039      582038        syn-C2H3C(O)NH2, v=0
  442221.0223  0.0013 -5.0936 3  433.0015113  71510 303561442      551441        syn-C2H3C(O)NH2, v=0
  442247.2811  0.0023 -4.2584 3   97.6203 55  71510 30327 919      26 620        syn-C2H3C(O)NH2, v=0
  442264.8250  0.0013 -5.1664 3  480.9015121  71510 303601248      591247        syn-C2H3C(O)NH2, v=0
  442267.8683  0.0897 -5.6650 3 1447.6236203  71510 303A12874      A02971        syn-C2H3C(O)NH2, v=0
  442313.5335  0.0082 -4.2553 3 1034.7982161  71510 303803347      803248        syn-C2H3C(O)NH2, v=0
  442313.5335  0.0082 -4.2553 3 1034.7982161  71510 303803348      803249        syn-C2H3C(O)NH2, v=0
  442359.4070  0.0026 -4.3943 3   90.8570 53  71510 30326 918      25 619        syn-C2H3C(O)NH2, v=0
  442382.2474  0.0017 -5.5290 3  617.4095121  71510 303602832      592831        syn-C2H3C(O)NH2, v=0
  442382.2474  0.0017 -5.5290 3  617.4095121  71510 303602833      592832        syn-C2H3C(O)NH2, v=0
  442406.9994  0.0188 -4.3266 3  765.5723149  71510 303741955      732054        syn-C2H3C(O)NH2, v=0
  442416.8928  0.0014 -5.1844 3  477.5304117  71510 303581741      571740        syn-C2H3C(O)NH2, v=0
  442463.7103  0.0200 -3.5938 3  549.8291103 -71510 303513219      513120        syn-C2H3C(O)NH2, v=0
  442463.7103  0.0200 -3.5938 3  549.8291103 -71510 303513220      513121        syn-C2H3C(O)NH2, v=0
  442471.6722  0.0775 -5.2860 3 1576.4744219  71510 303A92089      A91990        syn-C2H3C(O)NH2, v=0
  442471.8107  0.0775 -5.2860 3 1576.4744219  71510 303A92189      A92090        syn-C2H3C(O)NH2, v=0
  442706.6093  0.0200 -3.5872 3  537.3663101 -71510 303503218      503119        syn-C2H3C(O)NH2, v=0
  442706.6093  0.0200 -3.5872 3  537.3663101 -71510 303503219      503120        syn-C2H3C(O)NH2, v=0
  442739.8581  0.0203 -4.8134 3 1353.0027189  71510 303943460      943361        syn-C2H3C(O)NH2, v=0
  442739.8640  0.0203 -4.8134 3 1353.0027189  71510 303943461      943362        syn-C2H3C(O)NH2, v=0
  442745.0246  0.0037 -4.1113 3   93.8521 57  71510 30328 623      27 324        syn-C2H3C(O)NH2, v=0
  442783.0769  0.0013 -5.1577 3  473.0987119  71510 303591446      581445        syn-C2H3C(O)NH2, v=0
  442812.0501  0.0200 -3.1742 3  212.2827 79 -71510 303391227      381128        syn-C2H3C(O)NH2, v=0
  442869.8256  0.0021 -5.3958 3   46.1714 37  71510 30318 9 9      17 612        syn-C2H3C(O)NH2, v=0
  442934.1051  0.0200 -3.3230 3  480.9015121 -71510 303601348      591247        syn-C2H3C(O)NH2, v=0
  442936.4542  0.0200 -3.5823 3  525.1519 99 -71510 303493217      493118        syn-C2H3C(O)NH2, v=0
  442936.4542  0.0200 -3.5823 3  525.1519 99 -71510 303493218      493119        syn-C2H3C(O)NH2, v=0
  442959.6171  0.0017 -5.4930 3  604.7024121  71510 303602733      592732        syn-C2H3C(O)NH2, v=0
  442959.6171  0.0017 -5.4930 3  604.7024121  71510 303602734      592733        syn-C2H3C(O)NH2, v=0
  443023.6344  0.0137 -4.1446 3  692.6253159  71510 30379 475      79 376        syn-C2H3C(O)NH2, v=0
  443023.6344  0.0137 -4.1446 3  692.6253159  71510 30379 575      79 476        syn-C2H3C(O)NH2, v=0
  443153.6015  0.0200 -3.5792 3  513.1855 97 -71510 303483216      483117        syn-C2H3C(O)NH2, v=0
  443153.6015  0.0200 -3.5792 3  513.1855 97 -71510 303483217      483118        syn-C2H3C(O)NH2, v=0
  443180.1698  0.0078 -4.2213 3 1015.0319159  71510 303793346      793247        syn-C2H3C(O)NH2, v=0
  443180.1698  0.0078 -4.2213 3 1015.0319159  71510 303793347      793248        syn-C2H3C(O)NH2, v=0
  443210.5856  0.0736 -5.5535 3 1386.1574199  71510 303992773      982870        syn-C2H3C(O)NH2, v=0
  443229.0028  0.0191 -4.3921 3 1021.4860183  71510 303911180      911081        syn-C2H3C(O)NH2, v=0
  443229.0028  0.0191 -4.3921 3 1021.4860183  71510 303911280      911181        syn-C2H3C(O)NH2, v=0
  443342.1526  0.0200 -2.6973 3  145.5834 43 -71510 3032121 0      2020 1        syn-C2H3C(O)NH2, v=0
  443342.1526  0.0200 -2.6973 3  145.5834 43 -71510 3032121 1      2020 0        syn-C2H3C(O)NH2, v=0
  443358.7283  0.0200 -3.5779 3  501.4670 95 -71510 303473215      473116        syn-C2H3C(O)NH2, v=0
  443358.7283  0.0200 -3.5779 3  501.4670 95 -71510 303473216      473117        syn-C2H3C(O)NH2, v=0
  443368.4910  0.1284 -5.7096 3 1811.0866233  71510 303B62393      B62294        syn-C2H3C(O)NH2, v=0
  443371.1251  0.1283 -5.7096 3 1811.0866233  71510 303B62493      B62394        syn-C2H3C(O)NH2, v=0
  443426.6230  0.0132 -4.1787 3  825.2838169  71510 30384 777      84 678        syn-C2H3C(O)NH2, v=0
  443426.6230  0.0132 -4.1787 3  825.2838169  71510 30384 877      84 778        syn-C2H3C(O)NH2, v=0
  443509.0125  0.0069 -4.4906 3  502.6842121  71510 303601644      601347        syn-C2H3C(O)NH2, v=0
  443547.3730  0.0027 -5.8356 3   95.0534 53  71510 303261016      26 521        syn-C2H3C(O)NH2, v=0
  443552.1937  0.0200 -3.5788 3  489.9961 93 -71510 303463214      463115        syn-C2H3C(O)NH2, v=0
  443552.1937  0.0200 -3.5788 3  489.9961 93 -71510 303463215      463116        syn-C2H3C(O)NH2, v=0
  443574.5959  0.0200 -2.9678 3  186.0549 71 -71510 303351422      341321        syn-C2H3C(O)NH2, v=0
  443592.9333  0.0200 -2.9677 3  186.0544 71 -71510 303351421      341322        syn-C2H3C(O)NH2, v=0
  443607.6158  0.0016 -5.4584 3  592.4974121  71510 303602634      592633        syn-C2H3C(O)NH2, v=0
  443607.6158  0.0016 -5.4584 3  592.4974121  71510 303602635      592634        syn-C2H3C(O)NH2, v=0
  443623.7625  0.0649 -5.7865 3 1875.5691227  71510 303B33677      B33578        syn-C2H3C(O)NH2, v=0
  443630.1689  0.0033 -3.9683 3  104.6195 59  71510 30329 723      28 424        syn-C2H3C(O)NH2, v=0
  443631.1348  0.0649 -5.7865 3 1875.5688227  71510 303B33678      B33579        syn-C2H3C(O)NH2, v=0
  443646.4246  0.0028 -4.5329 3   84.3183 51  71510 30325 917      24 618        syn-C2H3C(O)NH2, v=0
  443726.7966  0.0662 -5.1681 3 1509.9632215  71510 303A71988      A71889        syn-C2H3C(O)NH2, v=0
  443726.8369  0.0662 -5.1681 3 1509.9632215  71510 303A72088      A71989        syn-C2H3C(O)NH2, v=0
  443734.6081  0.0200 -3.5819 3  478.7725 91 -71510 303453213      453114        syn-C2H3C(O)NH2, v=0
  443734.6081  0.0200 -3.5819 3  478.7725 91 -71510 303453214      453115        syn-C2H3C(O)NH2, v=0
  443774.9601  0.0200 -2.7242 3  146.8510 47 -71510 3032320 3      2219 4        syn-C2H3C(O)NH2, v=0
  443774.9601  0.0200 -2.7242 3  146.8510 47 -71510 3032320 4      2219 3        syn-C2H3C(O)NH2, v=0
  443825.4470  0.0022 -4.7939 3  188.9318 73  71510 303361324      361027        syn-C2H3C(O)NH2, v=0
  443889.6625  0.0167 -4.2786 3  613.9675153  71510 30376 274      76 175        syn-C2H3C(O)NH2, v=0
  443889.6625  0.0167 -4.2786 3  613.9675153  71510 30376 374      76 275        syn-C2H3C(O)NH2, v=0
  443906.3242  0.0200 -3.5877 3  467.7961 89 -71510 303443212      443113        syn-C2H3C(O)NH2, v=0
  443906.3242  0.0200 -3.5877 3  467.7961 89 -71510 303443213      443114        syn-C2H3C(O)NH2, v=0
  443914.2492  0.0019 -4.1328 3  104.5880 57  71510 30328 920      27 621        syn-C2H3C(O)NH2, v=0
  443928.8046  0.0044 -4.4913 3  462.7226115  71510 303571740      571443        syn-C2H3C(O)NH2, v=0
  443931.4452  0.0028 -5.9796 3   88.5795 51  71510 303251015      25 520        syn-C2H3C(O)NH2, v=0
  443938.1344  0.0377 -5.2952 3 1615.5081209  71510 303A43569      A43470        syn-C2H3C(O)NH2, v=0
  443938.4784  0.0377 -5.2952 3 1615.5081209  71510 303A43570      A43471        syn-C2H3C(O)NH2, v=0
  443981.2243  0.0042 -4.4736 3  578.4194129  71510 303641846      641549        syn-C2H3C(O)NH2, v=0
  444011.1575  0.0073 -4.1881 3  995.5228157  71510 303783345      783246        syn-C2H3C(O)NH2, v=0
  444011.1575  0.0073 -4.1881 3  995.5228157  71510 303783346      783247        syn-C2H3C(O)NH2, v=0
  444067.8822  0.0200 -3.5965 3  457.0667 87 -71510 303433211      433112        syn-C2H3C(O)NH2, v=0
  444067.8822  0.0200 -3.5965 3  457.0667 87 -71510 303433212      433113        syn-C2H3C(O)NH2, v=0
  444074.4632  0.0013 -5.2440 3  507.0864119  71510 303591941      581940        syn-C2H3C(O)NH2, v=0
  444127.3288  0.0191 -4.7694 3 1329.6327187  71510 303933459      933360        syn-C2H3C(O)NH2, v=0
  444127.3318  0.0191 -4.7694 3 1329.6327187  71510 303933460      933361        syn-C2H3C(O)NH2, v=0
  444149.5997  0.0013 -5.2439 3  507.0894119  71510 303591940      581939        syn-C2H3C(O)NH2, v=0
  444168.3481  0.0014 -3.4192 3  487.8684121  71510 303601347      591446        syn-C2H3C(O)NH2, v=0
  444170.4934  0.0221 -4.4706 3 1078.2408187  71510 303931281      931182        syn-C2H3C(O)NH2, v=0
  444170.4934  0.0221 -4.4706 3 1078.2408187  71510 303931381      931282        syn-C2H3C(O)NH2, v=0
  444178.4753  0.0022 -5.2697 3   50.8090 39  71510 30319 911      18 612        syn-C2H3C(O)NH2, v=0
  444187.3311  0.0200 -2.7528 3  149.5892 51 -71510 3032519 6      2418 7        syn-C2H3C(O)NH2, v=0
  444187.3311  0.0200 -2.7528 3  149.5892 51 -71510 3032519 7      2418 6        syn-C2H3C(O)NH2, v=0
  444219.6603  0.0200 -3.6086 3  446.5840 85 -71510 303423210      423111        syn-C2H3C(O)NH2, v=0
  444219.6603  0.0200 -3.6086 3  446.5840 85 -71510 303423211      423112        syn-C2H3C(O)NH2, v=0
  444256.5794  0.0026 -4.6017 3  248.3674 85  71510 303421330      421033        syn-C2H3C(O)NH2, v=0
  444340.7347  0.0016 -5.4251 3  580.8005121  71510 303602535      592534        syn-C2H3C(O)NH2, v=0
  444340.7347  0.0016 -5.4251 3  580.8005121  71510 303602536      592535        syn-C2H3C(O)NH2, v=0
  444362.1761  0.0200 -3.6247 3  436.3479 83 -71510 3034132 9      413110        syn-C2H3C(O)NH2, v=0
  444362.1761  0.0200 -3.6247 3  436.3479 83 -71510 303413210      413111        syn-C2H3C(O)NH2, v=0
  444478.2360  0.0021 -3.5549 3  509.4799123  71510 303611447      601546        syn-C2H3C(O)NH2, v=0
  444495.8145  0.0200 -3.6455 3  426.3581 81 -71510 3034032 8      4031 9        syn-C2H3C(O)NH2, v=0
  444495.8145  0.0200 -3.6455 3  426.3581 81 -71510 3034032 9      403110        syn-C2H3C(O)NH2, v=0
  444550.9907  0.0200 -2.7840 3  153.8103 55 -71510 3032718 9      261710        syn-C2H3C(O)NH2, v=0
  444550.9907  0.0200 -2.7840 3  153.8103 55 -71510 303271810      2617 9        syn-C2H3C(O)NH2, v=0
  444556.7433  0.0035 -3.7107 3  547.0767127  71510 303631548      621647        syn-C2H3C(O)NH2, v=0
  444560.0987  0.1792 -6.0319 3 1985.3102243  71510 303C12596      C12497        syn-C2H3C(O)NH2, v=0
  444573.8038  0.1791 -6.0319 3 1985.3103243  71510 303C12696      C12597        syn-C2H3C(O)NH2, v=0
  444586.6465  0.0039 -4.6153 3  305.0206 93  71510 303461531      461234        syn-C2H3C(O)NH2, v=0
  444593.4843  0.0200 -2.9077 3  175.6007 67 -71510 303331519      321418        syn-C2H3C(O)NH2, v=0
  444593.4843  0.0200 -2.9077 3  175.6007 67 -71510 303331518      321419        syn-C2H3C(O)NH2, v=0
  444620.9152  0.0200 -3.6720 3  416.6145 79 -71510 3033932 7      3931 8        syn-C2H3C(O)NH2, v=0
  444620.9152  0.0200 -3.6720 3  416.6145 79 -71510 3033932 8      3931 9        syn-C2H3C(O)NH2, v=0
  444644.9043  0.0565 -5.0545 3 1444.6464211  71510 303A51887      A51788        syn-C2H3C(O)NH2, v=0
  444644.9156  0.0565 -5.0545 3 1444.6464211  71510 303A51987      A51888        syn-C2H3C(O)NH2, v=0
  444660.6442  0.0958 -5.3341 3 1277.4620191  71510 303952669      942768        syn-C2H3C(O)NH2, v=0
  444666.6677  0.0034 -4.6359 3  243.1793 85  71510 303421231      42 934        syn-C2H3C(O)NH2, v=0
  444737.9612  0.0200 -3.7057 3  407.1169 77 -71510 3033832 6      3831 7        syn-C2H3C(O)NH2, v=0
  444737.9612  0.0200 -3.7057 3  407.1169 77 -71510 3033832 7      3831 8        syn-C2H3C(O)NH2, v=0
  444807.8608  0.0069 -4.1556 3  976.2704155  71510 303773344      773245        syn-C2H3C(O)NH2, v=0
  444807.8608  0.0069 -4.1556 3  976.2704155  71510 303773345      773246        syn-C2H3C(O)NH2, v=0
  444814.9236  0.0200 -2.8191 3  159.5324 59 -71510 303291712      281613        syn-C2H3C(O)NH2, v=0
  444814.9236  0.0200 -2.8191 3  159.5324 59 -71510 303291713      281612        syn-C2H3C(O)NH2, v=0
  444847.2993  0.0032 -3.7486 3  397.8650 75  71510 3033732 5      3731 6        syn-C2H3C(O)NH2, v=0
  444847.2993  0.0032 -3.7486 3  397.8650 75  71510 3033732 6      3731 7        syn-C2H3C(O)NH2, v=0
  444885.2777  0.0257 -4.5551 3 1136.2388191  71510 303951382      951283        syn-C2H3C(O)NH2, v=0
  444885.2777  0.0257 -4.5551 3 1136.2388191  71510 303951482      951383        syn-C2H3C(O)NH2, v=0
  444886.8316  0.0200 -2.8595 3  166.7822 63 -71510 303311616      301515        syn-C2H3C(O)NH2, v=0
  444886.8316  0.0200 -2.8595 3  166.7822 63 -71510 303311615      301516        syn-C2H3C(O)NH2, v=0
  444948.2807  0.0021 -5.1881 3  535.1452141  71510 30370 367      69 366        syn-C2H3C(O)NH2, v=0
  444948.2761  0.0200 -3.0311 3  535.1452141 -71510 30370 367      69 466        syn-C2H3C(O)NH2, v=0
  444948.2761  0.0200 -3.0311 3  535.1452141 -71510 30370 467      69 366        syn-C2H3C(O)NH2, v=0
  444948.2807  0.0021 -5.1881 3  535.1452141  71510 30370 467      69 466        syn-C2H3C(O)NH2, v=0
  444949.3093  0.0034 -3.8041 3  388.8588 73  71510 3033632 4      3631 5        syn-C2H3C(O)NH2, v=0
  444949.3093  0.0034 -3.8041 3  388.8588 73  71510 3033632 5      3631 6        syn-C2H3C(O)NH2, v=0
  444952.5193  0.0024 -5.1828 3  536.7009143  71510 30371 269      70 268        syn-C2H3C(O)NH2, v=0
  444952.5255  0.0200 -3.0095 3  536.7009143 -71510 30371 269      70 368        syn-C2H3C(O)NH2, v=0
  444952.5255  0.0200 -3.0095 3  536.7009143 -71510 30371 369      70 268        syn-C2H3C(O)NH2, v=0
  444952.5193  0.0024 -5.1828 3  536.7009143  71510 30371 369      70 368        syn-C2H3C(O)NH2, v=0
  444954.9536  0.0020 -5.1923 3  533.0668139  71510 30369 465      68 464        syn-C2H3C(O)NH2, v=0
  444954.9504  0.0200 -3.0534 3  533.0668139 -71510 30369 465      68 564        syn-C2H3C(O)NH2, v=0
  444954.9504  0.0200 -3.0534 3  533.0668139 -71510 30369 565      68 464        syn-C2H3C(O)NH2, v=0
  444954.9536  0.0020 -5.1923 3  533.0668139  71510 30369 565      68 564        syn-C2H3C(O)NH2, v=0
  444962.3262  0.0031 -5.1765 3  537.7416145  71510 30372 171      71 170        syn-C2H3C(O)NH2, v=0
  444962.3131  0.0200 -2.9882 3  537.7416145 -71510 30372 171      71 270        syn-C2H3C(O)NH2, v=0
  444962.3131  0.0200 -2.9882 3  537.7416145 -71510 30372 271      71 170        syn-C2H3C(O)NH2, v=0
  444962.3262  0.0031 -5.1765 3  537.7416145  71510 30372 271      71 270        syn-C2H3C(O)NH2, v=0
  444973.7733  0.0042 -5.1693 3  538.2736147  71510 30373 073      72 072        syn-C2H3C(O)NH2, v=0
  444973.7572  0.0200 -2.9672 3  538.2736147 -71510 30373 073      72 172        syn-C2H3C(O)NH2, v=0
  444973.7572  0.0200 -2.9672 3  538.2736147 -71510 30373 173      72 072        syn-C2H3C(O)NH2, v=0
  444973.7733  0.0042 -5.1693 3  538.2736147  71510 30373 173      72 172        syn-C2H3C(O)NH2, v=0
  444979.9222  0.0020 -5.1955 3  530.4565137  71510 30368 563      67 562        syn-C2H3C(O)NH2, v=0
  444979.9108  0.0200 -3.0765 3  530.4565137 -71510 30368 563      67 662        syn-C2H3C(O)NH2, v=0
  444979.9108  0.0200 -3.0765 3  530.4565137 -71510 30368 663      67 562        syn-C2H3C(O)NH2, v=0
  444979.9222  0.0020 -5.1955 3  530.4565137  71510 30368 663      67 662        syn-C2H3C(O)NH2, v=0
  445033.5934  0.0020 -5.1976 3  527.3024135  71510 30367 661      66 660        syn-C2H3C(O)NH2, v=0
  445033.6112  0.0200 -3.1009 3  527.3024135 -71510 30367 661      66 760        syn-C2H3C(O)NH2, v=0
  445033.6112  0.0200 -3.1009 3  527.3024135 -71510 30367 761      66 660        syn-C2H3C(O)NH2, v=0
  445033.5934  0.0020 -5.1976 3  527.3024135  71510 30367 761      66 760        syn-C2H3C(O)NH2, v=0
  445044.3771  0.0200 -3.8776 3  380.0980 71 -71510 3033532 3      3531 4        syn-C2H3C(O)NH2, v=0
  445044.3771  0.0200 -3.8776 3  380.0980 71 -71510 3033532 4      3531 5        syn-C2H3C(O)NH2, v=0
  445069.3622  0.1305 -5.8537 3 1453.7729205  71510 303A22677      A12774        syn-C2H3C(O)NH2, v=0
  445130.9860  0.0200 -3.1270 3  523.5898133 -71510 30366 759      65 858        syn-C2H3C(O)NH2, v=0
  445131.0042  0.0019 -5.1985 3  523.5898133  71510 30366 759      65 758        syn-C2H3C(O)NH2, v=0
  445130.9860  0.0200 -3.1270 3  523.5898133 -71510 30366 859      65 758        syn-C2H3C(O)NH2, v=0
  445131.0042  0.0019 -5.1985 3  523.5898133  71510 30366 859      65 858        syn-C2H3C(O)NH2, v=0
  445132.7733  0.0036 -3.9793 3  371.5825 69  71510 3033432 2      3431 3        syn-C2H3C(O)NH2, v=0
  445132.7733  0.0036 -3.9793 3  371.5825 69  71510 3033432 3      3431 4        syn-C2H3C(O)NH2, v=0
  445177.8828  0.0015 -5.3931 3  569.6190121  71510 303602437      592436        syn-C2H3C(O)NH2, v=0
  445177.8835  0.0015 -5.3931 3  569.6190121  71510 303602436      592435        syn-C2H3C(O)NH2, v=0
  445206.3121  0.0144 -4.2265 3  877.6090173  71510 30386 878      86 779        syn-C2H3C(O)NH2, v=0
  445206.3121  0.0144 -4.2265 3  877.6090173  71510 30386 978      86 879        syn-C2H3C(O)NH2, v=0
  445214.9178  0.0038 -4.1325 3  363.3121 67  71510 3033332 1      3331 2        syn-C2H3C(O)NH2, v=0
  445214.9178  0.0038 -4.1325 3  363.3121 67  71510 3033332 2      3331 3        syn-C2H3C(O)NH2, v=0
  445218.7823  0.1226 -5.7761 3 1510.5626207  71510 303A32974      A23073        syn-C2H3C(O)NH2, v=0
  445249.0257  0.0482 -4.9452 3 1380.5318207  71510 303A31786      A31687        syn-C2H3C(O)NH2, v=0
  445249.0287  0.0482 -4.9452 3 1380.5318207  71510 303A31886      A31787        syn-C2H3C(O)NH2, v=0
  445291.1132  0.0039 -4.4108 3  355.2866 65  71510 3033232 0      3231 1        syn-C2H3C(O)NH2, v=0
  445291.1132  0.0039 -4.4108 3  355.2866 65  71510 3033232 1      3231 2        syn-C2H3C(O)NH2, v=0
  445294.5995  0.0200 -3.1553 3  519.2997131 -71510 30365 857      64 956        syn-C2H3C(O)NH2, v=0
  445294.5942  0.0018 -5.1981 3  519.2997131  71510 30365 957      64 956        syn-C2H3C(O)NH2, v=0
  445294.5955  0.0018 -5.1981 3  519.2997131  71510 30365 857      64 856        syn-C2H3C(O)NH2, v=0
  445294.5995  0.0200 -3.1553 3  519.2997131 -71510 30365 957      64 856        syn-C2H3C(O)NH2, v=0
  445351.7910  0.0135 -4.1461 3  741.7168163  71510 30381 576      81 477        syn-C2H3C(O)NH2, v=0
  445351.7910  0.0135 -4.1461 3  741.7168163  71510 30381 676      81 577        syn-C2H3C(O)NH2, v=0
  445362.9904  0.0300 -4.6451 3 1195.4734195  71510 303971483      971384        syn-C2H3C(O)NH2, v=0
  445362.9905  0.0300 -4.6451 3 1195.4734195  71510 303971583      971484        syn-C2H3C(O)NH2, v=0
  445457.7014  0.0029 -4.6679 3   78.0253 49  71510 30324 916      23 617        syn-C2H3C(O)NH2, v=0
  445459.0095  0.0180 -4.7262 3 1306.5259185  71510 303923458      923359        syn-C2H3C(O)NH2, v=0
  445459.0110  0.0180 -4.7262 3 1306.5259185  71510 303923459      923360        syn-C2H3C(O)NH2, v=0
  445536.7197  0.0047 -6.1369 3  841.5255123  71510 303614120      604119        syn-C2H3C(O)NH2, v=0
  445536.7197  0.0047 -6.1369 3  841.5255123  71510 303614121      604120        syn-C2H3C(O)NH2, v=0
  445558.9793  0.0411 -4.8404 3 1317.6267203  71510 303A11685      A11586        syn-C2H3C(O)NH2, v=0
  445558.9801  0.0411 -4.8404 3 1317.6267203  71510 303A11785      A11686        syn-C2H3C(O)NH2, v=0
  445559.3348  0.0200 -3.1870 3  514.4066129 -71510 30364 955      631054        syn-C2H3C(O)NH2, v=0
  445559.3101  0.0017 -5.1962 3  514.4066129  71510 303641055      631054        syn-C2H3C(O)NH2, v=0
  445559.3509  0.0017 -5.1962 3  514.4066129  71510 30364 955      63 954        syn-C2H3C(O)NH2, v=0
  445559.3348  0.0200 -3.1870 3  514.4066129 -71510 303641055      63 954        syn-C2H3C(O)NH2, v=0
  445571.5786  0.0066 -4.1238 3  957.2742153  71510 303763343      763244        syn-C2H3C(O)NH2, v=0
  445571.5786  0.0066 -4.1238 3  957.2742153  71510 303763344      763245        syn-C2H3C(O)NH2, v=0
  445591.9598  0.0351 -4.7403 3 1255.9383199  71510 303991584      991485        syn-C2H3C(O)NH2, v=0
  445591.9599  0.0351 -4.7403 3 1255.9383199  71510 303991684      991585        syn-C2H3C(O)NH2, v=0
  445683.4561  0.1104 -5.5783 3 1740.4255229  71510 303B42292      B42193        syn-C2H3C(O)NH2, v=0
  445684.3073  0.1104 -5.5783 3 1740.4255229  71510 303B42392      B42293        syn-C2H3C(O)NH2, v=0
  445686.8551  0.0028 -5.7247 3  101.7066 55  71510 303271017      27 522        syn-C2H3C(O)NH2, v=0
  445722.3163  0.1396 -6.0796 3 1667.8534217  71510 303A83178      A73275        syn-C2H3C(O)NH2, v=0
  445752.8576  0.0043 -6.0800 3  822.5417123  71510 303614021      604020        syn-C2H3C(O)NH2, v=0
  445752.8576  0.0043 -6.0800 3  822.5417123  71510 303614022      604021        syn-C2H3C(O)NH2, v=0
  445803.3289  0.0355 -5.2443 3 1589.5375207  71510 303A33568      A33469        syn-C2H3C(O)NH2, v=0
  445803.5154  0.0355 -5.2443 3 1589.5375207  71510 303A33569      A33470        syn-C2H3C(O)NH2, v=0
  445981.3158  0.0200 -3.2234 3  508.8757127 -71510 303631053      621152        syn-C2H3C(O)NH2, v=0
  445981.4185  0.0039 -6.0252 3  804.0333123  71510 303613922      603921        syn-C2H3C(O)NH2, v=0
  445981.4185  0.0039 -6.0252 3  804.0333123  71510 303613923      603922        syn-C2H3C(O)NH2, v=0
  445982.5795  0.0016 -5.1927 3  508.8757127  71510 303631153      621152        syn-C2H3C(O)NH2, v=0
  445983.5757  0.0016 -5.1927 3  508.8757127  71510 303631053      621052        syn-C2H3C(O)NH2, v=0
  445984.7945  0.0200 -3.2234 3  508.8757127 -71510 303631153      621052        syn-C2H3C(O)NH2, v=0
  446038.8646  0.0609 -5.7292 3 1847.2342225  71510 303B23676      B23577        syn-C2H3C(O)NH2, v=0
  446043.0830  0.0609 -5.7292 3 1847.2341225  71510 303B23677      B23578        syn-C2H3C(O)NH2, v=0
  446144.3957  0.0015 -5.3624 3  558.9622121  71510 303602338      592337        syn-C2H3C(O)NH2, v=0
  446144.4066  0.0015 -5.3624 3  558.9622121  71510 303602337      592336        syn-C2H3C(O)NH2, v=0
  446223.9068  0.0035 -5.9722 3  786.0012123  71510 303613823      603822        syn-C2H3C(O)NH2, v=0
  446223.9068  0.0035 -5.9722 3  786.0012123  71510 303613824      603823        syn-C2H3C(O)NH2, v=0
  446226.9732  0.0032 -6.0448 3   38.6991 37  71510 30318 712      17 215        syn-C2H3C(O)NH2, v=0
  446263.0509  0.0032 -3.3614 3  317.4019 97  71510 303481336      471235        syn-C2H3C(O)NH2, v=0
  446303.5491  0.0062 -4.0928 3  938.5339151  71510 303753342      753243        syn-C2H3C(O)NH2, v=0
  446303.5491  0.0062 -4.0928 3  938.5339151  71510 303753343      753244        syn-C2H3C(O)NH2, v=0
  446313.0372  0.0041 -4.4798 3  561.9055127  71510 303631845      631548        syn-C2H3C(O)NH2, v=0
  446336.9757  0.0049 -5.7252 3  104.6195 57  71510 30328 919      28 424        syn-C2H3C(O)NH2, v=0
  446347.8809  0.0013 -5.2182 3  499.2713119  71510 303591842      581841        syn-C2H3C(O)NH2, v=0
  446450.1201  0.0014 -5.1494 3  472.7366119  71510 303591346      581345        syn-C2H3C(O)NH2, v=0
  446482.0473  0.0032 -5.9211 3  768.4463123  71510 303613724      603723        syn-C2H3C(O)NH2, v=0
  446482.0473  0.0032 -5.9211 3  768.4463123  71510 303613725      603724        syn-C2H3C(O)NH2, v=0
  446507.1790  0.0011 -3.0640 3  207.5842 77  71510 303381326      371225        syn-C2H3C(O)NH2, v=0
  446553.1775  0.0157 -4.1964 3  661.0760157  71510 30378 375      78 276        syn-C2H3C(O)NH2, v=0
  446553.1775  0.0157 -4.1964 3  661.0760157  71510 30378 475      78 376        syn-C2H3C(O)NH2, v=0
  446635.7369  0.0200 -3.2672 3  502.6565125 -71510 303621151      611250        syn-C2H3C(O)NH2, v=0
  446661.2629  0.0015 -5.1872 3  502.6565125  71510 303621251      611250        syn-C2H3C(O)NH2, v=0
  446680.0578  0.0015 -5.1872 3  502.6550125  71510 303621151      611150        syn-C2H3C(O)NH2, v=0
  446705.6143  0.0200 -3.2671 3  502.6550125 -71510 303621251      611150        syn-C2H3C(O)NH2, v=0
  446737.3846  0.0170 -4.6837 3 1283.6814183  71510 303913457      913358        syn-C2H3C(O)NH2, v=0
  446737.3854  0.0170 -4.6837 3 1283.6814183  71510 303913458      913359        syn-C2H3C(O)NH2, v=0
  446757.8274  0.0029 -5.8717 3  751.3697123  71510 303613625      603624        syn-C2H3C(O)NH2, v=0
  446757.8274  0.0029 -5.8717 3  751.3697123  71510 303613626      603625        syn-C2H3C(O)NH2, v=0
  446794.2019  0.0160 -4.2842 3  931.2018177  71510 30388 979      88 880        syn-C2H3C(O)NH2, v=0
  446794.2019  0.0160 -4.2842 3  931.2018177  71510 303881079      88 980        syn-C2H3C(O)NH2, v=0
  446828.2891  0.0023 -5.1493 3   55.6569 41  71510 30320 912      19 613        syn-C2H3C(O)NH2, v=0
  446891.6200  0.0014 -5.2172 3  499.2967119  71510 303591841      581840        syn-C2H3C(O)NH2, v=0
  447004.9538  0.0059 -4.0626 3  920.0489149  71510 303743341      743242        syn-C2H3C(O)NH2, v=0
  447004.9538  0.0059 -4.0626 3  920.0489149  71510 303743342      743243        syn-C2H3C(O)NH2, v=0
  447053.5478  0.0027 -5.8240 3  734.7726123  71510 303613526      603525        syn-C2H3C(O)NH2, v=0
  447053.5478  0.0027 -5.8240 3  734.7726123  71510 303613527      603526        syn-C2H3C(O)NH2, v=0
  447092.8273  0.0195 -4.5089 3  583.4061151  71510 30375 174      75 075        syn-C2H3C(O)NH2, v=0
  447092.8273  0.0195 -4.5089 3  583.4061151  71510 30375 274      75 175        syn-C2H3C(O)NH2, v=0
  447096.6193  0.0023 -4.8437 3  179.8500 71  71510 303351323      351026        syn-C2H3C(O)NH2, v=0
  447156.2282  0.0063 -5.9989 3   96.4904 59  71510 30329 425      29 128        syn-C2H3C(O)NH2, v=0
  447163.3913  0.0028 -4.7959 3   71.9980 47  71510 30323 915      22 616        syn-C2H3C(O)NH2, v=0
  447275.3525  0.0015 -5.3328 3  548.8421121  71510 303602239      592238        syn-C2H3C(O)NH2, v=0
  447275.4943  0.0015 -5.3328 3  548.8421121  71510 303602238      592237        syn-C2H3C(O)NH2, v=0
  447278.6640  0.0062 -5.9987 3   96.4904 59  71510 30329 525      29 228        syn-C2H3C(O)NH2, v=0
  447306.3284  0.0200 -3.3245 3  495.6762123 -71510 303611249      601348        syn-C2H3C(O)NH2, v=0
  447351.0061  0.0028 -4.9628 3  162.6856 67  71510 303331320      331023        syn-C2H3C(O)NH2, v=0
  447371.8875  0.0025 -5.7780 3  718.6563123  71510 303613427      603426        syn-C2H3C(O)NH2, v=0
  447371.8875  0.0025 -5.7780 3  718.6563123  71510 303613428      603427        syn-C2H3C(O)NH2, v=0
  447382.5745  0.1476 -6.0763 3 1667.8487217  71510 303A83177      A73276        syn-C2H3C(O)NH2, v=0
  447506.5986  0.0138 -4.1682 3  792.0930167  71510 30383 677      83 578        syn-C2H3C(O)NH2, v=0
  447506.5986  0.0138 -4.1682 3  792.0930167  71510 30383 777      83 678        syn-C2H3C(O)NH2, v=0
  447582.3831  0.0949 -5.4511 3 1670.9353225  71510 303B22191      B22092        syn-C2H3C(O)NH2, v=0
  447582.6478  0.0949 -5.4511 3 1670.9353225  71510 303B22291      B22192        syn-C2H3C(O)NH2, v=0
  447591.5122  0.0335 -5.1942 3 1563.8350205  71510 303A23567      A23468        syn-C2H3C(O)NH2, v=0
  447591.6124  0.0335 -5.1942 3 1563.8350205  71510 303A23568      A23469        syn-C2H3C(O)NH2, v=0
  447595.0333  0.0052 -4.4873 3  595.0743131  71510 303651847      651550        syn-C2H3C(O)NH2, v=0
  447673.2334  0.1549 -5.8917 3 1911.7159239  71510 303B92495      B92396        syn-C2H3C(O)NH2, v=0
  447676.9220  0.0056 -4.0332 3  901.8190147  71510 303733340      733241        syn-C2H3C(O)NH2, v=0
  447676.9220  0.0056 -4.0332 3  901.8190147  71510 303733341      733242        syn-C2H3C(O)NH2, v=0
  447677.9391  0.1548 -5.8917 3 1911.7160239  71510 303B92595      B92496        syn-C2H3C(O)NH2, v=0
  447697.5601  0.0035 -4.7391 3  233.2214 81  71510 303401426      401129        syn-C2H3C(O)NH2, v=0
  447711.3283  0.0014 -5.1793 3  495.6762123  71510 303611349      601348        syn-C2H3C(O)NH2, v=0
  447715.9852  0.0024 -5.7336 3  703.0226123  71510 303613328      603327        syn-C2H3C(O)NH2, v=0
  447715.9852  0.0024 -5.7336 3  703.0226123  71510 303613329      603328        syn-C2H3C(O)NH2, v=0
  447759.2090  0.0562 -5.5108 3 1351.0243197  71510 303982673      972770        syn-C2H3C(O)NH2, v=0
  447826.9315  0.0016 -4.0245 3  111.7434 59  71510 30329 921      28 622        syn-C2H3C(O)NH2, v=0
  447928.3508  0.0027 -3.8764 3  115.5666 61  71510 30330 823      29 524        syn-C2H3C(O)NH2, v=0
  447937.6065  0.0013 -5.1623 3  479.3740119  71510 303591545      581544        syn-C2H3C(O)NH2, v=0
  447964.7780  0.0160 -4.6420 3 1261.0987181  71510 303903456      903357        syn-C2H3C(O)NH2, v=0
  447964.7784  0.0160 -4.6420 3 1261.0987181  71510 303903457      903358        syn-C2H3C(O)NH2, v=0
  447975.6657  0.0014 -5.1787 3  495.6538123  71510 303611249      601248        syn-C2H3C(O)NH2, v=0
  448001.5710  0.0010 -3.0616 3  207.5429 77  71510 303381325      371226        syn-C2H3C(O)NH2, v=0
  448089.5428  0.0023 -5.6907 3  687.8730123  71510 303613229      603228        syn-C2H3C(O)NH2, v=0
  448089.5428  0.0023 -5.6907 3  687.8730123  71510 303613230      603229        syn-C2H3C(O)NH2, v=0
  448170.2439  0.0025 -5.0332 3   60.8046 43  71510 30321 913      20 614        syn-C2H3C(O)NH2, v=0
  448183.8643  0.0182 -4.3502 3  986.0562181  71510 303901080      90 981        syn-C2H3C(O)NH2, v=0
  448183.8643  0.0182 -4.3502 3  986.0562181  71510 303901180      901081        syn-C2H3C(O)NH2, v=0
  448207.7499  0.0027 -4.9168 3   66.2536 45  71510 30322 914      21 615        syn-C2H3C(O)NH2, v=0
  448320.5340  0.0053 -4.0046 3  883.8437145  71510 303723339      723240        syn-C2H3C(O)NH2, v=0
  448320.5340  0.0053 -4.0046 3  883.8437145  71510 303723340      723241        syn-C2H3C(O)NH2, v=0
  448347.4858  0.0573 -5.6728 3 1819.1729223  71510 303B13675      B13576        syn-C2H3C(O)NH2, v=0
  448349.8776  0.0573 -5.6728 3 1819.1728223  71510 303B13676      B13577        syn-C2H3C(O)NH2, v=0
  448380.6269  0.0014 -3.3224 3  495.6538123  71510 303611349      601248        syn-C2H3C(O)NH2, v=0
  448496.9606  0.0021 -5.6494 3  673.2099123  71510 303613130      603129        syn-C2H3C(O)NH2, v=0
  448496.9606  0.0021 -5.6494 3  673.2099123  71510 303613131      603130        syn-C2H3C(O)NH2, v=0
  448499.9021  0.0921 -6.1436 3 2065.6194239  71510 303B93782      B93683        syn-C2H3C(O)NH2, v=0
  448524.7523  0.0919 -6.1436 3 2065.6185239  71510 303B93783      B93684        syn-C2H3C(O)NH2, v=0
  448621.1172  0.0014 -5.3043 3  539.2752121  71510 303602140      592139        syn-C2H3C(O)NH2, v=0
  448622.7280  0.0014 -5.3043 3  539.2753121  71510 303602139      592138        syn-C2H3C(O)NH2, v=0
  448675.4487  0.0067 -4.4951 3  555.9951127  71510 303631746      631449        syn-C2H3C(O)NH2, v=0
  448694.1072  0.0013 -5.1940 3  492.1176119  71510 303591743      581742        syn-C2H3C(O)NH2, v=0
  448725.1462  0.0021 -5.2679 3   50.6575 39  71510 30319 910      18 613        syn-C2H3C(O)NH2, v=0
  448792.9173  0.0014 -5.1043 3  447.7525115  71510 303571443      561442        syn-C2H3C(O)NH2, v=0
  448836.1515  0.0014 -5.1693 3  487.8684121  71510 303601447      591446        syn-C2H3C(O)NH2, v=0
  448853.1394  0.1256 -5.9456 3 1601.5155213  71510 303A63077      A53174        syn-C2H3C(O)NH2, v=0
  448879.0321  0.0015 -5.1150 3  451.6916115  71510 303571542      561541        syn-C2H3C(O)NH2, v=0
  448914.5744  0.1091 -5.4850 3 1361.1977197  71510 303982771      972870        syn-C2H3C(O)NH2, v=0
  448936.8246  0.0050 -3.9767 3  866.1227143  71510 303713338      713239        syn-C2H3C(O)NH2, v=0
  448936.8246  0.0050 -3.9767 3  866.1227143  71510 303713339      713240        syn-C2H3C(O)NH2, v=0
  448943.5139  0.0020 -5.6095 3  659.0356123  71510 303613031      603030        syn-C2H3C(O)NH2, v=0
  448943.5139  0.0020 -5.6095 3  659.0356123  71510 303613032      603031        syn-C2H3C(O)NH2, v=0
  448956.3871  0.0025 -4.7982 3   68.1826 47  71510 30323 815      22 518        syn-C2H3C(O)NH2, v=0
  449005.1783  0.0056 -5.1521 3  156.3328 71  71510 30335 728      35 431        syn-C2H3C(O)NH2, v=0
  449053.6446  0.0151 -4.1682 3  709.4805161  71510 30380 476      80 377        syn-C2H3C(O)NH2, v=0
  449053.6446  0.0151 -4.1682 3  709.4805161  71510 30380 576      80 477        syn-C2H3C(O)NH2, v=0
  449100.7358  0.0815 -5.3280 3 1602.6246221  71510 303B02090      B01991        syn-C2H3C(O)NH2, v=0
  449100.8150  0.0815 -5.3280 3 1602.6246221  71510 303B02190      B02091        syn-C2H3C(O)NH2, v=0
  449143.3676  0.0151 -4.6010 3 1238.7773179  71510 303893455      893356        syn-C2H3C(O)NH2, v=0
  449143.3678  0.0151 -4.6010 3 1238.7773179  71510 303893456      893357        syn-C2H3C(O)NH2, v=0
  449164.3613  0.0024 -3.3399 3  207.8290 79  71510 303391128      381029        syn-C2H3C(O)NH2, v=0
  449306.6944  0.0316 -5.1448 3 1538.3996203  71510 303A13566      A13467        syn-C2H3C(O)NH2, v=0
  449306.7477  0.0316 -5.1448 3 1538.3996203  71510 303A13567      A13468        syn-C2H3C(O)NH2, v=0
  449368.1792  0.0208 -4.4234 3 1042.1663185  71510 303921181      921082        syn-C2H3C(O)NH2, v=0
  449368.1792  0.0208 -4.4234 3 1042.1663185  71510 303921281      921182        syn-C2H3C(O)NH2, v=0
  449435.5887  0.0020 -5.5711 3  645.3531123  71510 303612932      602931        syn-C2H3C(O)NH2, v=0
  449435.5887  0.0020 -5.5711 3  645.3531123  71510 303612933      602932        syn-C2H3C(O)NH2, v=0
  449483.4237  0.0145 -4.2055 3  843.7484171  71510 30385 778      85 679        syn-C2H3C(O)NH2, v=0
  449483.4237  0.0145 -4.2055 3  843.7484171  71510 30385 878      85 779        syn-C2H3C(O)NH2, v=0
  449526.7860  0.0048 -3.9497 3  848.6555141  71510 303703337      703238        syn-C2H3C(O)NH2, v=0
  449526.7860  0.0048 -3.9497 3  848.6555141  71510 303703338      703239        syn-C2H3C(O)NH2, v=0
  449742.0656  0.0028 -4.5928 3  259.0377 87  71510 303431331      431034        syn-C2H3C(O)NH2, v=0
  449822.5104  0.0013 -5.1742 3  485.5710119  71510 303591644      581643        syn-C2H3C(O)NH2, v=0
  449914.6917  0.0182 -4.3001 3  629.8169155  71510 30377 275      77 176        syn-C2H3C(O)NH2, v=0
  449914.6917  0.0182 -4.3001 3  629.8169155  71510 30377 375      77 276        syn-C2H3C(O)NH2, v=0
  449981.0031  0.0019 -5.5341 3  632.1658123  71510 303612833      602832        syn-C2H3C(O)NH2, v=0
  449981.0031  0.0019 -5.5341 3  632.1658123  71510 303612834      602833        syn-C2H3C(O)NH2, v=0
  450091.3344  0.0200 -3.9235 3  831.4419139 -71510 303693336      693237        syn-C2H3C(O)NH2, v=0
  450091.3344  0.0200 -3.9235 3  831.4419139 -71510 303693337      693238        syn-C2H3C(O)NH2, v=0
  450167.1191  0.0016 -5.1514 3  471.3954117  71510 303581642      571641        syn-C2H3C(O)NH2, v=0
  450254.8002  0.0014 -5.2769 3  530.2838121  71510 303602041      592040        syn-C2H3C(O)NH2, v=0
  450268.1116  0.0698 -5.2090 3 1535.5017217  71510 303A81989      A81890        syn-C2H3C(O)NH2, v=0
  450268.1344  0.0698 -5.2090 3 1535.5017217  71510 303A82089      A81990        syn-C2H3C(O)NH2, v=0
  450270.6038  0.0014 -5.2768 3  530.2844121  71510 303602040      592039        syn-C2H3C(O)NH2, v=0
  450275.1989  0.0143 -4.5607 3 1216.7165177  71510 303883454      883355        syn-C2H3C(O)NH2, v=0
  450275.1990  0.0143 -4.5607 3 1216.7165177  71510 303883455      883356        syn-C2H3C(O)NH2, v=0
  450299.4619  0.1338 -5.7554 3 1839.2756235  71510 303B72394      B72295        syn-C2H3C(O)NH2, v=0
  450301.0198  0.1337 -5.7554 3 1839.2756235  71510 303B72494      B72395        syn-C2H3C(O)NH2, v=0
  450318.3336  0.0030 -5.6433 3  108.5428 57  71510 303281018      28 523        syn-C2H3C(O)NH2, v=0
  450331.8646  0.0200 -2.9753 3  194.7647 73 -71510 303361423      351322        syn-C2H3C(O)NH2, v=0
  450339.2362  0.0240 -4.5032 3 1099.5261189  71510 303941282      941183        syn-C2H3C(O)NH2, v=0
  450339.2362  0.0240 -4.5032 3 1099.5261189  71510 303941382      941283        syn-C2H3C(O)NH2, v=0
  450370.3570  0.0200 -2.9752 3  194.7635 73 -71510 303361422      351323        syn-C2H3C(O)NH2, v=0
  450556.4336  0.0539 -5.6172 3 1791.3840221  71510 303B03674      B03575        syn-C2H3C(O)NH2, v=0
  450557.7775  0.0539 -5.6172 3 1791.3839221  71510 303B03675      B03576        syn-C2H3C(O)NH2, v=0
  450589.4546  0.0018 -5.4985 3  619.4779123  71510 303612734      602733        syn-C2H3C(O)NH2, v=0
  450589.4546  0.0018 -5.4985 3  619.4779123  71510 303612735      602734        syn-C2H3C(O)NH2, v=0
  450625.4760  0.0200 -2.6955 3  150.6948 45 -71510 3032221 1      2120 2        syn-C2H3C(O)NH2, v=0
  450625.4760  0.0200 -2.6955 3  150.6948 45 -71510 3032221 2      2120 1        syn-C2H3C(O)NH2, v=0
  450631.4930  0.0044 -3.8981 3  814.4815137  71510 303683335      683236        syn-C2H3C(O)NH2, v=0
  450631.4930  0.0044 -3.8981 3  814.4815137  71510 303683336      683237        syn-C2H3C(O)NH2, v=0
  450680.7549  0.0060 -5.6284 3  115.1582 63  71510 30331 526      31 229        syn-C2H3C(O)NH2, v=0
  450689.7689  0.0023 -4.8973 3  171.0210 69  71510 303341322      341025        syn-C2H3C(O)NH2, v=0
  450952.5612  0.0298 -5.0962 3 1513.2306201  71510 303A03565      A03466        syn-C2H3C(O)NH2, v=0
  450952.5893  0.0298 -5.0962 3 1513.2306201  71510 303A03566      A03467        syn-C2H3C(O)NH2, v=0
  450986.6415  0.0023 -5.2012 3  549.9870143  71510 30371 368      70 367        syn-C2H3C(O)NH2, v=0
  450986.6435  0.0200 -3.0435 3  549.9870143 -71510 30371 368      70 467        syn-C2H3C(O)NH2, v=0
  450986.6435  0.0200 -3.0435 3  549.9870143 -71510 30371 468      70 367        syn-C2H3C(O)NH2, v=0
  450986.6415  0.0023 -5.2012 3  549.9870143  71510 30371 468      70 467        syn-C2H3C(O)NH2, v=0
  450991.3679  0.0027 -5.1960 3  551.5429145  71510 30372 270      71 269        syn-C2H3C(O)NH2, v=0
  450991.3148  0.0200 -3.0222 3  551.5429145 -71510 30372 270      71 369        syn-C2H3C(O)NH2, v=0
  450991.3148  0.0200 -3.0222 3  551.5429145 -71510 30372 370      71 269        syn-C2H3C(O)NH2, v=0
  450991.3679  0.0027 -5.1960 3  551.5429145  71510 30372 370      71 369        syn-C2H3C(O)NH2, v=0
  450992.3323  0.0022 -5.2054 3  547.9089141  71510 30370 466      69 465        syn-C2H3C(O)NH2, v=0
  450992.3748  0.0200 -3.0653 3  547.9089141 -71510 30370 466      69 565        syn-C2H3C(O)NH2, v=0
  450992.3748  0.0200 -3.0653 3  547.9089141 -71510 30370 566      69 465        syn-C2H3C(O)NH2, v=0
  450992.3323  0.0022 -5.2054 3  547.9089141  71510 30370 566      69 565        syn-C2H3C(O)NH2, v=0
  451001.3742  0.0034 -5.1899 3  552.5839147  71510 30373 172      72 171        syn-C2H3C(O)NH2, v=0
  451001.3814  0.0200 -3.0013 3  552.5839147 -71510 30373 172      72 271        syn-C2H3C(O)NH2, v=0
  451001.3814  0.0200 -3.0013 3  552.5839147 -71510 30373 272      72 171        syn-C2H3C(O)NH2, v=0
  451001.3742  0.0034 -5.1899 3  552.5839147  71510 30373 272      72 271        syn-C2H3C(O)NH2, v=0
  451012.8645  0.0046 -5.1828 3  553.1163149  71510 30374 074      73 073        syn-C2H3C(O)NH2, v=0
  451012.8724  0.0200 -2.9806 3  553.1163149 -71510 30374 074      73 173        syn-C2H3C(O)NH2, v=0
  451012.8724  0.0200 -2.9806 3  553.1163149 -71510 30374 174      73 073        syn-C2H3C(O)NH2, v=0
  451012.8645  0.0046 -5.1828 3  553.1163149  71510 30374 174      73 173        syn-C2H3C(O)NH2, v=0
  451015.5003  0.0022 -5.2084 3  545.2994139  71510 30369 564      68 563        syn-C2H3C(O)NH2, v=0
  451015.4963  0.0200 -3.0879 3  545.2994139 -71510 30369 564      68 663        syn-C2H3C(O)NH2, v=0
  451015.4963  0.0200 -3.0879 3  545.2994139 -71510 30369 664      68 563        syn-C2H3C(O)NH2, v=0
  451015.5003  0.0022 -5.2084 3  545.2994139  71510 30369 664      68 663        syn-C2H3C(O)NH2, v=0
  451054.1031  0.0200 -2.7225 3  152.4562 49 -71510 3032420 4      2319 5        syn-C2H3C(O)NH2, v=0
  451054.1031  0.0200 -2.7225 3  152.4562 49 -71510 3032420 5      2319 4        syn-C2H3C(O)NH2, v=0
  451066.0336  0.0022 -5.2104 3  542.1471137  71510 30368 662      67 661        syn-C2H3C(O)NH2, v=0
  451066.0537  0.0200 -3.1117 3  542.1471137 -71510 30368 662      67 761        syn-C2H3C(O)NH2, v=0
  451066.0537  0.0200 -3.1117 3  542.1471137 -71510 30368 762      67 661        syn-C2H3C(O)NH2, v=0
  451066.0336  0.0022 -5.2104 3  542.1471137  71510 30368 762      67 761        syn-C2H3C(O)NH2, v=0
  451088.2184  0.0278 -4.5889 3 1158.1295193  71510 303961383      961284        syn-C2H3C(O)NH2, v=0
  451088.2185  0.0278 -4.5889 3 1158.1295193  71510 303961483      961384        syn-C2H3C(O)NH2, v=0
  451109.5818  0.0598 -5.0943 3 1469.5746213  71510 303A61888      A61789        syn-C2H3C(O)NH2, v=0
  451109.5881  0.0598 -5.0943 3 1469.5746213  71510 303A61988      A61889        syn-C2H3C(O)NH2, v=0
  451148.0044  0.0200 -3.8735 3  797.7739135 -71510 303673334      673235        syn-C2H3C(O)NH2, v=0
  451148.0044  0.0200 -3.8735 3  797.7739135 -71510 303673335      673236        syn-C2H3C(O)NH2, v=0
  451158.1149  0.0021 -5.2112 3  538.4378135  71510 30367 760      66 759        syn-C2H3C(O)NH2, v=0
  451158.1110  0.0200 -3.1370 3  538.4378135 -71510 30367 760      66 859        syn-C2H3C(O)NH2, v=0
  451158.1149  0.0021 -5.2112 3  538.4378135  71510 30367 860      66 859        syn-C2H3C(O)NH2, v=0
  451158.1110  0.0200 -3.1370 3  538.4378135 -71510 30367 860      66 759        syn-C2H3C(O)NH2, v=0
  451165.1859  0.0059 -5.6277 3  115.1582 63  71510 30331 626      31 329        syn-C2H3C(O)NH2, v=0
  451246.6532  0.0863 -6.0823 3 2035.7231237  71510 303B83781      B83682        syn-C2H3C(O)NH2, v=0
  451261.2239  0.0862 -6.0823 3 2035.7226237  71510 303B83782      B83683        syn-C2H3C(O)NH2, v=0
  451273.1584  0.0017 -5.4642 3  607.2946123  71510 303612635      602634        syn-C2H3C(O)NH2, v=0
  451273.1584  0.0017 -5.4642 3  607.2946123  71510 303612636      602635        syn-C2H3C(O)NH2, v=0
  451277.1790  0.0158 -4.2547 3  896.6773175  71510 30387 879      87 780        syn-C2H3C(O)NH2, v=0
  451277.1790  0.0158 -4.2547 3  896.6773175  71510 30387 979      87 880        syn-C2H3C(O)NH2, v=0
  451312.7105  0.0200 -3.1644 3  534.1531133 -71510 30366 858      65 957        syn-C2H3C(O)NH2, v=0
  451312.7212  0.0020 -5.2107 3  534.1531133  71510 30366 958      65 957        syn-C2H3C(O)NH2, v=0
  451312.7219  0.0020 -5.2107 3  534.1531133  71510 30366 858      65 857        syn-C2H3C(O)NH2, v=0
  451312.7105  0.0200 -3.1644 3  534.1531133 -71510 30366 958      65 857        syn-C2H3C(O)NH2, v=0
  451355.4020  0.0014 -5.1638 3  487.6286121  71510 303601347      591346        syn-C2H3C(O)NH2, v=0
  451362.1965  0.0135 -4.5212 3 1194.9158175  71510 303873453      873354        syn-C2H3C(O)NH2, v=0
  451362.1966  0.0135 -4.5212 3 1194.9158175  71510 303873454      873355        syn-C2H3C(O)NH2, v=0
  451387.3192  0.0149 -4.1710 3  759.1754165  71510 30382 577      82 478        syn-C2H3C(O)NH2, v=0
  451387.3192  0.0149 -4.1710 3  759.1754165  71510 30382 677      82 578        syn-C2H3C(O)NH2, v=0
  451455.6416  0.0200 -2.7515 3  155.6916 53 -71510 3032619 7      2518 8        syn-C2H3C(O)NH2, v=0
  451455.6416  0.0200 -2.7515 3  155.6916 53 -71510 3032619 8      2518 7        syn-C2H3C(O)NH2, v=0
  451562.1656  0.0200 -3.1949 3  529.2689131 -71510 30365 956      641055        syn-C2H3C(O)NH2, v=0
  451562.1586  0.0019 -5.2088 3  529.2689131  71510 303651056      641055        syn-C2H3C(O)NH2, v=0
  451562.1806  0.0019 -5.2088 3  529.2689131  71510 30365 956      64 955        syn-C2H3C(O)NH2, v=0
  451562.1656  0.0200 -3.1949 3  529.2689131 -71510 303651056      64 955        syn-C2H3C(O)NH2, v=0
  451600.7613  0.0009 -2.9119 3  183.7594 69  71510 303341520      331419        syn-C2H3C(O)NH2, v=0
  451601.2802  0.0009 -2.9119 3  183.7594 69  71510 303341519      331420        syn-C2H3C(O)NH2, v=0
  451605.2630  0.0323 -4.6802 3 1217.9702197  71510 303981484      981385        syn-C2H3C(O)NH2, v=0
  451605.2630  0.0323 -4.6802 3 1217.9702197  71510 303981584      981485        syn-C2H3C(O)NH2, v=0
  451641.8385  0.0040 -3.8499 3  781.3188133  71510 303663333      663234        syn-C2H3C(O)NH2, v=0
  451641.8385  0.0040 -3.8499 3  781.3188133  71510 303663334      663235        syn-C2H3C(O)NH2, v=0
  451646.6242  0.0512 -4.9838 3 1404.8508209  71510 303A41787      A41688        syn-C2H3C(O)NH2, v=0
  451646.6258  0.0512 -4.9838 3 1404.8508209  71510 303A41887      A41788        syn-C2H3C(O)NH2, v=0
  451653.1057  0.0057 -5.3587 3  135.1102 67  71510 30333 627      33 330        syn-C2H3C(O)NH2, v=0
  451725.2772  0.0015 -5.1885 3  492.2879119  71510 303591742      581741        syn-C2H3C(O)NH2, v=0
  451730.5465  0.0935 -5.7415 3 1427.5332203  71510 303A12676      A02773        syn-C2H3C(O)NH2, v=0
  451744.7997  0.1857 -6.0804 3 2014.9297245  71510 303C22597      C22498        syn-C2H3C(O)NH2, v=0
  451753.0804  0.1856 -6.0803 3 2014.9297245  71510 303C22697      C22598        syn-C2H3C(O)NH2, v=0
  451781.5272  0.1105 -5.8171 3 1536.6426209  71510 303A42976      A33073        syn-C2H3C(O)NH2, v=0
  451797.4426  0.0200 -2.7835 3  160.4144 57 -71510 303281810      271711        syn-C2H3C(O)NH2, v=0
  451797.4426  0.0200 -2.7835 3  160.4144 57 -71510 303281811      271710        syn-C2H3C(O)NH2, v=0
  451822.5481  0.0014 -3.4067 3  502.8399123  71510 303611348      601447        syn-C2H3C(O)NH2, v=0
  451879.2915  0.0376 -4.7766 3 1279.0417201  71510 303A01585      A01486        syn-C2H3C(O)NH2, v=0
  451879.2916  0.0376 -4.7766 3 1279.0417201  71510 303A01685      A01586        syn-C2H3C(O)NH2, v=0
  451897.8040  0.0439 -4.8779 3 1341.3375205  71510 303A21686      A21587        syn-C2H3C(O)NH2, v=0
  451897.8044  0.0439 -4.8779 3 1341.3375205  71510 303A21786      A21687        syn-C2H3C(O)NH2, v=0
  451958.1228  0.0200 -3.2298 3  523.7521129 -71510 303641054      631153        syn-C2H3C(O)NH2, v=0
  451958.8436  0.0018 -5.2052 3  523.7521129  71510 303641154      631153        syn-C2H3C(O)NH2, v=0
  451959.3992  0.0018 -5.2052 3  523.7521129  71510 303641054      631053        syn-C2H3C(O)NH2, v=0
  451960.0815  0.0018 -3.2298 3  523.7521129  71510 303641154      631053        syn-C2H3C(O)NH2, v=0
  451976.2632  0.0056 -4.8788 3  211.9487 81  71510 30340 931      40 634        syn-C2H3C(O)NH2, v=0
  451976.9696  0.0011 -3.0810 3  217.1739 79  71510 303391327      381226        syn-C2H3C(O)NH2, v=0
  452021.2489  0.0010 -2.8197 3  166.6445 61  71510 303301713      291614        syn-C2H3C(O)NH2, v=0
  452021.2489  0.0010 -2.8197 3  166.6445 61  71510 303301714      291613        syn-C2H3C(O)NH2, v=0
  452021.8207  0.0009 -2.8616 3  174.4110 65  71510 303321617      311516        syn-C2H3C(O)NH2, v=0
  452021.8244  0.0009 -2.8616 3  174.4110 65  71510 303321616      311517        syn-C2H3C(O)NH2, v=0
  452047.7881  0.0017 -5.4312 3  595.6221123  71510 303612537      602536        syn-C2H3C(O)NH2, v=0
  452047.7882  0.0017 -5.4312 3  595.6221123  71510 303612536      602535        syn-C2H3C(O)NH2, v=0
  452113.7038  0.0200 -3.8270 3  765.1159131 -71510 303653332      653233        syn-C2H3C(O)NH2, v=0
  452113.7038  0.0200 -3.8270 3  765.1159131 -71510 303653333      653234        syn-C2H3C(O)NH2, v=0
  452266.4207  0.0014 -5.2503 3  521.8991121  71510 303601942      591941        syn-C2H3C(O)NH2, v=0
  452397.6592  0.0014 -5.2500 3  521.9047121  71510 303601941      591940        syn-C2H3C(O)NH2, v=0
  452406.1747  0.0127 -4.4824 3 1173.3747173  71510 303863452      863353        syn-C2H3C(O)NH2, v=0
  452406.1747  0.0127 -4.4824 3 1173.3747173  71510 303863453      863354        syn-C2H3C(O)NH2, v=0
  452407.4165  0.0586 -5.5724 3 1376.1719199  71510 303992674      982771        syn-C2H3C(O)NH2, v=0
  452470.4754  0.0200 -3.2026 3  222.1388 81 -71510 303401228      391129        syn-C2H3C(O)NH2, v=0
  452487.5985  0.1154 -5.6231 3 1767.9988231  71510 303B52293      B52194        syn-C2H3C(O)NH2, v=0
  452488.0955  0.1154 -5.6231 3 1767.9988231  71510 303B52393      B52294        syn-C2H3C(O)NH2, v=0
  452532.5122  0.0281 -5.0484 3 1488.3272199  71510 303993564      993465        syn-C2H3C(O)NH2, v=0
  452532.5269  0.0281 -5.0484 3 1488.3272199  71510 303993565      993466        syn-C2H3C(O)NH2, v=0
  452564.4178  0.0200 -3.8051 3  749.1648129 -71510 303643331      643232        syn-C2H3C(O)NH2, v=0
  452564.4178  0.0200 -3.8051 3  749.1648129 -71510 303643332      643233        syn-C2H3C(O)NH2, v=0
  452576.7011  0.0200 -3.2713 3  517.5555127 -71510 303631152      621251        syn-C2H3C(O)NH2, v=0
  452578.9789  0.0172 -4.2192 3  677.5289159  71510 30379 376      79 277        syn-C2H3C(O)NH2, v=0
  452578.9789  0.0172 -4.2192 3  677.5289159  71510 30379 476      79 377        syn-C2H3C(O)NH2, v=0
  452591.3296  0.0016 -5.1998 3  517.5555127  71510 303631252      621251        syn-C2H3C(O)NH2, v=0
  452602.2602  0.0016 -5.1998 3  517.5547127  71510 303631152      621151        syn-C2H3C(O)NH2, v=0
  452616.8837  0.0200 -3.2713 3  517.5547127 -71510 303631252      621151        syn-C2H3C(O)NH2, v=0
  452636.2684  0.0021 -3.4053 3  458.0004117  71510 303581445      571344        syn-C2H3C(O)NH2, v=0
  452640.5542  0.0043 -4.8397 3  202.5323 79  71510 303391030      39 733        syn-C2H3C(O)NH2, v=0
  452661.1679  0.0044 -4.5636 3  372.9666103  71510 303511635      511338        syn-C2H3C(O)NH2, v=0
  452671.0218  0.1415 -5.9379 3 1601.5038213  71510 303A63076      A53175        syn-C2H3C(O)NH2, v=0
  452671.7702  0.0508 -5.5623 3 1763.8664219  71510 303A93673      A93574        syn-C2H3C(O)NH2, v=0
  452672.5184  0.0508 -5.5623 3 1763.8664219  71510 303A93674      A93575        syn-C2H3C(O)NH2, v=0
  452689.8351  0.0030 -3.3354 3  305.0206 95  71510 303471335      461234        syn-C2H3C(O)NH2, v=0
  452882.2668  0.0175 -4.3136 3  950.8739179  71510 30389 980      89 881        syn-C2H3C(O)NH2, v=0
  452882.2668  0.0175 -4.3136 3  950.8739179  71510 303891080      89 981        syn-C2H3C(O)NH2, v=0
  452932.7047  0.0049 -6.1355 3  856.3870125  71510 303624121      614120        syn-C2H3C(O)NH2, v=0
  452932.7047  0.0049 -6.1355 3  856.3870125  71510 303624122      614121        syn-C2H3C(O)NH2, v=0
  452933.9150  0.0016 -5.3994 3  584.4685123  71510 303612438      602437        syn-C2H3C(O)NH2, v=0
  452933.9166  0.0016 -5.3994 3  584.4685123  71510 303612437      602436        syn-C2H3C(O)NH2, v=0
  452994.8557  0.0200 -3.7841 3  733.4653127 -71510 303633330      633231        syn-C2H3C(O)NH2, v=0
  452994.8557  0.0200 -3.7841 3  733.4653127 -71510 303633331      633232        syn-C2H3C(O)NH2, v=0
  453047.7008  0.0042 -5.0348 3   68.2041 53  71510 30326 224      25 125        syn-C2H3C(O)NH2, v=0
  453049.8684  0.0042 -5.0348 3   68.2041 53  71510 30326 324      25 025        syn-C2H3C(O)NH2, v=0
  453118.4571  0.0210 -4.5297 3  598.8531153  71510 30376 175      76 076        syn-C2H3C(O)NH2, v=0
  453118.4571  0.0210 -4.5297 3  598.8531153  71510 30376 275      76 176        syn-C2H3C(O)NH2, v=0
  453158.2539  0.0045 -6.0795 3  837.4104125  71510 303624022      614021        syn-C2H3C(O)NH2, v=0
  453158.2539  0.0045 -6.0795 3  837.4104125  71510 303624023      614022        syn-C2H3C(O)NH2, v=0
  453180.6667  0.0740 -5.5916 3 1411.3637201  71510 303A02774      992871        syn-C2H3C(O)NH2, v=0
  453264.9052  0.0047 -4.9767 3  178.8118 75  71510 30337 929      37 632        syn-C2H3C(O)NH2, v=0
  453293.6466  0.0055 -5.3563 3  135.1103 67  71510 30333 727      33 430        syn-C2H3C(O)NH2, v=0
  453319.6890  0.0200 -3.4117 3  443.4137115 -71510 303571444      561343        syn-C2H3C(O)NH2, v=0
  453340.4688  0.0200 -3.3245 3  510.6102125 -71510 303621250      611349        syn-C2H3C(O)NH2, v=0
  453355.6133  0.0048 -5.0421 3   65.0154 47  71510 30323 716      22 419        syn-C2H3C(O)NH2, v=0
  453396.9155  0.0041 -6.0255 3  818.9097125  71510 303623923      613922        syn-C2H3C(O)NH2, v=0
  453396.9155  0.0041 -6.0255 3  818.9097125  71510 303623924      613923        syn-C2H3C(O)NH2, v=0
  453405.5819  0.0200 -3.7640 3  718.0170125 -71510 303623329      623230        syn-C2H3C(O)NH2, v=0
  453405.5819  0.0200 -3.7640 3  718.0170125 -71510 303623330      623231        syn-C2H3C(O)NH2, v=0
  453408.8467  0.0120 -4.4443 3 1152.0927171  71510 303853451      853352        syn-C2H3C(O)NH2, v=0
  453408.8467  0.0120 -4.4443 3 1152.0927171  71510 303853452      853353        syn-C2H3C(O)NH2, v=0
  453449.0257  0.0039 -4.7306 3  227.4787 83  71510 303411131      41 834        syn-C2H3C(O)NH2, v=0
  453550.1114  0.0152 -4.1944 3  810.1550169  71510 30384 678      84 579        syn-C2H3C(O)NH2, v=0
  453550.1114  0.0152 -4.1944 3  810.1550169  71510 30384 778      84 679        syn-C2H3C(O)NH2, v=0
  453583.1521  0.0015 -5.1920 3  510.6102125  71510 303621350      611349        syn-C2H3C(O)NH2, v=0
  453637.1961  0.0200 -3.3993 3  472.7366119 -71510 303591446      581345        syn-C2H3C(O)NH2, v=0
  453650.2768  0.0037 -5.9733 3  800.8856125  71510 303623824      613823        syn-C2H3C(O)NH2, v=0
  453650.2768  0.0037 -5.9733 3  800.8856125  71510 303623825      613824        syn-C2H3C(O)NH2, v=0
  453714.4640  0.0933 -5.6972 3 1473.2502205  71510 303A22875      A12972        syn-C2H3C(O)NH2, v=0
  453745.4403  0.0015 -5.1916 3  510.5967125  71510 303621250      611249        syn-C2H3C(O)NH2, v=0
  453797.3860  0.0200 -3.7449 3  702.8197123 -71510 303613328      613229        syn-C2H3C(O)NH2, v=0
  453797.3860  0.0200 -3.7449 3  702.8197123 -71510 303613329      613230        syn-C2H3C(O)NH2, v=0
  453820.4477  0.0052 -5.1456 3  156.3329 71  71510 30335 828      35 531        syn-C2H3C(O)NH2, v=0
  453867.3520  0.0810 -6.0219 3 2006.1036235  71510 303B73780      B73681        syn-C2H3C(O)NH2, v=0
  453875.8191  0.0809 -6.0219 3 2006.1032235  71510 303B73781      B73682        syn-C2H3C(O)NH2, v=0
  453879.0681  0.0026 -5.0205 3  154.2813 65  71510 303321319      321022        syn-C2H3C(O)NH2, v=0
  453920.1592  0.0034 -5.9229 3  783.3393125  71510 303623725      613724        syn-C2H3C(O)NH2, v=0
  453920.1592  0.0034 -5.9229 3  783.3393125  71510 303623726      613725        syn-C2H3C(O)NH2, v=0
  453959.3066  0.0016 -5.3689 3  573.8439123  71510 303612339      602338        syn-C2H3C(O)NH2, v=0
  453959.3295  0.0016 -5.3689 3  573.8439123  71510 303612338      602337        syn-C2H3C(O)NH2, v=0
  453969.4046  0.0696 -5.6484 3 1401.6700201  71510 303A02675      992772        syn-C2H3C(O)NH2, v=0
  453988.1133  0.0015 -3.3232 3  510.5967125  71510 303621350      611249        syn-C2H3C(O)NH2, v=0
  454049.6932  0.0266 -5.0012 3 1463.6888197  71510 303983563      983464        syn-C2H3C(O)NH2, v=0
  454049.7008  0.0266 -5.0012 3 1463.6888197  71510 303983564      983465        syn-C2H3C(O)NH2, v=0
  454059.4587  0.0045 -4.5029 3  545.5380125  71510 303621844      621547        syn-C2H3C(O)NH2, v=0
  454170.9925  0.0200 -3.7268 3  687.8730121 -71510 303603327      603228        syn-C2H3C(O)NH2, v=0
  454170.9925  0.0200 -3.7268 3  687.8730121 -71510 303603328      603229        syn-C2H3C(O)NH2, v=0
  454173.8650  0.1239 -5.6400 3 1447.5825203  71510 303A12873      A02972        syn-C2H3C(O)NH2, v=0
  454208.6625  0.0032 -5.8742 3  766.2719125  71510 303623626      613625        syn-C2H3C(O)NH2, v=0
  454208.6625  0.0032 -5.8742 3  766.2719125  71510 303623627      613626        syn-C2H3C(O)NH2, v=0
  454230.3167  0.0015 -3.9375 3  119.0762 61  71510 30330 922      29 623        syn-C2H3C(O)NH2, v=0
  454276.9783  0.0995 -5.4949 3 1697.8946227  71510 303B32192      B32093        syn-C2H3C(O)NH2, v=0
  454277.1310  0.0995 -5.4949 3 1697.8946227  71510 303B32292      B32193        syn-C2H3C(O)NH2, v=0
  454292.5142  0.0198 -4.3808 3 1006.3324183  71510 303911081      91 982        syn-C2H3C(O)NH2, v=0
  454292.5142  0.0198 -4.3808 3 1006.3324183  71510 303911181      911082        syn-C2H3C(O)NH2, v=0
  454371.8329  0.0113 -4.4069 3 1131.0693169  71510 303843450      843351        syn-C2H3C(O)NH2, v=0
  454371.8329  0.0113 -4.4069 3 1131.0693169  71510 303843451      843352        syn-C2H3C(O)NH2, v=0
  454412.3019  0.0023 -4.9544 3  162.4498 67  71510 303331321      331024        syn-C2H3C(O)NH2, v=0
  454484.3770  0.0014 -5.1180 3  462.7226117  71510 303581444      571443        syn-C2H3C(O)NH2, v=0
  454518.2196  0.0029 -5.8271 3  749.6847125  71510 303623527      613526        syn-C2H3C(O)NH2, v=0
  454518.2196  0.0029 -5.8271 3  749.6847125  71510 303623528      613527        syn-C2H3C(O)NH2, v=0
  454526.8949  0.0200 -3.7097 3  673.1768119 -71510 303593326      593227        syn-C2H3C(O)NH2, v=0
  454526.8949  0.0200 -3.7097 3  673.1768119 -71510 303593327      593228        syn-C2H3C(O)NH2, v=0
  454615.3966  0.0014 -5.1730 3  494.3156121  71510 303601546      591545        syn-C2H3C(O)NH2, v=0
  454638.4339  0.0020 -5.1491 3   55.3967 41  71510 30320 911      19 614        syn-C2H3C(O)NH2, v=0
  454640.9243  0.0200 -3.0769 3  217.1010 79 -71510 303391326      381227        syn-C2H3C(O)NH2, v=0
  454653.4067  0.0014 -5.2247 3  514.1599121  71510 303601843      591842        syn-C2H3C(O)NH2, v=0
  454695.4403  0.1609 -5.9392 3 1940.7164241  71510 303C02496      C02397        syn-C2H3C(O)NH2, v=0
  454698.2466  0.1609 -5.9391 3 1940.7164241  71510 303C02596      C02497        syn-C2H3C(O)NH2, v=0
  454698.9415  0.0479 -5.5083 3 1736.6192217  71510 303A83672      A83573        syn-C2H3C(O)NH2, v=0
  454699.3543  0.0479 -5.5083 3 1736.6192217  71510 303A83673      A83574        syn-C2H3C(O)NH2, v=0
  454804.5374  0.0014 -5.1818 3  502.8399123  71510 303611448      601447        syn-C2H3C(O)NH2, v=0
  454851.6662  0.0028 -5.7817 3  733.5791125  71510 303623428      613427        syn-C2H3C(O)NH2, v=0
  454851.6662  0.0028 -5.7817 3  733.5791125  71510 303623429      613428        syn-C2H3C(O)NH2, v=0
  454865.9405  0.0200 -3.6937 3  658.7306117 -71510 303583325      583226        syn-C2H3C(O)NH2, v=0
  454865.9405  0.0200 -3.6937 3  658.7306117 -71510 303583326      583227        syn-C2H3C(O)NH2, v=0
  454870.5221  0.0042 -3.9678 3  111.4100 61  71510 30330 624      29 525        syn-C2H3C(O)NH2, v=0
  455082.3559  0.0165 -4.1923 3  726.5368163  71510 30381 477      81 378        syn-C2H3C(O)NH2, v=0
  455082.3559  0.0165 -4.1923 3  726.5368163  71510 30381 577      81 478        syn-C2H3C(O)NH2, v=0
  455162.7557  0.0015 -5.3396 3  563.7616123  71510 303612240      602239        syn-C2H3C(O)NH2, v=0
  455163.0395  0.0015 -5.3396 3  563.7616123  71510 303612239      602238        syn-C2H3C(O)NH2, v=0
  455188.6445  0.0200 -3.6788 3  644.5342115 -71510 303573324      573225        syn-C2H3C(O)NH2, v=0
  455188.6445  0.0200 -3.6788 3  644.5342115 -71510 303573325      573226        syn-C2H3C(O)NH2, v=0
  455212.3283  0.0026 -5.7378 3  717.9568125  71510 303623329      613328        syn-C2H3C(O)NH2, v=0
  455212.3283  0.0026 -5.7378 3  717.9568125  71510 303623330      613329        syn-C2H3C(O)NH2, v=0
  455296.6685  0.0107 -4.3703 3 1110.3039167  71510 303833449      833350        syn-C2H3C(O)NH2, v=0
  455296.6685  0.0107 -4.3703 3 1110.3039167  71510 303833450      833351        syn-C2H3C(O)NH2, v=0
  455319.5827  0.0053 -3.8377 3  602.4670133  71510 303661650      651749        syn-C2H3C(O)NH2, v=0
  455495.6378  0.0200 -3.6650 3  630.5874113 -71510 303563323      563224        syn-C2H3C(O)NH2, v=0
  455495.6378  0.0200 -3.6650 3  630.5874113 -71510 303563324      563225        syn-C2H3C(O)NH2, v=0
  455501.0954  0.0226 -4.4553 3 1063.0470187  71510 303931182      931083        syn-C2H3C(O)NH2, v=0
  455501.0954  0.0226 -4.4553 3 1063.0470187  71510 303931282      931183        syn-C2H3C(O)NH2, v=0
  455507.0233  0.0251 -4.9548 3 1439.3146195  71510 303973562      973463        syn-C2H3C(O)NH2, v=0
  455507.0271  0.0251 -4.9548 3 1439.3146195  71510 303973563      973464        syn-C2H3C(O)NH2, v=0
  455537.5468  0.0160 -4.2330 3  862.4139173  71510 30386 779      86 680        syn-C2H3C(O)NH2, v=0
  455537.5468  0.0160 -4.2330 3  862.4139173  71510 30386 879      86 780        syn-C2H3C(O)NH2, v=0
  455542.9341  0.0014 -5.2231 3  514.2034121  71510 303601842      591841        syn-C2H3C(O)NH2, v=0
  455604.1339  0.0025 -5.6954 3  702.8197125  71510 303623230      613229        syn-C2H3C(O)NH2, v=0
  455604.1339  0.0025 -5.6954 3  702.8197125  71510 303623231      613230        syn-C2H3C(O)NH2, v=0
  455700.1201  0.0856 -5.3707 3 1628.9716223  71510 303B12091      B11992        syn-C2H3C(O)NH2, v=0
  455700.1653  0.0856 -5.3707 3 1628.9716223  71510 303B12191      B12092        syn-C2H3C(O)NH2, v=0
  455787.4973  0.0029 -3.6525 3  616.8900111  71510 303553322      553223        syn-C2H3C(O)NH2, v=0
  455787.4973  0.0029 -3.6525 3  616.8900111  71510 303553323      553224        syn-C2H3C(O)NH2, v=0
  455873.5828  0.0028 -3.4172 3  428.9753113  71510 303561443      551342        syn-C2H3C(O)NH2, v=0
  455938.9122  0.0197 -4.3222 3  645.8675157  71510 30378 276      78 177        syn-C2H3C(O)NH2, v=0
  455938.9122  0.0197 -4.3222 3  645.8675157  71510 30378 376      78 277        syn-C2H3C(O)NH2, v=0
  456023.2054  0.0017 -3.3945 3  487.6286121  71510 303601447      591346        syn-C2H3C(O)NH2, v=0
  456031.7589  0.0023 -5.6545 3  688.1701125  71510 303623131      613130        syn-C2H3C(O)NH2, v=0
  456031.7589  0.0023 -5.6545 3  688.1701125  71510 303623132      613131        syn-C2H3C(O)NH2, v=0
  456064.7753  0.0029 -3.6412 3  603.4415109  71510 303543321      543222        syn-C2H3C(O)NH2, v=0
  456064.7753  0.0029 -3.6412 3  603.4415109  71510 303543322      543223        syn-C2H3C(O)NH2, v=0
  456099.8738  0.0019 -3.5229 3  524.8601125  71510 303621448      611547        syn-C2H3C(O)NH2, v=0
  456184.8098  0.0101 -4.3344 3 1089.7963165  71510 303823448      823349        syn-C2H3C(O)NH2, v=0
  456184.8098  0.0101 -4.3344 3 1089.7963165  71510 303823449      823350        syn-C2H3C(O)NH2, v=0
  456328.0324  0.0028 -3.6312 3  590.2419107  71510 303533320      533221        syn-C2H3C(O)NH2, v=0
  456328.0324  0.0028 -3.6312 3  590.2419107  71510 303533321      533222        syn-C2H3C(O)NH2, v=0
  456371.1739  0.0761 -5.9623 3 1976.7593233  71510 303B63779      B63680        syn-C2H3C(O)NH2, v=0
  456376.0505  0.0761 -5.9623 3 1976.7591233  71510 303B63780      B63681        syn-C2H3C(O)NH2, v=0
  456490.3514  0.0015 -5.1782 3  502.6842123  71510 303611348      601347        syn-C2H3C(O)NH2, v=0
  456500.4423  0.0259 -4.5364 3 1121.0115191  71510 303951283      951184        syn-C2H3C(O)NH2, v=0
  456500.4423  0.0259 -4.5364 3 1121.0115191  71510 303951383      951284        syn-C2H3C(O)NH2, v=0
  456500.8193  0.0022 -5.6150 3  674.0107125  71510 303623032      613031        syn-C2H3C(O)NH2, v=0
  456500.8193  0.0022 -5.6150 3  674.0107125  71510 303623033      613032        syn-C2H3C(O)NH2, v=0
  456577.8023  0.0028 -3.6227 3  577.2908105  71510 303523319      523220        syn-C2H3C(O)NH2, v=0
  456577.8023  0.0028 -3.6227 3  577.2908105  71510 303523320      523221        syn-C2H3C(O)NH2, v=0
  456600.3512  0.0015 -5.3113 3  554.2396123  71510 303612141      602140        syn-C2H3C(O)NH2, v=0
  456603.4253  0.0015 -5.3113 3  554.2397123  71510 303612140      602139        syn-C2H3C(O)NH2, v=0
  456642.8748  0.0452 -5.4550 3 1709.6415215  71510 303A73671      A73572        syn-C2H3C(O)NH2, v=0
  456643.1005  0.0452 -5.4550 3 1709.6415215  71510 303A73672      A73573        syn-C2H3C(O)NH2, v=0
  456784.3857  0.0736 -5.2505 3 1561.2378219  71510 303A91990      A91891        syn-C2H3C(O)NH2, v=0
  456784.3985  0.0736 -5.2505 3 1561.2378219  71510 303A92090      A91991        syn-C2H3C(O)NH2, v=0
  456814.6029  0.0028 -3.6157 3  564.5881103  71510 303513318      513219        syn-C2H3C(O)NH2, v=0
  456814.6029  0.0028 -3.6157 3  564.5881103  71510 303513319      513220        syn-C2H3C(O)NH2, v=0
  456836.9378  0.0012 -3.1012 3  227.0533 81  71510 303401328      391227        syn-C2H3C(O)NH2, v=0
  456887.1552  0.0014 -5.2012 3  507.0844121  71510 303601744      591743        syn-C2H3C(O)NH2, v=0
  456907.2185  0.0237 -4.9092 3 1415.2039193  71510 303963561      963462        syn-C2H3C(O)NH2, v=0
  456907.2204  0.0237 -4.9092 3 1415.2039193  71510 303963562      963463        syn-C2H3C(O)NH2, v=0
  456925.4549  0.0071 -6.0944 3   93.8521 55  71510 30327 819      27 324        syn-C2H3C(O)NH2, v=0
  457002.0187  0.0010 -2.9843 3  203.7384 75  71510 303371424      361323        syn-C2H3C(O)NH2, v=0
  457018.1285  0.0021 -5.5770 3  660.3446125  71510 303622933      612932        syn-C2H3C(O)NH2, v=0
  457018.1285  0.0021 -5.5770 3  660.3446125  71510 303622934      612933        syn-C2H3C(O)NH2, v=0
  457024.4221  0.0026 -5.2150 3  565.0303145  71510 30372 369      71 368        syn-C2H3C(O)NH2, v=0
  457024.4217  0.0200 -3.0565 3  565.0303145 -71510 30372 369      71 468        syn-C2H3C(O)NH2, v=0
  457024.4217  0.0200 -3.0565 3  565.0303145 -71510 30372 469      71 368        syn-C2H3C(O)NH2, v=0
  457024.4221  0.0026 -5.2150 3  565.0303145  71510 30372 469      71 468        syn-C2H3C(O)NH2, v=0
  457029.1748  0.0025 -5.2190 3  562.9524143  71510 30371 467      70 466        syn-C2H3C(O)NH2, v=0
  457029.1748  0.0025 -3.0779 3  562.9524143  71510 30371 467      70 566        syn-C2H3C(O)NH2, v=0
  457029.1748  0.0025 -3.0779 3  562.9524143  71510 30371 567      70 466        syn-C2H3C(O)NH2, v=0
  457029.1748  0.0025 -5.2190 3  562.9524143  71510 30371 567      70 566        syn-C2H3C(O)NH2, v=0
  457029.6164  0.0030 -5.2100 3  566.5863147  71510 30373 271      72 270        syn-C2H3C(O)NH2, v=0
  457029.6164  0.0030 -3.0356 3  566.5863147  71510 30373 271      72 370        syn-C2H3C(O)NH2, v=0
  457029.6164  0.0030 -3.0356 3  566.5863147  71510 30373 371      72 270        syn-C2H3C(O)NH2, v=0
  457029.6164  0.0030 -5.2100 3  566.5863147  71510 30373 371      72 370        syn-C2H3C(O)NH2, v=0
  457037.6408  0.0096 -4.2993 3 1069.5458163  71510 303813447      813348        syn-C2H3C(O)NH2, v=0
  457037.6408  0.0096 -4.2993 3 1069.5458163  71510 303813448      813349        syn-C2H3C(O)NH2, v=0
  457038.9375  0.0029 -3.6103 3  552.1334101  71510 303503317      503218        syn-C2H3C(O)NH2, v=0
  457038.9375  0.0029 -3.6103 3  552.1334101  71510 303503318      503219        syn-C2H3C(O)NH2, v=0
  457039.8144  0.0038 -5.2039 3  567.6277149  71510 30374 173      73 172        syn-C2H3C(O)NH2, v=0
  457039.8256  0.0200 -3.0151 3  567.6277149 -71510 30374 173      73 272        syn-C2H3C(O)NH2, v=0
  457039.8256  0.0200 -3.0151 3  567.6277149 -71510 30374 273      73 172        syn-C2H3C(O)NH2, v=0
  457039.8144  0.0038 -5.2039 3  567.6277149  71510 30374 273      73 272        syn-C2H3C(O)NH2, v=0
  457050.6315  0.0025 -5.2220 3  560.3437141  71510 30370 565      69 564        syn-C2H3C(O)NH2, v=0
  457050.6315  0.0025 -3.1000 3  560.3437141  71510 30370 565      69 664        syn-C2H3C(O)NH2, v=0
  457050.6315  0.0025 -3.1000 3  560.3437141  71510 30370 665      69 564        syn-C2H3C(O)NH2, v=0
  457050.6315  0.0025 -5.2220 3  560.3437141  71510 30370 665      69 664        syn-C2H3C(O)NH2, v=0
  457051.3456  0.0051 -5.1969 3  568.1605151  71510 30375 075      74 074        syn-C2H3C(O)NH2, v=0
  457051.3456  0.0051 -2.9947 3  568.1605151  71510 30375 075      74 174        syn-C2H3C(O)NH2, v=0
  457051.3456  0.0051 -2.9947 3  568.1605151  71510 30375 175      74 074        syn-C2H3C(O)NH2, v=0
  457051.3456  0.0051 -5.1969 3  568.1605151  71510 30375 175      74 174        syn-C2H3C(O)NH2, v=0
  457080.5834  0.0200 -2.9841 3  203.7362 75 -71510 303371423      361324        syn-C2H3C(O)NH2, v=0
  457098.1981  0.0024 -5.2239 3  557.1931139  71510 30369 663      68 662        syn-C2H3C(O)NH2, v=0
  457098.1961  0.0200 -3.1231 3  557.1931139 -71510 30369 663      68 762        syn-C2H3C(O)NH2, v=0
  457098.1961  0.0200 -3.1231 3  557.1931139 -71510 30369 763      68 662        syn-C2H3C(O)NH2, v=0
  457098.1981  0.0024 -5.2239 3  557.1931139  71510 30369 763      68 762        syn-C2H3C(O)NH2, v=0
  457157.6595  0.0030 -4.5911 3  269.9133 89  71510 303441332      441035        syn-C2H3C(O)NH2, v=0
  457183.3410  0.1394 -5.8019 3 1867.6592237  71510 303B82395      B82296        syn-C2H3C(O)NH2, v=0
  457184.2583  0.1394 -5.8019 3 1867.6592237  71510 303B82495      B82396        syn-C2H3C(O)NH2, v=0
  457185.2667  0.0200 -3.1477 3  553.4868137 -71510 30368 761      67 860        syn-C2H3C(O)NH2, v=0
  457185.2715  0.0024 -5.2245 3  553.4868137  71510 30368 761      67 760        syn-C2H3C(O)NH2, v=0
  457185.2667  0.0200 -3.1477 3  553.4868137 -71510 30368 861      67 760        syn-C2H3C(O)NH2, v=0
  457185.2715  0.0024 -5.2245 3  553.4868137  71510 30368 861      67 860        syn-C2H3C(O)NH2, v=0
  457230.4238  0.0040 -4.5789 3   78.6005 55  71510 30327 324      26 225        syn-C2H3C(O)NH2, v=0
  457251.2951  0.0029 -3.6067 3  539.9267 99  71510 303493316      493217        syn-C2H3C(O)NH2, v=0
  457251.2951  0.0029 -3.6067 3  539.9267 99  71510 303493317      493218        syn-C2H3C(O)NH2, v=0
  457256.2011  0.0040 -4.5788 3   78.6005 55  71510 30327 424      26 125        syn-C2H3C(O)NH2, v=0
  457282.1368  0.0299 -4.6233 3 1180.2201195  71510 303971384      971285        syn-C2H3C(O)NH2, v=0
  457282.1368  0.0299 -4.6233 3 1180.2201195  71510 303971484      971385        syn-C2H3C(O)NH2, v=0
  457331.4917  0.0200 -3.1744 3  549.2073135 -71510 30367 859      66 958        syn-C2H3C(O)NH2, v=0
  457331.4982  0.0022 -5.2240 3  549.2073135  71510 30367 959      66 958        syn-C2H3C(O)NH2, v=0
  457331.4986  0.0022 -5.2240 3  549.2073135  71510 30367 859      66 858        syn-C2H3C(O)NH2, v=0
  457331.4917  0.0200 -3.1744 3  549.2073135 -71510 30367 959      66 858        syn-C2H3C(O)NH2, v=0
  457344.7198  0.0173 -4.2834 3  915.9464177  71510 30388 880      88 781        syn-C2H3C(O)NH2, v=0
  457344.7198  0.0173 -4.2834 3  915.9464177  71510 30388 980      88 881        syn-C2H3C(O)NH2, v=0
  457374.2276  0.0068 -4.5214 3  611.8731133  71510 303661848      661551        syn-C2H3C(O)NH2, v=0
  457408.9586  0.0014 -5.1830 3  500.5754121  71510 303601645      591644        syn-C2H3C(O)NH2, v=0
  457418.3970  0.0033 -5.5884 3  115.5666 59  71510 303291019      29 524        syn-C2H3C(O)NH2, v=0
  457421.1944  0.0163 -4.1964 3  776.8351167  71510 30383 578      83 479        syn-C2H3C(O)NH2, v=0
  457421.1944  0.0163 -4.1964 3  776.8351167  71510 30383 678      83 579        syn-C2H3C(O)NH2, v=0
  457452.1543  0.0200 -3.6050 3  527.9675 97 -71510 303483315      483216        syn-C2H3C(O)NH2, v=0
  457452.1543  0.0200 -3.6050 3  527.9675 97 -71510 303483316      483217        syn-C2H3C(O)NH2, v=0
  457488.8196  0.0036 -4.6489 3  253.6360 87  71510 303431232      43 935        syn-C2H3C(O)NH2, v=0
  457553.0952  0.0633 -5.1346 3 1494.7009215  71510 303A71889      A71790        syn-C2H3C(O)NH2, v=0
  457553.0987  0.0633 -5.1346 3 1494.7009215  71510 303A71989      A71890        syn-C2H3C(O)NH2, v=0
  457566.8410  0.0200 -3.2038 3  544.3314133 -71510 30366 957      651056        syn-C2H3C(O)NH2, v=0
  457566.8162  0.0021 -5.2220 3  544.3314133  71510 303661057      651056        syn-C2H3C(O)NH2, v=0
  457566.8280  0.0021 -5.2220 3  544.3314133  71510 30366 957      65 956        syn-C2H3C(O)NH2, v=0
  457566.8410  0.0200 -3.2038 3  544.3314133 -71510 303661057      65 956        syn-C2H3C(O)NH2, v=0
  457592.0496  0.0020 -5.5403 3  647.1755125  71510 303622834      612833        syn-C2H3C(O)NH2, v=0
  457592.0496  0.0020 -5.5403 3  647.1755125  71510 303622835      612834        syn-C2H3C(O)NH2, v=0
  457641.9581  0.0200 -3.6054 3  516.2558 95 -71510 303473314      473215        syn-C2H3C(O)NH2, v=0
  457641.9581  0.0200 -3.6054 3  516.2558 95 -71510 303473315      473216        syn-C2H3C(O)NH2, v=0
  457821.1954  0.0200 -3.6081 3  504.7914 93 -71510 303463313      463214        syn-C2H3C(O)NH2, v=0
  457821.1954  0.0200 -3.6081 3  504.7914 93 -71510 303463314      463215        syn-C2H3C(O)NH2, v=0
  457826.5000  0.1499 -6.1106 3 1695.0957219  71510 303A93179      A83276        syn-C2H3C(O)NH2, v=0
  457836.7833  0.0346 -4.7158 3 1240.6665199  71510 303991485      991386        syn-C2H3C(O)NH2, v=0
  457836.7833  0.0346 -4.7158 3 1240.6665199  71510 303991585      991486        syn-C2H3C(O)NH2, v=0
  457856.4781  0.0091 -4.2649 3 1049.5522161  71510 303803446      803347        syn-C2H3C(O)NH2, v=0
  457856.4781  0.0091 -4.2649 3 1049.5522161  71510 303803447      803348        syn-C2H3C(O)NH2, v=0
  457907.4852  0.0200 -2.6940 3  156.0515 47 -71510 3032321 2      2220 3        syn-C2H3C(O)NH2, v=0
  457907.4852  0.0200 -2.6940 3  156.0515 47 -71510 3032321 3      2220 2        syn-C2H3C(O)NH2, v=0
  457938.8114  0.0019 -3.2372 3  538.8278131  71510 303651055      641154        syn-C2H3C(O)NH2, v=0
  457939.1855  0.0019 -5.2184 3  538.8278131  71510 303651155      641154        syn-C2H3C(O)NH2, v=0
  457939.4937  0.0019 -5.2184 3  538.8278131  71510 303651055      641054        syn-C2H3C(O)NH2, v=0
  457939.8678  0.0019 -3.2372 3  538.8278131  71510 303651155      641054        syn-C2H3C(O)NH2, v=0
  457990.2697  0.0200 -3.6135 3  493.5739 91 -71510 303453312      453213        syn-C2H3C(O)NH2, v=0
  457990.2697  0.0200 -3.6135 3  493.5739 91 -71510 303453313      453214        syn-C2H3C(O)NH2, v=0
  458026.3246  0.0544 -5.0230 3 1429.3683211  71510 303A51788      A51689        syn-C2H3C(O)NH2, v=0
  458026.3255  0.0544 -5.0230 3 1429.3683211  71510 303A51888      A51789        syn-C2H3C(O)NH2, v=0
  458085.0307  0.0015 -5.1197 3  466.6646117  71510 303581543      571542        syn-C2H3C(O)NH2, v=0
  458109.5515  0.0023 -5.0151 3  154.1401 65  71510 303321320      321023        syn-C2H3C(O)NH2, v=0
  458149.6068  0.0200 -3.6217 3  482.6033 89 -71510 303443311      443212        syn-C2H3C(O)NH2, v=0
  458149.6068  0.0200 -3.6217 3  482.6033 89 -71510 303443312      443213        syn-C2H3C(O)NH2, v=0
  458153.8535  0.0402 -4.8134 3 1302.3443203  71510 303A11586      A11487        syn-C2H3C(O)NH2, v=0
  458153.8536  0.0402 -4.8134 3 1302.3443203  71510 303A11686      A11587        syn-C2H3C(O)NH2, v=0
  458203.6268  0.0028 -3.3018 3  292.9230 93  71510 303461334      451233        syn-C2H3C(O)NH2, v=0
  458221.4998  0.0467 -4.9159 3 1365.2472207  71510 303A31687      A31588        syn-C2H3C(O)NH2, v=0
  458221.5001  0.0467 -4.9159 3 1365.2472207  71510 303A31787      A31688        syn-C2H3C(O)NH2, v=0
  458232.9891  0.0020 -5.5050 3  634.5079125  71510 303622735      612734        syn-C2H3C(O)NH2, v=0
  458232.9891  0.0020 -5.5050 3  634.5079125  71510 303622736      612735        syn-C2H3C(O)NH2, v=0
  458252.8120  0.0224 -4.8642 3 1391.3562191  71510 303953560      953461        syn-C2H3C(O)NH2, v=0
  458252.8130  0.0224 -4.8642 3 1391.3562191  71510 303953561      953462        syn-C2H3C(O)NH2, v=0
  458299.6236  0.0033 -3.6334 3  471.8792 87  71510 303433310      433211        syn-C2H3C(O)NH2, v=0
  458299.6236  0.0033 -3.6334 3  471.8792 87  71510 303433311      433212        syn-C2H3C(O)NH2, v=0
  458330.2523  0.0200 -2.7213 3  158.3077 51 -71510 3032520 5      2419 6        syn-C2H3C(O)NH2, v=0
  458330.2523  0.0200 -2.7213 3  158.3077 51 -71510 3032520 6      2419 5        syn-C2H3C(O)NH2, v=0
  458352.2923  0.0015 -5.2840 3  545.3027123  71510 303612042      602041        syn-C2H3C(O)NH2, v=0
  458380.9689  0.0015 -5.2839 3  545.3038123  71510 303612041      602040        syn-C2H3C(O)NH2, v=0
  458440.7560  0.0200 -3.6491 3  461.4016 85 -71510 3034233 9      423210        syn-C2H3C(O)NH2, v=0
  458440.7560  0.0200 -3.6491 3  461.4016 85 -71510 303423310      423211        syn-C2H3C(O)NH2, v=0
  458508.0546  0.0427 -5.4025 3 1682.9323213  71510 303A63670      A63571        syn-C2H3C(O)NH2, v=0
  458508.1769  0.0427 -5.4025 3 1682.9323213  71510 303A63671      A63572        syn-C2H3C(O)NH2, v=0
  458520.8910  0.0200 -3.2767 3  532.6523129 -71510 303641153      631252        syn-C2H3C(O)NH2, v=0
  458529.2597  0.0018 -5.2130 3  532.6523129  71510 303641253      631252        syn-C2H3C(O)NH2, v=0
  458535.5688  0.0018 -5.2130 3  532.6518129  71510 303641153      631152        syn-C2H3C(O)NH2, v=0
  458543.8772  0.0200 -3.2766 3  532.6518129 -71510 303641253      631152        syn-C2H3C(O)NH2, v=0
  458565.9464  0.0010 -2.9173 3  192.1759 71  71510 303351521      341420        syn-C2H3C(O)NH2, v=0
  458567.1600  0.0010 -2.9173 3  192.1758 71  71510 303351520      341421        syn-C2H3C(O)NH2, v=0
  458573.3572  0.0200 -3.6694 3  451.1702 83 -71510 3034133 8      4132 9        syn-C2H3C(O)NH2, v=0
  458573.3572  0.0200 -3.6694 3  451.1702 83 -71510 3034133 9      413210        syn-C2H3C(O)NH2, v=0
  458603.7654  0.0187 -4.2426 3  694.1831161  71510 30380 377      80 278        syn-C2H3C(O)NH2, v=0
  458603.7654  0.0187 -4.2426 3  694.1831161  71510 30380 477      80 378        syn-C2H3C(O)NH2, v=0
  458642.5761  0.0086 -4.2312 3 1029.8148159  71510 303793445      793346        syn-C2H3C(O)NH2, v=0
  458642.5761  0.0086 -4.2312 3 1029.8148159  71510 303793446      793347        syn-C2H3C(O)NH2, v=0
  458697.7449  0.0200 -3.6955 3  441.1849 81 -71510 3034033 7      4032 8        syn-C2H3C(O)NH2, v=0
  458697.7449  0.0200 -3.6955 3  441.1849 81 -71510 3034033 8      4032 9        syn-C2H3C(O)NH2, v=0
  458718.4287  0.0200 -2.7508 3  162.0414 55 -71510 3032719 8      2618 9        syn-C2H3C(O)NH2, v=0
  458718.4287  0.0200 -2.7508 3  162.0414 55 -71510 3032719 9      2618 8        syn-C2H3C(O)NH2, v=0
  458766.0798  0.0716 -5.9035 3 1947.6892231  71510 303B53778      B53679        syn-C2H3C(O)NH2, v=0
  458768.8638  0.0716 -5.9035 3 1947.6891231  71510 303B53779      B53680        syn-C2H3C(O)NH2, v=0
  458814.3716  0.0200 -3.7288 3  431.4455 79 -71510 3033933 6      3932 7        syn-C2H3C(O)NH2, v=0
  458814.3716  0.0200 -3.7288 3  431.4455 79 -71510 3033933 7      3932 8        syn-C2H3C(O)NH2, v=0
  458837.2030  0.0015 -3.3989 3  518.0106125  71510 303621349      611448        syn-C2H3C(O)NH2, v=0
  458865.5465  0.1925 -6.1295 3 2044.7420247  71510 303C32598      C32499        syn-C2H3C(O)NH2, v=0
  458870.5254  0.1924 -6.1295 3 2044.7420247  71510 303C32698      C32599        syn-C2H3C(O)NH2, v=0
  458923.6201  0.0200 -3.7714 3  421.9517 77 -71510 3033833 5      3832 6        syn-C2H3C(O)NH2, v=0
  458923.6201  0.0200 -3.7714 3  421.9517 77 -71510 3033833 6      3832 7        syn-C2H3C(O)NH2, v=0
  458954.1068  0.0019 -5.4710 3  622.3474125  71510 303622636      612635        syn-C2H3C(O)NH2, v=0
  458954.1068  0.0019 -5.4710 3  622.3474125  71510 303622637      612636        syn-C2H3C(O)NH2, v=0
  458966.2417  0.0192 -4.3436 3  970.7467181  71510 30390 981      90 882        syn-C2H3C(O)NH2, v=0
  458966.2417  0.0192 -4.3436 3  970.7467181  71510 303901081      90 982        syn-C2H3C(O)NH2, v=0
  459025.8012  0.0200 -3.8264 3  412.7035 75 -71510 3033733 4      3732 5        syn-C2H3C(O)NH2, v=0
  459025.8012  0.0200 -3.8264 3  412.7035 75 -71510 3033733 5      3732 6        syn-C2H3C(O)NH2, v=0
  459034.5478  0.0200 -2.7837 3  167.2674 59 -71510 303291811      281712        syn-C2H3C(O)NH2, v=0
  459034.5478  0.0200 -2.7837 3  167.2674 59 -71510 303291812      281711        syn-C2H3C(O)NH2, v=0
  459121.2074  0.0042 -3.8995 3  403.7007 73  71510 3033633 3      3632 4        syn-C2H3C(O)NH2, v=0
  459121.2074  0.0042 -3.8995 3  403.7007 73  71510 3033633 4      3632 5        syn-C2H3C(O)NH2, v=0
  459131.7487  0.0200 -2.8647 3  182.2936 67 -71510 303331618      321517        syn-C2H3C(O)NH2, v=0
  459131.7487  0.0200 -2.8647 3  182.2936 67 -71510 303331617      321518        syn-C2H3C(O)NH2, v=0
  459143.4174  0.0226 -4.5510 3  614.5015155  71510 30377 176      77 077        syn-C2H3C(O)NH2, v=0
  459143.4174  0.0226 -4.5510 3  614.5015155  71510 30377 276      77 177        syn-C2H3C(O)NH2, v=0
  459210.2222  0.0044 -4.0009 3  394.9431 71  71510 3033533 2      3532 3        syn-C2H3C(O)NH2, v=0
  459210.2222  0.0044 -4.0009 3  394.9431 71  71510 3033533 3      3532 4        syn-C2H3C(O)NH2, v=0
  459212.1789  0.0200 -2.8211 3  174.0074 63 -71510 303311715      301614        syn-C2H3C(O)NH2, v=0
  459212.1789  0.0200 -2.8211 3  174.0074 63 -71510 303311714      301615        syn-C2H3C(O)NH2, v=0
  459225.9004  0.0025 -5.0828 3  146.1760 63  71510 303311318      311021        syn-C2H3C(O)NH2, v=0
  459252.4006  0.1206 -5.6686 3 1795.7676233  71510 303B62294      B62195        syn-C2H3C(O)NH2, v=0
  459252.6897  0.1206 -5.6686 3 1795.7676233  71510 303B62394      B62295        syn-C2H3C(O)NH2, v=0
  459293.1471  0.0045 -4.1537 3  386.4305 69  71510 3033433 1      3432 2        syn-C2H3C(O)NH2, v=0
  459293.1471  0.0045 -4.1537 3  386.4305 69  71510 3033433 2      3432 3        syn-C2H3C(O)NH2, v=0
  459309.3591  0.0048 -4.5369 3  447.7525113  71510 303561739      561442        syn-C2H3C(O)NH2, v=0
  459315.8548  0.0200 -3.3263 3  525.7401127 -71510 303631251      621350        syn-C2H3C(O)NH2, v=0
  459370.2904  0.0047 -4.4317 3  378.1628 67  71510 3033333 0      3332 1        syn-C2H3C(O)NH2, v=0
  459370.2904  0.0047 -4.4317 3  378.1628 67  71510 3033333 1      3332 2        syn-C2H3C(O)NH2, v=0
  459397.1317  0.0082 -4.1983 3 1010.3334157  71510 303783444      783345        syn-C2H3C(O)NH2, v=0
  459397.1317  0.0082 -4.1983 3 1010.3334157  71510 303783445      783346        syn-C2H3C(O)NH2, v=0
  459459.9240  0.0015 -5.1338 3  477.8825119  71510 303591445      581444        syn-C2H3C(O)NH2, v=0
  459459.9753  0.0017 -5.2053 3  525.7401127  71510 303631351      621350        syn-C2H3C(O)NH2, v=0
  459472.3407  0.0016 -3.3911 3  502.6842123  71510 303611448      601347        syn-C2H3C(O)NH2, v=0
  459546.1718  0.0212 -4.8200 3 1367.7709189  71510 303943559      943460        syn-C2H3C(O)NH2, v=0
  459546.1723  0.0212 -4.8200 3 1367.7709189  71510 303943560      943461        syn-C2H3C(O)NH2, v=0
  459558.5140  0.0017 -5.2051 3  525.7320127  71510 303631251      621250        syn-C2H3C(O)NH2, v=0
  459591.5368  0.0167 -4.2211 3  828.4181171  71510 30385 679      85 580        syn-C2H3C(O)NH2, v=0
  459591.5368  0.0167 -4.2211 3  828.4181171  71510 30385 779      85 680        syn-C2H3C(O)NH2, v=0
  459702.6483  0.0017 -3.3255 3  525.7320127  71510 303631351      621250        syn-C2H3C(O)NH2, v=0
  459772.3716  0.0018 -5.4383 3  610.7008125  71510 303622538      612537        syn-C2H3C(O)NH2, v=0
  459772.3719  0.0018 -5.4383 3  610.7008125  71510 303622537      612536        syn-C2H3C(O)NH2, v=0
  459839.3863  0.0039 -4.3015 3   89.2809 57  71510 30328 424      27 325        syn-C2H3C(O)NH2, v=0
  459921.3681  0.0039 -4.1077 3  100.2253 59  71510 30329 524      28 425        syn-C2H3C(O)NH2, v=0
  460056.7509  0.0056 -4.7933 3  247.7460 87  71510 303431033      43 736        syn-C2H3C(O)NH2, v=0
  460059.9010  0.0038 -4.3012 3   89.2808 57  71510 30328 524      27 225        syn-C2H3C(O)NH2, v=0
  460121.2877  0.0078 -4.1662 3  991.1076155  71510 303773443      773344        syn-C2H3C(O)NH2, v=0
  460121.2877  0.0078 -4.1662 3  991.1076155  71510 303773444      773345        syn-C2H3C(O)NH2, v=0
  460257.7549  0.1408 -5.7999 3 1536.6143209  71510 303A42975      A33074        syn-C2H3C(O)NH2, v=0
  460278.5913  0.0031 -3.4199 3  414.6919111  71510 303551442      541341        syn-C2H3C(O)NH2, v=0
  460298.5825  0.0404 -5.3507 3 1656.4908211  71510 303A53669      A53570        syn-C2H3C(O)NH2, v=0
  460298.6256  0.0033 -4.7805 3  222.8115 79  71510 303391425      391128        syn-C2H3C(O)NH2, v=0
  460298.6482  0.0404 -5.3507 3 1656.4908211  71510 303A53670      A53571        syn-C2H3C(O)NH2, v=0
  460396.1794  0.0216 -4.4121 3 1026.8091185  71510 303921082      92 983        syn-C2H3C(O)NH2, v=0
  460396.1794  0.0216 -4.4121 3 1026.8091185  71510 303921182      921083        syn-C2H3C(O)NH2, v=0
  460480.5183  0.1634 -6.1053 3 1695.0877219  71510 303A93178      A83277        syn-C2H3C(O)NH2, v=0
  460503.8565  0.0015 -5.2575 3  536.9851123  71510 303611943      601942        syn-C2H3C(O)NH2, v=0
  460540.0397  0.0017 -5.1539 3  486.4113119  71510 303591643      581642        syn-C2H3C(O)NH2, v=0
  460568.5010  0.0047 -6.0806 3  852.5262127  71510 303634023      624022        syn-C2H3C(O)NH2, v=0
  460568.5010  0.0047 -6.0806 3  852.5262127  71510 303634024      624023        syn-C2H3C(O)NH2, v=0
  460710.1937  0.0018 -5.4068 3  599.5768125  71510 303622439      612438        syn-C2H3C(O)NH2, v=0
  460710.1973  0.0018 -5.4068 3  599.5768125  71510 303622438      612437        syn-C2H3C(O)NH2, v=0
  460715.1375  0.0016 -5.1951 3  518.0106125  71510 303621449      611448        syn-C2H3C(O)NH2, v=0
  460728.9626  0.0015 -5.2571 3  536.9950123  71510 303611942      601941        syn-C2H3C(O)NH2, v=0
  460764.8705  0.0020 -5.0392 3   60.3853 43  71510 30321 912      20 615        syn-C2H3C(O)NH2, v=0
  460789.5162  0.0201 -4.7765 3 1344.4472187  71510 303933558      933459        syn-C2H3C(O)NH2, v=0
  460789.5164  0.0201 -4.7765 3 1344.4472187  71510 303933559      933460        syn-C2H3C(O)NH2, v=0
  460816.1372  0.0074 -4.1348 3  972.1369153  71510 303763442      763343        syn-C2H3C(O)NH2, v=0
  460816.1372  0.0074 -4.1348 3  972.1369153  71510 303763443      763344        syn-C2H3C(O)NH2, v=0
  460817.5921  0.0043 -6.0274 3  834.0333127  71510 303633924      623923        syn-C2H3C(O)NH2, v=0
  460817.5921  0.0043 -6.0274 3  834.0333127  71510 303633925      623924        syn-C2H3C(O)NH2, v=0
  460838.9026  0.0014 -3.1253 3  237.2316 83  71510 303411329      401228        syn-C2H3C(O)NH2, v=0
  460852.1785  0.0031 -3.6609 3  563.0470129  71510 303641549      631648        syn-C2H3C(O)NH2, v=0
  460938.4964  0.1042 -5.5392 3 1725.0503229  71510 303B42193      B42094        syn-C2H3C(O)NH2, v=0
  460938.5841  0.1042 -5.5392 3 1725.0503229  71510 303B42293      B42194        syn-C2H3C(O)NH2, v=0
  460992.7556  0.0038 -4.6592 3  292.9230 91  71510 303451530      451233        syn-C2H3C(O)NH2, v=0
  461013.3113  0.1340 -5.9766 3 1628.3101215  71510 303A73078      A63175        syn-C2H3C(O)NH2, v=0
  461059.0704  0.0675 -5.8455 3 1918.8920229  71510 303B43777      B43678        syn-C2H3C(O)NH2, v=0
  461060.6457  0.0675 -5.8455 3 1918.8919229  71510 303B43778      B43679        syn-C2H3C(O)NH2, v=0
  461082.1866  0.0040 -5.9759 3  816.0178127  71510 303633825      623824        syn-C2H3C(O)NH2, v=0
  461082.1866  0.0040 -5.9759 3  816.0178127  71510 303633826      623825        syn-C2H3C(O)NH2, v=0
  461085.3668  0.0015 -5.1850 3  509.4799123  71510 303611547      601546        syn-C2H3C(O)NH2, v=0
  461109.7814  0.0181 -4.2170 3  743.7944165  71510 30382 478      82 379        syn-C2H3C(O)NH2, v=0
  461109.7814  0.0181 -4.2170 3  743.7944165  71510 30382 578      82 479        syn-C2H3C(O)NH2, v=0
  461340.1057  0.0037 -4.1058 3  100.2248 59  71510 30329 624      28 325        syn-C2H3C(O)NH2, v=0
  461364.2064  0.0037 -5.9261 3  798.4805127  71510 303633726      623725        syn-C2H3C(O)NH2, v=0
  461364.2064  0.0037 -5.9261 3  798.4805127  71510 303633727      623726        syn-C2H3C(O)NH2, v=0
  461389.7932  0.0016 -5.1931 3  507.3558121  71510 303601743      591742        syn-C2H3C(O)NH2, v=0
  461452.9751  0.0200 -3.0945 3  226.9284 81 -71510 303401327      391228        syn-C2H3C(O)NH2, v=0
  461482.7265  0.0070 -4.1042 3  953.4209151  71510 303753441      753342        syn-C2H3C(O)NH2, v=0
  461482.7265  0.0070 -4.1042 3  953.4209151  71510 303753442      753343        syn-C2H3C(O)NH2, v=0
  461589.0593  0.0176 -4.2610 3  881.2803175  71510 30387 780      87 681        syn-C2H3C(O)NH2, v=0
  461589.0593  0.0176 -4.2610 3  881.2803175  71510 30387 880      87 781        syn-C2H3C(O)NH2, v=0
  461627.9844  0.0245 -4.4879 3 1084.1279189  71510 303941183      941084        syn-C2H3C(O)NH2, v=0
  461627.9844  0.0245 -4.4879 3 1084.1279189  71510 303941283      941184        syn-C2H3C(O)NH2, v=0
  461665.0409  0.1672 -5.9873 3 1969.9108243  71510 303C12497      C12398        syn-C2H3C(O)NH2, v=0
  461665.8692  0.0034 -5.8780 3  781.4227127  71510 303633627      623626        syn-C2H3C(O)NH2, v=0
  461665.8692  0.0034 -5.8780 3  781.4227127  71510 303633628      623627        syn-C2H3C(O)NH2, v=0
  461666.5707  0.0023 -5.0795 3  146.0945 63  71510 303311319      311022        syn-C2H3C(O)NH2, v=0
  461666.7068  0.1672 -5.9873 3 1969.9108243  71510 303C12597      C12498        syn-C2H3C(O)NH2, v=0
  461738.3951  0.0034 -3.9611 3  111.4059 61  71510 30330 724      29 425        syn-C2H3C(O)NH2, v=0
  461798.0623  0.0017 -5.3765 3  588.9864125  71510 303622340      612339        syn-C2H3C(O)NH2, v=0
  461798.1095  0.0017 -5.3765 3  588.9864125  71510 303622339      612338        syn-C2H3C(O)NH2, v=0
  461819.1923  0.0016 -5.1928 3  517.9111125  71510 303621349      611348        syn-C2H3C(O)NH2, v=0
  461830.3284  0.0729 -5.6366 3 1436.8848203  71510 303A12775      A02872        syn-C2H3C(O)NH2, v=0
  461962.3212  0.0213 -4.3449 3  662.1195159  71510 30379 277      79 178        syn-C2H3C(O)NH2, v=0
  461962.3212  0.0213 -4.3449 3  662.1195159  71510 30379 377      79 278        syn-C2H3C(O)NH2, v=0
  461984.9275  0.0190 -4.7338 3 1321.3848185  71510 303923557      923458        syn-C2H3C(O)NH2, v=0
  461984.9276  0.0190 -4.7338 3 1321.3848185  71510 303923558      923459        syn-C2H3C(O)NH2, v=0
  461989.7470  0.0032 -5.8315 3  764.8458127  71510 303633528      623527        syn-C2H3C(O)NH2, v=0
  461989.7470  0.0032 -5.8315 3  764.8458127  71510 303633529      623528        syn-C2H3C(O)NH2, v=0
  462018.2258  0.0382 -5.2997 3 1630.3163209  71510 303A43668      A43569        syn-C2H3C(O)NH2, v=0
  462018.2607  0.0382 -5.2997 3 1630.3163209  71510 303A43669      A43570        syn-C2H3C(O)NH2, v=0
  462122.0583  0.0067 -4.0743 3  934.9594149  71510 303743440      743341        syn-C2H3C(O)NH2, v=0
  462122.0583  0.0067 -4.0743 3  934.9594149  71510 303743441      743342        syn-C2H3C(O)NH2, v=0
  462271.5769  0.0900 -5.4139 3 1655.5155225  71510 303B22092      B21993        syn-C2H3C(O)NH2, v=0
  462271.6025  0.0900 -5.4139 3 1655.5155225  71510 303B22192      B22093        syn-C2H3C(O)NH2, v=0
  462285.9762  0.0025 -3.2636 3  281.1326 91  71510 303451333      441232        syn-C2H3C(O)NH2, v=0
  462338.8404  0.0030 -5.7866 3  748.7513127  71510 303633429      623428        syn-C2H3C(O)NH2, v=0
  462338.8404  0.0030 -5.7866 3  748.7513127  71510 303633430      623429        syn-C2H3C(O)NH2, v=0
  462654.4092  0.0280 -4.5701 3 1142.6970193  71510 303961284      961185        syn-C2H3C(O)NH2, v=0
  462654.4092  0.0280 -4.5701 3 1142.6970193  71510 303961384      961285        syn-C2H3C(O)NH2, v=0
  462716.6727  0.0028 -5.7431 3  733.1410127  71510 303633330      623329        syn-C2H3C(O)NH2, v=0
  462716.6727  0.0028 -5.7431 3  733.1410127  71510 303633331      623330        syn-C2H3C(O)NH2, v=0
  462735.0947  0.0064 -4.0452 3  916.7519147  71510 303733439      733340        syn-C2H3C(O)NH2, v=0
  462735.0947  0.0064 -4.0452 3  916.7519147  71510 303733440      733341        syn-C2H3C(O)NH2, v=0
  462973.4442  0.0015 -5.2322 3  529.3255123  71510 303611844      601843        syn-C2H3C(O)NH2, v=0
  462999.9750  0.0084 -3.9763 3  660.4890139  71510 303691752      681851        syn-C2H3C(O)NH2, v=0
  463061.6125  0.0030 -5.2295 3  580.2750147  71510 30373 370      72 369        syn-C2H3C(O)NH2, v=0
  463061.5871  0.0200 -3.0702 3  580.2750147 -71510 30373 370      72 469        syn-C2H3C(O)NH2, v=0
  463061.5871  0.0200 -3.0702 3  580.2750147 -71510 30373 470      72 369        syn-C2H3C(O)NH2, v=0
  463061.6125  0.0030 -5.2295 3  580.2750147  71510 30373 470      72 469        syn-C2H3C(O)NH2, v=0
  463065.4685  0.0028 -5.2334 3  578.1973145  71510 30372 468      71 467        syn-C2H3C(O)NH2, v=0
  463065.4442  0.0200 -3.0911 3  578.1973145 -71510 30372 468      71 567        syn-C2H3C(O)NH2, v=0
  463065.4442  0.0200 -3.0911 3  578.1973145 -71510 30372 568      71 467        syn-C2H3C(O)NH2, v=0
  463065.4685  0.0028 -5.2334 3  578.1973145  71510 30372 568      71 567        syn-C2H3C(O)NH2, v=0
  463067.2560  0.0034 -5.2245 3  581.8312149  71510 30374 272      73 271        syn-C2H3C(O)NH2, v=0
  463067.2467  0.0200 -3.0497 3  581.8312149 -71510 30374 272      73 371        syn-C2H3C(O)NH2, v=0
  463067.2467  0.0200 -3.0497 3  581.8312149 -71510 30374 372      73 271        syn-C2H3C(O)NH2, v=0
  463067.2560  0.0034 -5.2245 3  581.8312149  71510 30374 372      73 371        syn-C2H3C(O)NH2, v=0
  463077.6385  0.0043 -5.2186 3  582.8729151  71510 30375 174      74 173        syn-C2H3C(O)NH2, v=0
  463077.6372  0.0200 -3.0295 3  582.8729151 -71510 30375 174      74 273        syn-C2H3C(O)NH2, v=0
  463077.6372  0.0200 -3.0295 3  582.8729151 -71510 30375 274      74 173        syn-C2H3C(O)NH2, v=0
  463077.6385  0.0043 -5.2186 3  582.8729151  71510 30375 274      74 273        syn-C2H3C(O)NH2, v=0
  463078.9616  0.0017 -5.3473 3  578.9442125  71510 303622241      612240        syn-C2H3C(O)NH2, v=0
  463079.5203  0.0017 -5.3473 3  578.9442125  71510 303622240      612239        syn-C2H3C(O)NH2, v=0
  463085.2966  0.0028 -5.2363 3  575.5892143  71510 30371 566      70 565        syn-C2H3C(O)NH2, v=0
  463085.3077  0.0200 -3.1128 3  575.5892143 -71510 30371 566      70 665        syn-C2H3C(O)NH2, v=0
  463085.3077  0.0200 -3.1128 3  575.5892143 -71510 30371 666      70 565        syn-C2H3C(O)NH2, v=0
  463085.2966  0.0028 -5.2363 3  575.5892143  71510 30371 666      70 665        syn-C2H3C(O)NH2, v=0
  463089.2084  0.0056 -5.2117 3  583.4061153  71510 30376 076      75 075        syn-C2H3C(O)NH2, v=0
  463089.2213  0.0200 -3.0094 3  583.4061153 -71510 30376 076      75 175        syn-C2H3C(O)NH2, v=0
  463089.2213  0.0200 -3.0094 3  583.4061153 -71510 30376 176      75 075        syn-C2H3C(O)NH2, v=0
  463089.2084  0.0056 -5.2117 3  583.4061153  71510 30376 176      75 175        syn-C2H3C(O)NH2, v=0
  463123.5971  0.0016 -3.8723 3  126.5828 63  71510 30331 923      30 624        syn-C2H3C(O)NH2, v=0
  463127.4109  0.0027 -5.7012 3  718.0170127  71510 303633231      623230        syn-C2H3C(O)NH2, v=0
  463127.4109  0.0027 -5.7012 3  718.0170127  71510 303633232      623231        syn-C2H3C(O)NH2, v=0
  463130.0547  0.0027 -5.2380 3  572.4402141  71510 30370 664      69 663        syn-C2H3C(O)NH2, v=0
  463130.0671  0.0200 -3.1354 3  572.4402141 -71510 30370 664      69 763        syn-C2H3C(O)NH2, v=0
  463130.0671  0.0200 -3.1354 3  572.4402141 -71510 30370 764      69 663        syn-C2H3C(O)NH2, v=0
  463130.0547  0.0027 -5.2380 3  572.4402141  71510 30370 764      69 763        syn-C2H3C(O)NH2, v=0
  463134.3639  0.0180 -4.6917 3 1298.5829183  71510 303913556      913457        syn-C2H3C(O)NH2, v=0
  463134.3639  0.0180 -4.6917 3 1298.5829183  71510 303913557      913458        syn-C2H3C(O)NH2, v=0
  463212.4150  0.0026 -5.2386 3  568.7369139  71510 30369 762      68 761        syn-C2H3C(O)NH2, v=0
  463212.4294  0.0200 -3.1593 3  568.7369139 -71510 30369 762      68 861        syn-C2H3C(O)NH2, v=0
  463212.4294  0.0200 -3.1593 3  568.7369139 -71510 30369 862      68 761        syn-C2H3C(O)NH2, v=0
  463212.4150  0.0026 -5.2386 3  568.7369139  71510 30369 862      68 861        syn-C2H3C(O)NH2, v=0
  463256.3695  0.0637 -5.7883 3 1890.3668227  71510 303B33776      B33677        syn-C2H3C(O)NH2, v=0
  463257.2530  0.0637 -5.7883 3 1890.3667227  71510 303B33777      B33678        syn-C2H3C(O)NH2, v=0
  463277.0188  0.0776 -5.2927 3 1587.1713221  71510 303B01991      B01892        syn-C2H3C(O)NH2, v=0
  463277.0260  0.0776 -5.2927 3 1587.1713221  71510 303B02091      B01992        syn-C2H3C(O)NH2, v=0
  463322.7594  0.0061 -4.0169 3  898.7981145  71510 303723438      723339        syn-C2H3C(O)NH2, v=0
  463322.7594  0.0061 -4.0169 3  898.7981145  71510 303723439      723340        syn-C2H3C(O)NH2, v=0
  463350.7899  0.0200 -3.1851 3  564.4622137 -71510 30368 860      67 959        syn-C2H3C(O)NH2, v=0
  463350.8113  0.0025 -5.2379 3  564.4622137  71510 30368 960      67 959        syn-C2H3C(O)NH2, v=0
  463350.8115  0.0025 -5.2379 3  564.4622137  71510 30368 860      67 859        syn-C2H3C(O)NH2, v=0
  463350.7899  0.0200 -3.1851 3  564.4622137 -71510 30368 960      67 859        syn-C2H3C(O)NH2, v=0
  463368.2242  0.0036 -5.9752 3   42.8547 39  71510 30319 713      18 216        syn-C2H3C(O)NH2, v=0
  463407.6976  0.0030 -4.7702 3   73.7436 49  71510 30324 816      23 519        syn-C2H3C(O)NH2, v=0
  463409.0289  0.0190 -4.3127 3  935.4162179  71510 30389 881      89 782        syn-C2H3C(O)NH2, v=0
  463409.0289  0.0190 -4.3127 3  935.4162179  71510 30389 981      89 882        syn-C2H3C(O)NH2, v=0
  463453.4423  0.0179 -4.2224 3  794.6959169  71510 30384 579      84 480        syn-C2H3C(O)NH2, v=0
  463453.4423  0.0179 -4.2224 3  794.6959169  71510 30384 679      84 580        syn-C2H3C(O)NH2, v=0
  463467.4086  0.0322 -4.6583 3 1202.5106197  71510 303981385      981286        syn-C2H3C(O)NH2, v=0
  463467.4086  0.0322 -4.6583 3 1202.5106197  71510 303981485      981386        syn-C2H3C(O)NH2, v=0
  463565.2201  0.0200 -2.9947 3  212.9783 77 -71510 303381425      371324        syn-C2H3C(O)NH2, v=0
  463573.0630  0.0200 -3.2135 3  559.5942135 -71510 30367 958      661057        syn-C2H3C(O)NH2, v=0
  463573.0506  0.0023 -5.2359 3  559.5942135  71510 303671058      661057        syn-C2H3C(O)NH2, v=0
  463573.0569  0.0023 -5.2359 3  559.5942135  71510 30367 958      66 957        syn-C2H3C(O)NH2, v=0
  463573.0630  0.0200 -3.2135 3  559.5942135 -71510 303671058      66 957        syn-C2H3C(O)NH2, v=0
  463576.0237  0.0026 -5.6607 3  703.3817127  71510 303633132      623131        syn-C2H3C(O)NH2, v=0
  463576.0237  0.0026 -5.6607 3  703.3817127  71510 303633133      623132        syn-C2H3C(O)NH2, v=0
  463602.7953  0.1755 -6.0493 3 1569.6601213  71510 303A62780      A52877        syn-C2H3C(O)NH2, v=0
  463636.7894  0.1160 -5.8495 3 1562.9973211  71510 303A52977      A43074        syn-C2H3C(O)NH2, v=0
  463647.6335  0.0024 -5.1498 3  138.3597 61  71510 303301317      301020        syn-C2H3C(O)NH2, v=0
  463670.4570  0.0362 -5.2494 3 1604.4079207  71510 303A33667      A33568        syn-C2H3C(O)NH2, v=0
  463670.4754  0.0362 -5.2494 3 1604.4079207  71510 303A33668      A33569        syn-C2H3C(O)NH2, v=0
  463675.6609  0.0016 -3.1539 3  247.7196 85  71510 303421330      411229        syn-C2H3C(O)NH2, v=0
  463697.1329  0.0200 -3.3892 3  517.9111125 -71510 303621449      611348        syn-C2H3C(O)NH2, v=0
  463707.9413  0.0056 -5.7566 3  111.4059 59  71510 30329 920      29 425        syn-C2H3C(O)NH2, v=0
  463721.3565  0.0200 -2.9945 3  212.9739 77 -71510 303381424      371325        syn-C2H3C(O)NH2, v=0
  463825.4860  0.0200 -3.2372 3  232.2481 83 -71510 303411229      401130        syn-C2H3C(O)NH2, v=0
  463885.9407  0.0058 -3.9895 3  881.0976143  71510 303713437      713338        syn-C2H3C(O)NH2, v=0
  463885.9407  0.0058 -3.9895 3  881.0976143  71510 303713438      713339        syn-C2H3C(O)NH2, v=0
  463922.9257  0.0022 -3.2455 3  554.1030133  71510 303661056      651155        syn-C2H3C(O)NH2, v=0
  463923.1299  0.0022 -5.2323 3  554.1030133  71510 303661156      651155        syn-C2H3C(O)NH2, v=0
  463923.2998  0.0022 -5.2323 3  554.1030133  71510 303661056      651055        syn-C2H3C(O)NH2, v=0
  463923.5040  0.0022 -3.2455 3  554.1030133  71510 303661156      651055        syn-C2H3C(O)NH2, v=0
  463973.8366  0.0016 -5.1509 3  493.2085121  71510 303601446      591445        syn-C2H3C(O)NH2, v=0
  463976.5688  0.0669 -5.1756 3 1520.0252217  71510 303A81890      A81791        syn-C2H3C(O)NH2, v=0
  463976.5708  0.0669 -5.1756 3 1520.0252217  71510 303A81990      A81891        syn-C2H3C(O)NH2, v=0
  463982.3283  0.0029 -3.8601 3  122.7818 63  71510 30331 824      30 525        syn-C2H3C(O)NH2, v=0
  463997.0941  0.0068 -5.5806 3   56.5208 45  71510 30322 616      21 319        syn-C2H3C(O)NH2, v=0
  464023.3971  0.1452 -5.8491 3 1896.2378239  71510 303B92396      B92297        syn-C2H3C(O)NH2, v=0
  464023.9350  0.1452 -5.8491 3 1896.2378239  71510 303B92496      B92397        syn-C2H3C(O)NH2, v=0
  464058.0220  0.0371 -4.7520 3 1263.5624201  71510 303A01486      A01387        syn-C2H3C(O)NH2, v=0
  464058.0220  0.0371 -4.7520 3 1263.5624201  71510 303A01586      A01487        syn-C2H3C(O)NH2, v=0
  464068.4896  0.0024 -5.6216 3  689.2380127  71510 303633033      623032        syn-C2H3C(O)NH2, v=0
  464068.4896  0.0024 -5.6216 3  689.2380127  71510 303633034      623033        syn-C2H3C(O)NH2, v=0
  464110.1075  0.0045 -3.8571 3  130.2074 65  71510 30332 725      31 626        syn-C2H3C(O)NH2, v=0
  464113.7292  0.0054 -5.0083 3  187.6147 77  71510 30338 830      38 533        syn-C2H3C(O)NH2, v=0
  464115.7917  0.1018 -5.1910 3 1219.7627187  71510 303932568      922667        syn-C2H3C(O)NH2, v=0
  464187.0372  0.0868 -5.0392 3 1140.5872181  71510 303902466      892565        syn-C2H3C(O)NH2, v=0
  464239.6706  0.0170 -4.6504 3 1276.0412181  71510 303903555      903456        syn-C2H3C(O)NH2, v=0
  464239.6706  0.0170 -4.6504 3 1276.0412181  71510 303903556      903457        syn-C2H3C(O)NH2, v=0
  464389.0324  0.0577 -5.0629 3 1454.0843213  71510 303A61789      A61690        syn-C2H3C(O)NH2, v=0
  464389.0329  0.0577 -5.0629 3 1454.0843213  71510 303A61889      A61790        syn-C2H3C(O)NH2, v=0
  464396.3983  0.0016 -5.2297 3  529.3987123  71510 303611843      601842        syn-C2H3C(O)NH2, v=0
  464416.2326  0.0429 -4.8509 3 1325.8462205  71510 303A21587      A21488        syn-C2H3C(O)NH2, v=0
  464416.2326  0.0429 -4.8509 3 1325.8462205  71510 303A21687      A21588        syn-C2H3C(O)NH2, v=0
  464425.4927  0.0056 -3.9628 3  863.6501141  71510 303703436      703337        syn-C2H3C(O)NH2, v=0
  464425.4927  0.0056 -3.9628 3  863.6501141  71510 303703437      703338        syn-C2H3C(O)NH2, v=0
  464469.6947  0.0200 -3.2831 3  547.9472131 -71510 303651154      641253        syn-C2H3C(O)NH2, v=0
  464474.4147  0.0020 -5.2269 3  547.9472131  71510 303651254      641253        syn-C2H3C(O)NH2, v=0
  464478.0305  0.0020 -5.2269 3  547.9469131  71510 303651154      641153        syn-C2H3C(O)NH2, v=0
  464482.7277  0.0200 -3.2831 3  547.9469131 -71510 303651254      641153        syn-C2H3C(O)NH2, v=0
  464530.7961  0.0497 -4.9546 3 1389.3557209  71510 303A41688      A41589        syn-C2H3C(O)NH2, v=0
  464530.7962  0.0497 -4.9546 3 1389.3557209  71510 303A41788      A41689        syn-C2H3C(O)NH2, v=0
  464565.1169  0.0952 -5.7335 3 1499.1777207  71510 303A32876      A22973        syn-C2H3C(O)NH2, v=0
  464594.3696  0.0022 -3.2244 3  269.6652 89  71510 303441332      431231        syn-C2H3C(O)NH2, v=0
  464612.0789  0.0023 -5.5839 3  675.5891127  71510 303632934      622933        syn-C2H3C(O)NH2, v=0
  464612.0789  0.0023 -5.5839 3  675.5891127  71510 303632935      622934        syn-C2H3C(O)NH2, v=0
  464615.3140  0.0016 -5.3192 3  569.4702125  71510 303622142      612141        syn-C2H3C(O)NH2, v=0
  464621.0863  0.0016 -5.3192 3  569.4704125  71510 303622141      612140        syn-C2H3C(O)NH2, v=0
  464627.5404  0.0203 -4.2666 3  711.0385163  71510 30381 378      81 279        syn-C2H3C(O)NH2, v=0
  464627.5404  0.0203 -4.2666 3  711.0385163  71510 30381 478      81 379        syn-C2H3C(O)NH2, v=0
  464717.6147  0.0039 -3.5247 3  193.9311 77  71510 303381028      37 929        syn-C2H3C(O)NH2, v=0
  464754.0891  0.0015 -2.6671 3  160.3717 45  71510 3032222 0      2121 1        syn-C2H3C(O)NH2, v=0
  464754.0891  0.0015 -2.6671 3  160.3717 45  71510 3032222 1      2121 0        syn-C2H3C(O)NH2, v=0
  464770.7925  0.0015 -5.1932 3  515.8330123  71510 303611646      601645        syn-C2H3C(O)NH2, v=0
  464942.2384  0.0054 -3.9369 3  846.4554139  71510 303693435      693336        syn-C2H3C(O)NH2, v=0
  464942.2384  0.0054 -3.9369 3  846.4554139  71510 303693436      693337        syn-C2H3C(O)NH2, v=0
  464982.9280  0.0015 -5.2096 3  522.3245123  71510 303611745      601744        syn-C2H3C(O)NH2, v=0
  465005.8999  0.0023 -5.1479 3  138.3144 61  71510 303301318      301021        syn-C2H3C(O)NH2, v=0
  465018.4304  0.0019 -3.1871 3  258.5281 87  71510 303431331      421230        syn-C2H3C(O)NH2, v=0
  465046.2541  0.0209 -4.3742 3  990.8201183  71510 30391 982      91 883        syn-C2H3C(O)NH2, v=0
  465046.2541  0.0209 -4.3742 3  990.8201183  71510 303911082      91 983        syn-C2H3C(O)NH2, v=0
  465167.7020  0.0244 -4.5730 3  630.3512157  71510 30378 177      78 078        syn-C2H3C(O)NH2, v=0
  465167.7020  0.0244 -4.5730 3  630.3512157  71510 30378 277      78 178        syn-C2H3C(O)NH2, v=0
  465187.6958  0.0200 -2.6930 3  161.6537 49 -71510 3032421 3      2320 4        syn-C2H3C(O)NH2, v=0
  465187.6958  0.0200 -2.6930 3  161.6537 49 -71510 3032421 4      2320 3        syn-C2H3C(O)NH2, v=0
  465215.7403  0.0022 -5.5476 3  662.4391127  71510 303632835      622834        syn-C2H3C(O)NH2, v=0
  465215.7403  0.0022 -5.5476 3  662.4391127  71510 303632836      622835        syn-C2H3C(O)NH2, v=0
  465258.4878  0.0342 -5.1999 3 1578.7650205  71510 303A23666      A23567        syn-C2H3C(O)NH2, v=0
  465258.4974  0.0342 -5.1999 3 1578.7650205  71510 303A23667      A23568        syn-C2H3C(O)NH2, v=0
  465259.6902  0.0018 -3.3297 3  541.0660129  71510 303641252      631351        syn-C2H3C(O)NH2, v=0
  465302.5890  0.0161 -4.6098 3 1253.7591179  71510 303893554      893455        syn-C2H3C(O)NH2, v=0
  465302.5891  0.0161 -4.6098 3 1253.7591179  71510 303893555      893456        syn-C2H3C(O)NH2, v=0
  465330.4169  0.0716 -4.8879 3 1064.0617175  71510 303872364      862463        syn-C2H3C(O)NH2, v=0
  465342.7302  0.1165 -5.3443 3 1301.5880193  71510 303962670      952769        syn-C2H3C(O)NH2, v=0
  465344.5941  0.0018 -5.2193 3  541.0660129  71510 303641352      631351        syn-C2H3C(O)NH2, v=0
  465363.5609  0.0602 -5.7319 3 1862.1125225  71510 303B23775      B23676        syn-C2H3C(O)NH2, v=0
  465364.0521  0.0602 -5.7319 3 1862.1125225  71510 303B23776      B23677        syn-C2H3C(O)NH2, v=0
  465365.6334  0.0058 -4.7267 3  286.1950 93  71510 303461135      46 838        syn-C2H3C(O)NH2, v=0
  465403.8246  0.0018 -5.2192 3  541.0612129  71510 303641252      631251        syn-C2H3C(O)NH2, v=0
  465422.0668  0.0017 -3.3949 3  533.3784127  71510 303631350      621449        syn-C2H3C(O)NH2, v=0
  465436.9706  0.0051 -3.9119 3  829.5129137  71510 303683434      683335        syn-C2H3C(O)NH2, v=0
  465436.9706  0.0051 -3.9119 3  829.5129137  71510 303683435      683336        syn-C2H3C(O)NH2, v=0
  465483.7784  0.0200 -2.9237 3  200.8511 73 -71510 303361522      351421        syn-C2H3C(O)NH2, v=0
  465486.5312  0.0200 -2.9237 3  200.8510 73 -71510 303361521      351422        syn-C2H3C(O)NH2, v=0
  465488.7285  0.0018 -3.3292 3  541.0612129  71510 303641352      631251        syn-C2H3C(O)NH2, v=0
  465602.7882  0.0200 -2.7206 3  164.4057 53 -71510 3032620 6      2519 7        syn-C2H3C(O)NH2, v=0
  465602.7882  0.0200 -2.7206 3  164.4057 53 -71510 3032620 7      2519 6        syn-C2H3C(O)NH2, v=0
  465630.9166  0.0183 -4.2484 3  846.8822173  71510 30386 680      86 581        syn-C2H3C(O)NH2, v=0
  465630.9166  0.0183 -4.2484 3  846.8822173  71510 30386 780      86 681        syn-C2H3C(O)NH2, v=0
  465708.5894  0.0063 -6.0140 3  102.8577 61  71510 30330 426      30 129        syn-C2H3C(O)NH2, v=0
  465776.1303  0.0063 -6.0139 3  102.8577 61  71510 30330 526      30 229        syn-C2H3C(O)NH2, v=0
  465890.6465  0.0022 -5.5125 3  649.7930127  71510 303632736      622735        syn-C2H3C(O)NH2, v=0
  465890.6465  0.0022 -5.5125 3  649.7930127  71510 303632737      622736        syn-C2H3C(O)NH2, v=0
  465910.4542  0.0050 -3.8878 3  812.8226135  71510 303673433      673334        syn-C2H3C(O)NH2, v=0
  465910.4542  0.0050 -3.8878 3  812.8226135  71510 303673434      673335        syn-C2H3C(O)NH2, v=0
  465974.8446  0.0200 -2.7508 3  168.6390 57 -71510 3032819 9      271810        syn-C2H3C(O)NH2, v=0
  465974.8446  0.0200 -2.7508 3  168.6390 57 -71510 303281910      2718 9        syn-C2H3C(O)NH2, v=0
  465980.3981  0.1260 -5.7147 3 1823.7321235  71510 303B72295      B72196        syn-C2H3C(O)NH2, v=0
  465980.5656  0.1260 -5.7147 3 1823.7321235  71510 303B72395      B72296        syn-C2H3C(O)NH2, v=0
  466028.5368  0.0018 -3.5006 3  540.4500127  71510 303631449      621548        syn-C2H3C(O)NH2, v=0
  466187.1835  0.0046 -3.6529 3  171.4707 73  71510 30336 927      35 828        syn-C2H3C(O)NH2, v=0
  466213.8436  0.0200 -2.8687 3  190.4307 69 -71510 303341619      331518        syn-C2H3C(O)NH2, v=0
  466213.8436  0.0200 -2.8687 3  190.4307 69 -71510 303341618      331519        syn-C2H3C(O)NH2, v=0
  466246.3702  0.0055 -4.5524 3  652.6132137  71510 303681949      681652        syn-C2H3C(O)NH2, v=0
  466261.0399  0.0200 -2.7846 3  174.3699 61 -71510 303301812      291713        syn-C2H3C(O)NH2, v=0
  466261.0399  0.0200 -2.7846 3  174.3699 61 -71510 303301813      291712        syn-C2H3C(O)NH2, v=0
  466264.8922  0.0034 -3.4172 3  400.5792109  71510 303541441      531340        syn-C2H3C(O)NH2, v=0
  466324.7655  0.0153 -4.5699 3 1231.7360177  71510 303883553      883454        syn-C2H3C(O)NH2, v=0
  466324.7655  0.0153 -4.5699 3 1231.7360177  71510 303883554      883455        syn-C2H3C(O)NH2, v=0
  466363.4275  0.0048 -3.8645 3  796.3839133  71510 303663432      663333        syn-C2H3C(O)NH2, v=0
  466363.4275  0.0048 -3.8645 3  796.3839133  71510 303663433      663334        syn-C2H3C(O)NH2, v=0
  466385.9670  0.0200 -2.8233 3  181.6220 65 -71510 303321716      311615        syn-C2H3C(O)NH2, v=0
  466385.9670  0.0200 -2.8233 3  181.6220 65 -71510 303321715      311616        syn-C2H3C(O)NH2, v=0
  466405.7050  0.0051 -4.5376 3  529.3317123  71510 303611843      611546        syn-C2H3C(O)NH2, v=0
  466451.1972  0.0015 -5.1277 3  481.9447119  71510 303591544      581543        syn-C2H3C(O)NH2, v=0
  466493.6668  0.0016 -5.2921 3  560.5917125  71510 303622043      612042        syn-C2H3C(O)NH2, v=0
  466495.0285  0.0234 -4.4439 3 1047.4864187  71510 303931083      93 984        syn-C2H3C(O)NH2, v=0
  466495.0285  0.0234 -4.4439 3 1047.4864187  71510 303931183      931084        syn-C2H3C(O)NH2, v=0
  466522.2992  0.0033 -4.5963 3  280.9913 91  71510 303451333      451036        syn-C2H3C(O)NH2, v=0
  466544.8347  0.0016 -5.2920 3  560.5937125  71510 303622042      612041        syn-C2H3C(O)NH2, v=0
  466589.8587  0.0017 -5.2092 3  533.3784127  71510 303631450      621449        syn-C2H3C(O)NH2, v=0
  466650.9859  0.0021 -5.4788 3  637.6565127  71510 303632637      622636        syn-C2H3C(O)NH2, v=0
  466650.9859  0.0021 -5.4788 3  637.6565127  71510 303632638      622637        syn-C2H3C(O)NH2, v=0
  466785.2966  0.0324 -5.1511 3 1553.3868203  71510 303A13665      A13566        syn-C2H3C(O)NH2, v=0
  466785.3015  0.0324 -5.1511 3 1553.3868203  71510 303A13666      A13567        syn-C2H3C(O)NH2, v=0
  466796.6037  0.0046 -3.8421 3  780.1968131  71510 303653431      653332        syn-C2H3C(O)NH2, v=0
  466796.6037  0.0046 -3.8421 3  780.1968131  71510 303653432      653333        syn-C2H3C(O)NH2, v=0
  466996.2055  0.1602 -5.9647 3 1628.2908215  71510 303A73077      A63176        syn-C2H3C(O)NH2, v=0
  467015.1463  0.0038 -5.5575 3  122.7818 61  71510 303301020      30 525        syn-C2H3C(O)NH2, v=0
  467117.6810  0.0567 -4.7361 3  990.1857169  71510 303842262      832361        syn-C2H3C(O)NH2, v=0
  467135.9330  0.0197 -4.2423 3  761.2531167  71510 30383 479      83 380        syn-C2H3C(O)NH2, v=0
  467135.9330  0.0197 -4.2423 3  761.2531167  71510 30383 579      83 480        syn-C2H3C(O)NH2, v=0
  467210.6722  0.0045 -3.8207 3  764.2607129  71510 303643430      643331        syn-C2H3C(O)NH2, v=0
  467210.6722  0.0045 -3.8207 3  764.2607129  71510 303643431      643332        syn-C2H3C(O)NH2, v=0
  467299.7420  0.0020 -4.9383 3   65.6187 45  71510 30322 913      21 616        syn-C2H3C(O)NH2, v=0
  467300.0013  0.0017 -5.2077 3  533.3157127  71510 303631350      621349        syn-C2H3C(O)NH2, v=0
  467303.0645  0.0048 -3.7606 3  150.2305 69  71510 30334 826      33 727        syn-C2H3C(O)NH2, v=0
  467307.7587  0.0145 -4.5307 3 1209.9716175  71510 303873552      873453        syn-C2H3C(O)NH2, v=0
  467307.7587  0.0145 -4.5307 3 1209.9716175  71510 303873553      873454        syn-C2H3C(O)NH2, v=0
  467352.5976  0.0024 -5.2216 3  130.8244 59  71510 303291316      291019        syn-C2H3C(O)NH2, v=0
  467375.0119  0.0016 -5.1981 3  524.8601125  71510 303621548      611547        syn-C2H3C(O)NH2, v=0
  467385.6911  0.0569 -5.6762 3 1834.1281223  71510 303B13774      B13675        syn-C2H3C(O)NH2, v=0
  467385.9618  0.0569 -5.6762 3 1834.1281223  71510 303B13775      B13676        syn-C2H3C(O)NH2, v=0
  467396.0506  0.0029 -3.3916 3  217.6307 81  71510 303401129      391030        syn-C2H3C(O)NH2, v=0
  467515.1494  0.0020 -5.4464 3  626.0372127  71510 303632539      622538        syn-C2H3C(O)NH2, v=0
  467515.1499  0.0020 -5.4464 3  626.0372127  71510 303632538      622537        syn-C2H3C(O)NH2, v=0
  467568.9385  0.1092 -5.5843 3 1752.4024231  71510 303B52194      B52095        syn-C2H3C(O)NH2, v=0
  467568.9887  0.1092 -5.5843 3 1752.4024231  71510 303B52294      B52195        syn-C2H3C(O)NH2, v=0
  467606.2998  0.0043 -3.8001 3  748.5756127  71510 303633429      633330        syn-C2H3C(O)NH2, v=0
  467606.2998  0.0043 -3.8001 3  748.5756127  71510 303633430      633331        syn-C2H3C(O)NH2, v=0
  467638.0238  0.0192 -4.2896 3  900.3477177  71510 30388 781      88 682        syn-C2H3C(O)NH2, v=0
  467638.0238  0.0192 -4.2896 3  900.3477177  71510 30388 881      88 782        syn-C2H3C(O)NH2, v=0
  467709.1020  0.0079 -4.5580 3  517.9111123  71510 303611645      611348        syn-C2H3C(O)NH2, v=0
  467749.0642  0.0265 -4.5210 3 1105.4091191  71510 303951184      951085        syn-C2H3C(O)NH2, v=0
  467749.0642  0.0265 -4.5210 3 1105.4091191  71510 303951284      951185        syn-C2H3C(O)NH2, v=0
  467755.3873  0.0134 -4.1233 3  721.1459145  71510 303721854      711953        syn-C2H3C(O)NH2, v=0
  467907.9692  0.1313 -5.5004 3 1386.0622199  71510 303992772      982871        syn-C2H3C(O)NH2, v=0
  467909.4056  0.0078 -4.5726 3  466.3369117  71510 303581543      581246        syn-C2H3C(O)NH2, v=0
  467983.6881  0.0050 -6.0831 3  867.8891129  71510 303644024      634023        syn-C2H3C(O)NH2, v=0
  467983.6881  0.0050 -6.0831 3  867.8891129  71510 303644025      634024        syn-C2H3C(O)NH2, v=0
  467984.1321  0.0042 -3.7805 3  733.1410125  71510 303623428      623329        syn-C2H3C(O)NH2, v=0
  467984.1321  0.0042 -3.7805 3  733.1410125  71510 303623429      623330        syn-C2H3C(O)NH2, v=0
  467984.9156  0.0231 -4.3681 3  678.5728161  71510 30380 278      80 179        syn-C2H3C(O)NH2, v=0
  467984.9156  0.0231 -4.3681 3  678.5728161  71510 30380 378      80 279        syn-C2H3C(O)NH2, v=0
  468082.3165  0.0024 -5.2206 3  130.8001 59  71510 303291317      291020        syn-C2H3C(O)NH2, v=0
  468199.6632  0.0063 -4.6739 3  327.2874 99  71510 303491237      49 940        syn-C2H3C(O)NH2, v=0
  468243.5457  0.0046 -6.0306 3  849.4046129  71510 303643925      633924        syn-C2H3C(O)NH2, v=0
  468243.5457  0.0046 -6.0306 3  849.4046129  71510 303643926      633925        syn-C2H3C(O)NH2, v=0
  468253.0471  0.0137 -4.4923 3 1188.4653173  71510 303863551      863452        syn-C2H3C(O)NH2, v=0
  468253.0471  0.0137 -4.4923 3 1188.4653173  71510 303863552      863453        syn-C2H3C(O)NH2, v=0
  468253.6534  0.0307 -5.1030 3 1528.2727201  71510 303A03664      A03565        syn-C2H3C(O)NH2, v=0
  468253.6559  0.0307 -5.1030 3 1528.2727201  71510 303A03665      A03566        syn-C2H3C(O)NH2, v=0
  468279.1075  0.0051 -4.5530 3  635.0629135  71510 303671948      671651        syn-C2H3C(O)NH2, v=0
  468310.7331  0.0017 -5.1687 3  508.6850123  71510 303611447      601446        syn-C2H3C(O)NH2, v=0
  468344.7941  0.0041 -3.7620 3  717.9568123  71510 303613427      613328        syn-C2H3C(O)NH2, v=0
  468344.7941  0.0041 -3.7620 3  717.9568123  71510 303613428      613329        syn-C2H3C(O)NH2, v=0
  468433.5958  0.0024 -6.0418 3   37.2541 31  71510 3031510 6      14 7 7        syn-C2H3C(O)NH2, v=0
  468447.7238  0.0024 -6.0418 3   37.2537 31  71510 3031510 5      14 7 8        syn-C2H3C(O)NH2, v=0
  468467.7932  0.0017 -3.3890 3  533.3157127  71510 303631450      621349        syn-C2H3C(O)NH2, v=0
  468507.5873  0.0019 -5.4151 3  614.9444127  71510 303632440      622439        syn-C2H3C(O)NH2, v=0
  468507.5948  0.0019 -5.4151 3  614.9444127  71510 303632439      622438        syn-C2H3C(O)NH2, v=0
  468519.7421  0.0043 -5.9798 3  831.3978129  71510 303643826      633825        syn-C2H3C(O)NH2, v=0
  468519.7421  0.0043 -5.9798 3  831.3978129  71510 303643827      633826        syn-C2H3C(O)NH2, v=0
  468585.8338  0.1738 -6.0362 3 1999.2993245  71510 303C22498      C22399        syn-C2H3C(O)NH2, v=0
  468586.8184  0.1738 -6.0362 3 1999.2993245  71510 303C22598      C22499        syn-C2H3C(O)NH2, v=0
  468605.0421  0.0011 -3.1148 3  237.0241 83  71510 303411328      401229        syn-C2H3C(O)NH2, v=0
  468615.9121  0.0718 -5.6907 3 1462.7321205  71510 303A22776      A12873        syn-C2H3C(O)NH2, v=0
  468688.8918  0.0040 -3.7444 3  703.0226121  71510 303603426      603327        syn-C2H3C(O)NH2, v=0
  468688.8918  0.0040 -3.7444 3  703.0226121  71510 303603427      603328        syn-C2H3C(O)NH2, v=0
  468689.2315  0.0075 -4.5977 3  417.3678111  71510 303551441      551144        syn-C2H3C(O)NH2, v=0
  468784.1025  0.0016 -5.2658 3  552.3458125  71510 303621944      611943        syn-C2H3C(O)NH2, v=0
  468801.4146  0.0302 -4.6045 3 1164.5826195  71510 303971285      971186        syn-C2H3C(O)NH2, v=0
  468801.4146  0.0302 -4.6045 3 1164.5826195  71510 303971385      971286        syn-C2H3C(O)NH2, v=0
  468814.3050  0.0040 -5.9307 3  813.8699129  71510 303643727      633726        syn-C2H3C(O)NH2, v=0
  468814.3050  0.0040 -5.9307 3  813.8699129  71510 303643728      633727        syn-C2H3C(O)NH2, v=0
  468816.7026  0.0945 -5.4578 3 1682.2566227  71510 303B32093      B31994        syn-C2H3C(O)NH2, v=0
  468816.7172  0.0945 -5.4578 3 1682.2566227  71510 303B32193      B32094        syn-C2H3C(O)NH2, v=0
  468951.1290  0.0428 -4.5832 3  918.9582163  71510 303812160      802259        syn-C2H3C(O)NH2, v=0
  469017.0122  0.0039 -3.7279 3  688.3381119  71510 303593425      593326        syn-C2H3C(O)NH2, v=0
  469017.0122  0.0039 -3.7279 3  688.3381119  71510 303593426      593327        syn-C2H3C(O)NH2, v=0
  469072.6644  0.0069 -4.6315 3  371.0146105  71510 303521339      521042        syn-C2H3C(O)NH2, v=0
  469098.2029  0.0034 -5.2446 3  595.7211149  71510 30374 371      73 370        syn-C2H3C(O)NH2, v=0
  469098.2029  0.0034 -3.0846 3  595.7211149  71510 30374 371      73 470        syn-C2H3C(O)NH2, v=0
  469098.2029  0.0034 -3.0846 3  595.7211149  71510 30374 471      73 370        syn-C2H3C(O)NH2, v=0
  469098.2029  0.0034 -5.2446 3  595.7211149  71510 30374 471      73 470        syn-C2H3C(O)NH2, v=0
  469101.2007  0.0032 -5.2484 3  593.6435147  71510 30373 469      72 468        syn-C2H3C(O)NH2, v=0
  469101.2007  0.0032 -3.1051 3  593.6435147  71510 30373 469      72 568        syn-C2H3C(O)NH2, v=0
  469101.2007  0.0032 -3.1051 3  593.6435147  71510 30373 569      72 468        syn-C2H3C(O)NH2, v=0
  469101.2007  0.0032 -5.2484 3  593.6435147  71510 30373 569      72 568        syn-C2H3C(O)NH2, v=0
  469104.2779  0.0039 -5.2398 3  597.2774151  71510 30375 273      74 272        syn-C2H3C(O)NH2, v=0
  469104.2779  0.0039 -3.0644 3  597.2774151  71510 30375 273      74 372        syn-C2H3C(O)NH2, v=0
  469104.2779  0.0039 -3.0644 3  597.2774151  71510 30375 373      74 272        syn-C2H3C(O)NH2, v=0
  469104.2779  0.0039 -5.2398 3  597.2774151  71510 30375 373      74 372        syn-C2H3C(O)NH2, v=0
  469114.8381  0.0048 -5.2339 3  598.3195153  71510 30376 175      75 174        syn-C2H3C(O)NH2, v=0
  469114.8381  0.0048 -3.0445 3  598.3195153  71510 30376 175      75 274        syn-C2H3C(O)NH2, v=0
  469114.8381  0.0048 -3.0445 3  598.3195153  71510 30376 275      75 174        syn-C2H3C(O)NH2, v=0
  469114.8381  0.0048 -5.2339 3  598.3195153  71510 30376 275      75 274        syn-C2H3C(O)NH2, v=0
  469119.4774  0.0031 -5.2512 3  591.0361145  71510 30372 567      71 566        syn-C2H3C(O)NH2, v=0
  469119.4774  0.0031 -3.1263 3  591.0361145  71510 30372 567      71 666        syn-C2H3C(O)NH2, v=0
  469119.4774  0.0031 -3.1263 3  591.0361145  71510 30372 667      71 566        syn-C2H3C(O)NH2, v=0
  469119.4774  0.0031 -5.2512 3  591.0361145  71510 30372 667      71 666        syn-C2H3C(O)NH2, v=0
  469126.4447  0.0062 -5.2271 3  598.8531155  71510 30377 077      76 076        syn-C2H3C(O)NH2, v=0
  469126.4447  0.0062 -3.0248 3  598.8531155  71510 30377 077      76 176        syn-C2H3C(O)NH2, v=0
  469126.4447  0.0062 -3.0248 3  598.8531155  71510 30377 177      76 076        syn-C2H3C(O)NH2, v=0
  469126.4447  0.0062 -5.2271 3  598.8531155  71510 30377 177      76 176        syn-C2H3C(O)NH2, v=0
  469129.5756  0.0037 -5.8831 3  796.8222129  71510 303643628      633627        syn-C2H3C(O)NH2, v=0
  469129.5756  0.0037 -5.8831 3  796.8222129  71510 303643629      633628        syn-C2H3C(O)NH2, v=0
  469129.9272  0.0082 -4.5571 3  572.0779129  71510 303641747      641450        syn-C2H3C(O)NH2, v=0
  469161.5733  0.0030 -5.2528 3  587.8886143  71510 30371 665      70 664        syn-C2H3C(O)NH2, v=0
  469161.5733  0.0030 -3.1483 3  587.8886143  71510 30371 665      70 764        syn-C2H3C(O)NH2, v=0
  469161.5733  0.0030 -3.1483 3  587.8886143  71510 30371 765      70 664        syn-C2H3C(O)NH2, v=0
  469161.5733  0.0030 -5.2528 3  587.8886143  71510 30371 765      70 764        syn-C2H3C(O)NH2, v=0
  469162.0343  0.0130 -4.4546 3 1167.2168171  71510 303853550      853451        syn-C2H3C(O)NH2, v=0
  469162.0343  0.0130 -4.4546 3 1167.2168171  71510 303853551      853452        syn-C2H3C(O)NH2, v=0
  469163.1034  0.0016 -5.2651 3  552.3633125  71510 303621943      611942        syn-C2H3C(O)NH2, v=0
  469239.4916  0.0029 -5.2533 3  584.1880141  71510 30370 763      69 762        syn-C2H3C(O)NH2, v=0
  469239.4916  0.0029 -3.1716 3  584.1880141  71510 30370 763      69 862        syn-C2H3C(O)NH2, v=0
  469239.4916  0.0029 -3.1716 3  584.1880141  71510 30370 863      69 762        syn-C2H3C(O)NH2, v=0
  469239.4916  0.0029 -5.2533 3  584.1880141  71510 30370 863      69 862        syn-C2H3C(O)NH2, v=0
  469327.3489  0.0539 -5.6213 3 1806.4129221  71510 303B03773      B03674        syn-C2H3C(O)NH2, v=0
  469327.4967  0.0539 -5.6213 3 1806.4129221  71510 303B03774      B03675        syn-C2H3C(O)NH2, v=0
  469329.7253  0.0038 -3.7125 3  673.9033117  71510 303583424      583325        syn-C2H3C(O)NH2, v=0
  469329.7253  0.0038 -3.7125 3  673.9033117  71510 303583425      583326        syn-C2H3C(O)NH2, v=0
  469370.5573  0.0028 -3.1966 3  579.9179139  71510 30369 861      68 960        syn-C2H3C(O)NH2, v=0
  469370.5574  0.0028 -5.2525 3  579.9179139  71510 30369 961      68 960        syn-C2H3C(O)NH2, v=0
  469370.5575  0.0028 -5.2525 3  579.9179139  71510 30369 861      68 860        syn-C2H3C(O)NH2, v=0
  469370.5576  0.0028 -3.1966 3  579.9179139  71510 30369 961      68 860        syn-C2H3C(O)NH2, v=0
  469468.2719  0.0035 -5.8371 3  780.2561129  71510 303643529      633528        syn-C2H3C(O)NH2, v=0
  469468.2719  0.0035 -5.8371 3  780.2561129  71510 303643530      633529        syn-C2H3C(O)NH2, v=0
  469470.1943  0.0207 -4.3426 3  955.0869181  71510 30390 882      90 783        syn-C2H3C(O)NH2, v=0
  469470.1943  0.0207 -4.3426 3  955.0869181  71510 30390 982      90 883        syn-C2H3C(O)NH2, v=0
  469484.0867  0.0196 -4.2490 3  812.7578171  71510 30385 580      85 481        syn-C2H3C(O)NH2, v=0
  469484.0867  0.0196 -4.2490 3  812.7578171  71510 30385 680      85 581        syn-C2H3C(O)NH2, v=0
  469580.6516  0.0026 -3.2240 3  575.0573137  71510 30368 959      671058        syn-C2H3C(O)NH2, v=0
  469580.6554  0.0026 -5.2504 3  575.0573137  71510 303681059      671058        syn-C2H3C(O)NH2, v=0
  469580.6587  0.0026 -5.2504 3  575.0573137  71510 30368 959      67 958        syn-C2H3C(O)NH2, v=0
  469580.6624  0.0026 -3.2240 3  575.0573137  71510 303681059      67 958        syn-C2H3C(O)NH2, v=0
  469623.9857  0.0059 -5.6449 3  122.1323 65  71510 30332 527      32 230        syn-C2H3C(O)NH2, v=0
  469627.5838  0.0038 -3.6983 3  659.7177115  71510 303573423      573324        syn-C2H3C(O)NH2, v=0
  469627.5838  0.0038 -3.6983 3  659.7177115  71510 303573424      573325        syn-C2H3C(O)NH2, v=0
  469644.3836  0.0346 -4.6939 3 1225.0009199  71510 303991386      991287        syn-C2H3C(O)NH2, v=0
  469644.3836  0.0346 -4.6939 3 1225.0009199  71510 303991486      991387        syn-C2H3C(O)NH2, v=0
  469661.8435  0.0019 -5.3851 3  604.3903127  71510 303632341      622340        syn-C2H3C(O)NH2, v=0
  469661.9391  0.0019 -5.3851 3  604.3903127  71510 303632340      622339        syn-C2H3C(O)NH2, v=0
  469666.1403  0.0291 -5.0556 3 1503.4221199  71510 303993663      993564        syn-C2H3C(O)NH2, v=0
  469666.1416  0.0291 -5.0556 3 1503.4221199  71510 303993664      993565        syn-C2H3C(O)NH2, v=0
  469747.2933  0.0818 -5.3354 3 1613.3025223  71510 303B11992      B11893        syn-C2H3C(O)NH2, v=0
  469747.2973  0.0818 -5.3354 3 1613.3025223  71510 303B12092      B11993        syn-C2H3C(O)NH2, v=0
  469833.5680  0.0033 -5.7926 3  764.1732129  71510 303643430      633429        syn-C2H3C(O)NH2, v=0
  469833.5680  0.0033 -5.7926 3  764.1732129  71510 303643431      633430        syn-C2H3C(O)NH2, v=0
  469902.1704  0.0059 -5.6445 3  122.1323 65  71510 30332 627      32 330        syn-C2H3C(O)NH2, v=0
  469910.1415  0.0024 -3.2548 3  569.5779135  71510 303671057      661156        syn-C2H3C(O)NH2, v=0
  469910.2525  0.0024 -5.2468 3  569.5779135  71510 303671157      661156        syn-C2H3C(O)NH2, v=0
  469910.3457  0.0024 -5.2468 3  569.5778135  71510 303671057      661056        syn-C2H3C(O)NH2, v=0
  469910.4567  0.0024 -3.2548 3  569.5778135  71510 303671157      661056        syn-C2H3C(O)NH2, v=0
  469911.1244  0.0037 -3.6852 3  645.7811113  71510 303563422      563323        syn-C2H3C(O)NH2, v=0
  469911.1244  0.0037 -3.6852 3  645.7811113  71510 303563423      563324        syn-C2H3C(O)NH2, v=0
  469936.7389  0.0054 -5.1701 3  164.5243 73  71510 30336 729      36 432        syn-C2H3C(O)NH2, v=0
  469954.2219  0.0208 -4.2752 3  784.4410151  71510 303751956      742055        syn-C2H3C(O)NH2, v=0
  469992.7008  0.0011 -3.0068 3  222.4866 79  71510 303391426      381325        syn-C2H3C(O)NH2, v=0
  470036.0555  0.0124 -4.4176 3 1146.2255169  71510 303843549      843450        syn-C2H3C(O)NH2, v=0
  470036.0555  0.0124 -4.4176 3 1146.2255169  71510 303843550      843451        syn-C2H3C(O)NH2, v=0
  470134.2719  0.0306 -4.4292 3  850.3775157  71510 303782058      772157        syn-C2H3C(O)NH2, v=0
  470180.8685  0.0037 -3.6735 3  632.0934111  71510 303553421      553322        syn-C2H3C(O)NH2, v=0
  470180.8685  0.0037 -3.6735 3  632.0934111  71510 303553422      553323        syn-C2H3C(O)NH2, v=0
  470229.1956  0.0031 -5.7497 3  748.5756129  71510 303643331      633330        syn-C2H3C(O)NH2, v=0
  470229.1956  0.0031 -5.7497 3  748.5756129  71510 303643332      633331        syn-C2H3C(O)NH2, v=0
  470262.9532  0.0040 -4.7521 3  237.5139 85  71510 303421132      42 835        syn-C2H3C(O)NH2, v=0
  470269.4170  0.0397 -4.7889 3 1286.6578203  71510 303A11487      A11388        syn-C2H3C(O)NH2, v=0
  470269.4170  0.0397 -4.7889 3 1286.6578203  71510 303A11587      A11488        syn-C2H3C(O)NH2, v=0
  470294.8646  0.0011 -3.0064 3  222.4781 79  71510 303391425      381326        syn-C2H3C(O)NH2, v=0
  470314.1553  0.0044 -4.6085 3  359.5256101  71510 303501634      501337        syn-C2H3C(O)NH2, v=0
  470381.0366  0.0707 -5.2172 3 1545.5475219  71510 303A91891      A91792        syn-C2H3C(O)NH2, v=0
  470381.0377  0.0707 -5.2172 3 1545.5475219  71510 303A91991      A91892        syn-C2H3C(O)NH2, v=0
  470398.7589  0.0071 -4.5713 3  670.3013139  71510 303691950      691653        syn-C2H3C(O)NH2, v=0
  470423.4714  0.0022 -3.2907 3  563.4404133  71510 303661155      651254        syn-C2H3C(O)NH2, v=0
  470426.1100  0.0022 -5.2414 3  563.4404133  71510 303661255      651254        syn-C2H3C(O)NH2, v=0
  470428.1685  0.0022 -5.2414 3  563.4403133  71510 303661155      651154        syn-C2H3C(O)NH2, v=0
  470430.8071  0.0022 -3.2907 3  563.4403133  71510 303661255      651154        syn-C2H3C(O)NH2, v=0
  470437.3226  0.0037 -3.6630 3  618.6542109  71510 303543420      543321        syn-C2H3C(O)NH2, v=0
  470437.3226  0.0037 -3.6630 3  618.6542109  71510 303543421      543322        syn-C2H3C(O)NH2, v=0
  470497.5119  0.0024 -5.2987 3  123.5638 57  71510 303281315      281018        syn-C2H3C(O)NH2, v=0
  470501.3712  0.0024 -4.6261 3  264.0289 87  71510 303431430      431133        syn-C2H3C(O)NH2, v=0
  470650.3064  0.0221 -4.2911 3  728.0952165  71510 30382 379      82 280        syn-C2H3C(O)NH2, v=0
  470650.3064  0.0221 -4.2911 3  728.0952165  71510 30382 479      82 380        syn-C2H3C(O)NH2, v=0
  470659.5748  0.0029 -5.7081 3  733.4653129  71510 303643232      633231        syn-C2H3C(O)NH2, v=0
  470659.5748  0.0029 -5.7081 3  733.4653129  71510 303643233      633232        syn-C2H3C(O)NH2, v=0
  470666.9733  0.0458 -4.8889 3 1349.5474207  71510 303A31588      A31489        syn-C2H3C(O)NH2, v=0
  470666.9733  0.0458 -4.8889 3 1349.5474207  71510 303A31688      A31589        syn-C2H3C(O)NH2, v=0
  470680.9788  0.0037 -3.6540 3  605.4634107  71510 303533419      533320        syn-C2H3C(O)NH2, v=0
  470680.9788  0.0037 -3.6540 3  605.4634107  71510 303533420      533321        syn-C2H3C(O)NH2, v=0
  470735.5829  0.0611 -5.1033 3 1478.9988215  71510 303A71790      A71691        syn-C2H3C(O)NH2, v=0
  470735.5832  0.0611 -5.1033 3 1478.9988215  71510 303A71890      A71791        syn-C2H3C(O)NH2, v=0
  470795.6479  0.0025 -4.6034 3  275.0832 89  71510 303441431      441134        syn-C2H3C(O)NH2, v=0
  470817.6533  0.0017 -5.1579 3  501.7733121  71510 303601644      591643        syn-C2H3C(O)NH2, v=0
  470822.5451  0.1513 -5.8969 3 1925.0114241  71510 303C02397      C02298        syn-C2H3C(O)NH2, v=0
  470822.8592  0.1513 -5.8969 3 1925.0114241  71510 303C02497      C02398        syn-C2H3C(O)NH2, v=0
  470826.3677  0.0529 -4.9938 3 1413.6632211  71510 303A51689      A51590        syn-C2H3C(O)NH2, v=0
  470826.3678  0.0529 -4.9938 3 1413.6632211  71510 303A51789      A51690        syn-C2H3C(O)NH2, v=0
  470875.9563  0.0024 -5.2981 3  123.5512 57  71510 303281316      281019        syn-C2H3C(O)NH2, v=0
  470876.3821  0.0117 -4.3813 3 1125.4910167  71510 303833548      833449        syn-C2H3C(O)NH2, v=0
  470876.3821  0.0117 -4.3813 3 1125.4910167  71510 303833549      833450        syn-C2H3C(O)NH2, v=0
  470912.3157  0.0037 -3.6466 3  592.5206105  71510 303523418      523319        syn-C2H3C(O)NH2, v=0
  470912.3157  0.0037 -3.6466 3  592.5206105  71510 303523419      523320        syn-C2H3C(O)NH2, v=0
  470937.0609  0.0043 -4.8623 3  211.9498 81  71510 303401031      40 734        syn-C2H3C(O)NH2, v=0
  471025.1699  0.0276 -5.0090 3 1478.8342197  71510 303983662      983563        syn-C2H3C(O)NH2, v=0
  471025.1706  0.0276 -5.0090 3 1478.8342197  71510 303983663      983564        syn-C2H3C(O)NH2, v=0
  471025.6289  0.0018 -5.3561 3  594.3909127  71510 303632242      622241        syn-C2H3C(O)NH2, v=0
  471026.7116  0.0018 -5.3561 3  594.3909127  71510 303632241      622240        syn-C2H3C(O)NH2, v=0
  471052.2260  0.1253 -5.9334 3 1542.3700211  71510 303A52779      A42876        syn-C2H3C(O)NH2, v=0
  471095.2843  0.0030 -4.8217 3  212.7279 77  71510 303381424      381127        syn-C2H3C(O)NH2, v=0
  471122.4236  0.0228 -4.4053 3 1011.0942185  71510 30392 983      92 884        syn-C2H3C(O)NH2, v=0
  471122.4236  0.0228 -4.4053 3 1011.0942185  71510 303921083      92 984        syn-C2H3C(O)NH2, v=0
  471129.9845  0.0028 -5.6680 3  718.8450129  71510 303643133      633132        syn-C2H3C(O)NH2, v=0
  471129.9845  0.0028 -5.6680 3  718.8450129  71510 303643134      633133        syn-C2H3C(O)NH2, v=0
  471131.7987  0.0037 -3.6407 3  579.8258103  71510 303513417      513318        syn-C2H3C(O)NH2, v=0
  471131.7987  0.0037 -3.6407 3  579.8258103  71510 303513418      513319        syn-C2H3C(O)NH2, v=0
  471188.6888  0.0020 -3.3345 3  556.5883131  71510 303651253      641352        syn-C2H3C(O)NH2, v=0
  471191.3044  0.0263 -4.5954 3  646.4023159  71510 30379 178      79 079        syn-C2H3C(O)NH2, v=0
  471191.3044  0.0263 -4.5954 3  646.4023159  71510 30379 278      79 179        syn-C2H3C(O)NH2, v=0
  471192.7280  0.0510 -5.5672 3 1778.9659219  71510 303A93772      A93673        syn-C2H3C(O)NH2, v=0
  471192.8080  0.0510 -5.5672 3 1778.9659219  71510 303A93773      A93674        syn-C2H3C(O)NH2, v=0
  471238.3184  0.0020 -5.2339 3  556.5883131  71510 303651353      641352        syn-C2H3C(O)NH2, v=0
  471263.2439  0.0043 -5.0293 3   73.5612 55  71510 30327 225      26 126        syn-C2H3C(O)NH2, v=0
  471264.3408  0.0043 -5.0293 3   73.5612 55  71510 30327 325      26 026        syn-C2H3C(O)NH2, v=0
  471273.5927  0.0020 -5.2339 3  556.5854131  71510 303651253      641252        syn-C2H3C(O)NH2, v=0
  471287.1994  0.0016 -5.2408 3  544.7686125  71510 303621845      611844        syn-C2H3C(O)NH2, v=0
  471301.6047  0.0056 -5.3763 3  142.6922 69  71510 30334 628      34 331        syn-C2H3C(O)NH2, v=0
  471323.2222  0.0020 -3.3343 3  556.5854131  71510 303651353      641252        syn-C2H3C(O)NH2, v=0
  471339.8802  0.0037 -3.6366 3  567.3786101  71510 303503416      503317        syn-C2H3C(O)NH2, v=0
  471339.8802  0.0037 -3.6366 3  567.3786101  71510 303503417      503318        syn-C2H3C(O)NH2, v=0
  471425.9524  0.0018 -5.1981 3  522.7461123  71510 303611744      601743        syn-C2H3C(O)NH2, v=0
  471468.5458  0.0837 -6.0842 3 2050.7751237  71510 303B83880      B83781        syn-C2H3C(O)NH2, v=0
  471470.3793  0.0837 -6.0842 3 2050.7750237  71510 303B83881      B83782        syn-C2H3C(O)NH2, v=0
  471537.0005  0.0038 -3.6345 3  555.1789 99  71510 303493415      493316        syn-C2H3C(O)NH2, v=0
  471537.0005  0.0038 -3.6345 3  555.1789 99  71510 303493416      493317        syn-C2H3C(O)NH2, v=0
  471569.9123  0.0023 -4.6543 3  253.2002 85  71510 303421429      421132        syn-C2H3C(O)NH2, v=0
  471646.7901  0.0027 -5.6293 3  704.7176129  71510 303643034      633033        syn-C2H3C(O)NH2, v=0
  471646.7901  0.0027 -5.6293 3  704.7176129  71510 303643035      633034        syn-C2H3C(O)NH2, v=0
  471668.2900  0.0201 -4.2763 3  865.5472175  71510 30387 681      87 582        syn-C2H3C(O)NH2, v=0
  471668.2900  0.0201 -4.2763 3  865.5472175  71510 30387 781      87 682        syn-C2H3C(O)NH2, v=0
  471684.2261  0.0112 -4.3457 3 1105.0130165  71510 303823547      823448        syn-C2H3C(O)NH2, v=0
  471684.2261  0.0112 -4.3457 3 1105.0130165  71510 303823548      823449        syn-C2H3C(O)NH2, v=0
  471717.5167  0.1470 -5.6599 3 1473.1840205  71510 303A22874      A12973        syn-C2H3C(O)NH2, v=0
  471723.5880  0.0038 -3.6344 3  543.2265 97  71510 303483414      483315        syn-C2H3C(O)NH2, v=0
  471723.5880  0.0038 -3.6344 3  543.2265 97  71510 303483415      483316        syn-C2H3C(O)NH2, v=0
  471727.4120  0.0019 -3.3939 3  548.9421129  71510 303641351      631450        syn-C2H3C(O)NH2, v=0
  471893.9115  0.0016 -5.2049 3  531.3360125  71510 303621647      611646        syn-C2H3C(O)NH2, v=0
  471900.0593  0.0039 -3.6367 3  531.5211 95  71510 303473413      473314        syn-C2H3C(O)NH2, v=0
  471900.0593  0.0039 -3.6367 3  531.5211 95  71510 303473414      473315        syn-C2H3C(O)NH2, v=0
  471933.7950  0.0038 -4.6667 3  264.2919 89  71510 303441233      44 936        syn-C2H3C(O)NH2, v=0
  472035.9167  0.0015 -2.6664 3  165.7261 47  71510 3032322 1      2221 2        syn-C2H3C(O)NH2, v=0
  472035.9167  0.0015 -2.6664 3  165.7261 47  71510 3032322 2      2221 1        syn-C2H3C(O)NH2, v=0
  472066.8201  0.0040 -3.6415 3  520.0626 93  71510 303463412      463313        syn-C2H3C(O)NH2, v=0
  472066.8201  0.0040 -3.6415 3  520.0626 93  71510 303463413      463314        syn-C2H3C(O)NH2, v=0
  472217.7507  0.0026 -5.5919 3  691.0869129  71510 303642935      632934        syn-C2H3C(O)NH2, v=0
  472217.7507  0.0026 -5.5919 3  691.0869129  71510 303642936      632935        syn-C2H3C(O)NH2, v=0
  472224.2649  0.0041 -3.6494 3  508.8508 91  71510 303453411      453312        syn-C2H3C(O)NH2, v=0
  472224.2649  0.0041 -3.6494 3  508.8508 91  71510 303453412      453313        syn-C2H3C(O)NH2, v=0
  472262.5022  0.0047 -4.9985 3  187.6150 77  71510 30338 930      38 633        syn-C2H3C(O)NH2, v=0
  472284.7090  0.0055 -5.3749 3  142.6922 69  71510 30334 728      34 431        syn-C2H3C(O)NH2, v=0
  472333.0013  0.0262 -4.9630 3 1454.5087195  71510 303973661      973562        syn-C2H3C(O)NH2, v=0
  472333.0016  0.0262 -4.9630 3 1454.5087195  71510 303973662      973563        syn-C2H3C(O)NH2, v=0
  472348.2889  0.0010 -2.9314 3  209.7863 75  71510 303371523      361422        syn-C2H3C(O)NH2, v=0
  472354.3456  0.0010 -2.9314 3  209.7861 75  71510 303371522      361423        syn-C2H3C(O)NH2, v=0
  472372.7778  0.0042 -3.6606 3  497.8855 89  71510 303443410      443311        syn-C2H3C(O)NH2, v=0
  472372.7778  0.0042 -3.6606 3  497.8855 89  71510 303443411      443312        syn-C2H3C(O)NH2, v=0
  472445.4219  0.0019 -5.2239 3  548.9421129  71510 303641451      631450        syn-C2H3C(O)NH2, v=0
  472460.7448  0.0106 -4.3109 3 1084.7910163  71510 303813546      813447        syn-C2H3C(O)NH2, v=0
  472460.7448  0.0106 -4.3109 3 1084.7910163  71510 303813547      813448        syn-C2H3C(O)NH2, v=0
  472465.6729  0.0013 -2.6924 3  167.5018 51  71510 3032521 4      2420 5        syn-C2H3C(O)NH2, v=0
  472465.6729  0.0013 -2.6924 3  167.5018 51  71510 3032521 5      2420 4        syn-C2H3C(O)NH2, v=0
  472512.7325  0.0043 -3.6758 3  487.1665 87  71510 3034334 9      433310        syn-C2H3C(O)NH2, v=0
  472512.7325  0.0043 -3.6758 3  487.1665 87  71510 303433410      433311        syn-C2H3C(O)NH2, v=0
  472589.2190  0.0254 -4.4764 3 1068.3640189  71510 303941084      94 985        syn-C2H3C(O)NH2, v=0
  472589.2190  0.0254 -4.4764 3 1068.3640189  71510 303941184      941085        syn-C2H3C(O)NH2, v=0
  472644.4923  0.0044 -3.6958 3  476.6936 85  71510 3034234 8      4233 9        syn-C2H3C(O)NH2, v=0
  472644.4923  0.0044 -3.6958 3  476.6936 85  71510 3034234 9      423310        syn-C2H3C(O)NH2, v=0
  472668.2248  0.0018 -5.3281 3  584.9680127  71510 303632143      622142        syn-C2H3C(O)NH2, v=0
  472673.8776  0.1316 -5.7614 3 1851.8925237  71510 303B82296      B82197        syn-C2H3C(O)NH2, v=0
  472673.9742  0.1316 -5.7614 3 1851.8925237  71510 303B82396      B82297        syn-C2H3C(O)NH2, v=0
  472678.4970  0.0027 -4.5867 3  286.3565 91  71510 303451432      451135        syn-C2H3C(O)NH2, v=0
  472678.8908  0.0018 -5.3281 3  584.9685127  71510 303632142      622141        syn-C2H3C(O)NH2, v=0
  472707.0046  0.0017 -5.1865 3  524.3061125  71510 303621448      611447        syn-C2H3C(O)NH2, v=0
  472768.4112  0.0046 -3.7215 3  466.4666 83  71510 3034134 7      4133 8        syn-C2H3C(O)NH2, v=0
  472768.4112  0.0046 -3.7215 3  466.4666 83  71510 3034134 8      4133 9        syn-C2H3C(O)NH2, v=0
  472852.4452  0.0025 -5.5559 3  677.9571129  71510 303642836      632835        syn-C2H3C(O)NH2, v=0
  472852.4452  0.0025 -5.5559 3  677.9571129  71510 303642837      632836        syn-C2H3C(O)NH2, v=0
  472871.0505  0.0012 -2.7205 3  170.7505 55  71510 3032720 7      2619 8        syn-C2H3C(O)NH2, v=0
  472871.0505  0.0012 -2.7205 3  170.7505 55  71510 3032720 8      2619 7        syn-C2H3C(O)NH2, v=0
  472884.8330  0.0047 -3.7543 3  456.4854 81  71510 3034034 6      4033 7        syn-C2H3C(O)NH2, v=0
  472884.8330  0.0047 -3.7543 3  456.4854 81  71510 3034034 7      4033 8        syn-C2H3C(O)NH2, v=0
  472892.7740  0.0754 -5.7563 3 1488.9188207  71510 303A32777      A22874        syn-C2H3C(O)NH2, v=0
  472895.2040  0.0019 -5.2230 3  548.9032129  71510 303641351      631350        syn-C2H3C(O)NH2, v=0
  472942.2128  0.0016 -5.2194 3  537.8347125  71510 303621746      611745        syn-C2H3C(O)NH2, v=0
  472964.8976  0.0051 -5.1659 3  164.5243 73  71510 30336 829      36 532        syn-C2H3C(O)NH2, v=0
  472985.6775  0.0483 -5.5138 3 1751.7863217  71510 303A83771      A83672        syn-C2H3C(O)NH2, v=0
  472985.7205  0.0483 -5.5138 3 1751.7863217  71510 303A83772      A83673        syn-C2H3C(O)NH2, v=0
  472994.0924  0.0048 -3.7964 3  446.7499 79  71510 3033934 5      3933 6        syn-C2H3C(O)NH2, v=0
  472994.0924  0.0048 -3.7964 3  446.7499 79  71510 3033934 6      3933 7        syn-C2H3C(O)NH2, v=0
  473096.5144  0.0050 -3.8511 3  437.2598 77  71510 3033834 4      3833 5        syn-C2H3C(O)NH2, v=0
  473096.5144  0.0050 -3.8511 3  437.2598 77  71510 3033834 5      3833 6        syn-C2H3C(O)NH2, v=0
  473133.1950  0.1416 -6.0098 3 1655.3942217  71510 303A83079      A73176        syn-C2H3C(O)NH2, v=0
  473160.8215  0.0215 -4.2682 3  778.9130169  71510 30384 480      84 381        syn-C2H3C(O)NH2, v=0
  473160.8215  0.0215 -4.2682 3  778.9130169  71510 30384 580      84 481        syn-C2H3C(O)NH2, v=0
  473192.4153  0.0051 -3.9238 3  428.0150 75  71510 3033734 3      3733 4        syn-C2H3C(O)NH2, v=0
  473192.4153  0.0051 -3.9238 3  428.0150 75  71510 3033734 4      3733 5        syn-C2H3C(O)NH2, v=0
  473195.8588  0.0024 -5.3812 3  116.5731 55  71510 303271314      271017        syn-C2H3C(O)NH2, v=0
  473207.0442  0.0101 -4.2769 3 1064.8246161  71510 303803545      803446        syn-C2H3C(O)NH2, v=0
  473207.0442  0.0101 -4.2769 3 1064.8246161  71510 303803546      803447        syn-C2H3C(O)NH2, v=0
  473212.9706  0.0088 -4.5732 3  628.8230135  71510 303671849      671552        syn-C2H3C(O)NH2, v=0
  473223.9450  0.0011 -2.7515 3  175.4848 59  71510 303291910      281811        syn-C2H3C(O)NH2, v=0
  473223.9450  0.0011 -2.7515 3  175.4848 59  71510 303291911      281810        syn-C2H3C(O)NH2, v=0
  473265.0182  0.0010 -2.8736 3  198.8232 71  71510 303351620      341519        syn-C2H3C(O)NH2, v=0
  473265.0844  0.0010 -2.8736 3  198.8232 71  71510 303351619      341520        syn-C2H3C(O)NH2, v=0
  473282.1022  0.0053 -4.0248 3  419.0153 73  71510 3033634 2      3633 3        syn-C2H3C(O)NH2, v=0
  473282.1022  0.0053 -4.0248 3  419.0153 73  71510 3033634 3      3633 4        syn-C2H3C(O)NH2, v=0
  473342.2204  0.0035 -3.4069 3  386.6612107  71510 303531440      521339        syn-C2H3C(O)NH2, v=0
  473365.8732  0.0054 -4.1773 3  410.2607 71  71510 3033534 1      3533 2        syn-C2H3C(O)NH2, v=0
  473365.8732  0.0054 -4.1773 3  410.2607 71  71510 3033534 2      3533 3        syn-C2H3C(O)NH2, v=0
  473385.1835  0.0024 -5.3809 3  116.5668 55  71510 303271315      271018        syn-C2H3C(O)NH2, v=0
  473444.0178  0.0056 -4.4549 3  401.7509 69  71510 3033434 0      3433 1        syn-C2H3C(O)NH2, v=0
  473444.0178  0.0056 -4.4549 3  401.7509 69  71510 3033434 1      3433 2        syn-C2H3C(O)NH2, v=0
  473475.5913  0.0010 -2.7864 3  181.7223 63  71510 303311813      301714        syn-C2H3C(O)NH2, v=0
  473475.5913  0.0010 -2.7864 3  181.7223 63  71510 303311814      301713        syn-C2H3C(O)NH2, v=0
  473508.2494  0.0017 -5.2370 3  544.8893125  71510 303621844      611843        syn-C2H3C(O)NH2, v=0
  473516.3284  0.0017 -5.2123 3  540.4500127  71510 303631549      621548        syn-C2H3C(O)NH2, v=0
  473540.6663  0.0010 -2.8264 3  189.4888 67  71510 303331717      321616        syn-C2H3C(O)NH2, v=0
  473540.6667  0.0010 -2.8264 3  189.4888 67  71510 303331716      321617        syn-C2H3C(O)NH2, v=0
  473562.8759  0.0024 -5.5211 3  665.3334129  71510 303642737      632736        syn-C2H3C(O)NH2, v=0
  473562.8759  0.0024 -5.5211 3  665.3334129  71510 303642738      632737        syn-C2H3C(O)NH2, v=0
  473591.7539  0.0248 -4.9178 3 1430.4447193  71510 303963660      963561        syn-C2H3C(O)NH2, v=0
  473591.7541  0.0248 -4.9178 3 1430.4447193  71510 303963661      963562        syn-C2H3C(O)NH2, v=0
  473613.2138  0.0019 -3.3902 3  548.9032129  71510 303641451      631350        syn-C2H3C(O)NH2, v=0
  473684.4989  0.0210 -4.3188 3  919.6158179  71510 30389 782      89 683        syn-C2H3C(O)NH2, v=0
  473684.4989  0.0210 -4.3188 3  919.6158179  71510 30389 882      89 783        syn-C2H3C(O)NH2, v=0
  473747.2189  0.0791 -6.0246 3 2021.2429235  71510 303B73879      B73780        syn-C2H3C(O)NH2, v=0
  473748.2544  0.0791 -6.0246 3 2021.2429235  71510 303B73880      B73781        syn-C2H3C(O)NH2, v=0
  473750.8652  0.0023 -4.6872 3  242.6042 83  71510 303411428      411131        syn-C2H3C(O)NH2, v=0
  473864.5382  0.0286 -4.5546 3 1126.8906193  71510 303961185      961086        syn-C2H3C(O)NH2, v=0
  473864.5382  0.0286 -4.5546 3 1126.8906193  71510 303961285      961186        syn-C2H3C(O)NH2, v=0
  473866.0675  0.0015 -5.1390 3  497.5038121  71510 303601545      591544        syn-C2H3C(O)NH2, v=0
  473924.1828  0.0096 -4.2435 3 1045.1135159  71510 303793544      793445        syn-C2H3C(O)NH2, v=0
  473924.1828  0.0096 -4.2435 3 1045.1135159  71510 303793545      793446        syn-C2H3C(O)NH2, v=0
  473944.8773  0.0916 -5.8364 3 1515.4599209  71510 303A42778      A32875        syn-C2H3C(O)NH2, v=0
  474006.6920  0.0250 -4.3919 3  695.2274163  71510 30381 279      81 180        syn-C2H3C(O)NH2, v=0
  474006.6920  0.0250 -4.3919 3  695.2274163  71510 30381 379      81 280        syn-C2H3C(O)NH2, v=0
  474170.1233  0.1143 -5.6299 3 1779.9510233  71510 303B62195      B62096        syn-C2H3C(O)NH2, v=0
  474170.1520  0.1143 -5.6299 3 1779.9510233  71510 303B62295      B62196        syn-C2H3C(O)NH2, v=0
  474310.8486  0.0019 -3.8262 3  134.2652 65  71510 30332 924      31 625        syn-C2H3C(O)NH2, v=0
  474364.3528  0.0023 -5.4877 3  653.2223129  71510 303642639      632638        syn-C2H3C(O)NH2, v=0
  474364.3529  0.0023 -5.4877 3  653.2223129  71510 303642638      632637        syn-C2H3C(O)NH2, v=0
  474448.2836  0.0050 -3.7825 3  619.2370135  71510 303671651      661750        syn-C2H3C(O)NH2, v=0
  474465.1981  0.0948 -5.7752 3 1525.4135209  71510 303A42877      A32974        syn-C2H3C(O)NH2, v=0
  474473.7992  0.0019 -4.8472 3   71.0912 47  71510 30323 914      22 617        syn-C2H3C(O)NH2, v=0
  474613.1742  0.0092 -4.2110 3 1025.6573157  71510 303783543      783444        syn-C2H3C(O)NH2, v=0
  474613.1742  0.0092 -4.2110 3 1025.6573157  71510 303783544      783445        syn-C2H3C(O)NH2, v=0
  474661.8962  0.0020 -3.4859 3  556.2448129  71510 303641450      631549        syn-C2H3C(O)NH2, v=0
  474680.5221  0.0018 -5.3011 3  576.1522127  71510 303632044      622043        syn-C2H3C(O)NH2, v=0
  474709.7436  0.0458 -5.4611 3 1724.8734215  71510 303A73770      A73671        syn-C2H3C(O)NH2, v=0
  474709.7664  0.0458 -5.4611 3 1724.8734215  71510 303A73771      A73672        syn-C2H3C(O)NH2, v=0
  474726.6787  0.0029 -3.6227 3  579.2392131  71510 303651550      641649        syn-C2H3C(O)NH2, v=0
  474770.2937  0.0018 -5.3009 3  576.1560127  71510 303632043      622042        syn-C2H3C(O)NH2, v=0
  474803.4202  0.0236 -4.8733 3 1406.6419191  71510 303953659      953560        syn-C2H3C(O)NH2, v=0
  474803.4202  0.0236 -4.8733 3 1406.6419191  71510 303953660      953561        syn-C2H3C(O)NH2, v=0
  474936.9148  0.0024 -5.8665 3   40.9531 33  71510 3031610 7      15 7 8        syn-C2H3C(O)NH2, v=0
  474941.7176  0.0325 -4.6394 3 1186.6682197  71510 303981286      981187        syn-C2H3C(O)NH2, v=0
  474941.7176  0.0325 -4.6394 3 1186.6682197  71510 303981386      981287        syn-C2H3C(O)NH2, v=0
  474974.8366  0.0024 -5.8665 3   40.9518 33  71510 3031610 6      15 7 9        syn-C2H3C(O)NH2, v=0
  475123.7381  0.1198 -5.8852 3 1589.6489213  71510 303A62978      A53075        syn-C2H3C(O)NH2, v=0
  475134.1835  0.0038 -5.2604 3  611.3685151  71510 30375 372      74 371        syn-C2H3C(O)NH2, v=0
  475134.2139  0.0200 -3.0996 3  611.3685151 -71510 30375 372      74 471        syn-C2H3C(O)NH2, v=0
  475134.2139  0.0200 -3.0996 3  611.3685151 -71510 30375 472      74 371        syn-C2H3C(O)NH2, v=0
  475134.1835  0.0038 -5.2604 3  611.3685151  71510 30375 472      74 471        syn-C2H3C(O)NH2, v=0
  475136.3592  0.0036 -5.2641 3  609.2910149  71510 30374 470      73 469        syn-C2H3C(O)NH2, v=0
  475136.3949  0.0200 -3.1198 3  609.2910149 -71510 30374 470      73 569        syn-C2H3C(O)NH2, v=0
  475136.3949  0.0200 -3.1198 3  609.2910149 -71510 30374 570      73 469        syn-C2H3C(O)NH2, v=0
  475136.3592  0.0036 -5.2641 3  609.2910149  71510 30374 570      73 569        syn-C2H3C(O)NH2, v=0
  475140.6735  0.0044 -5.2556 3  612.9251153  71510 30376 274      75 273        syn-C2H3C(O)NH2, v=0
  475140.7121  0.0200 -3.0798 3  612.9251153 -71510 30376 274      75 373        syn-C2H3C(O)NH2, v=0
  475140.7121  0.0200 -3.0798 3  612.9251153 -71510 30376 374      75 273        syn-C2H3C(O)NH2, v=0
  475140.6735  0.0044 -5.2556 3  612.9251153  71510 30376 374      75 373        syn-C2H3C(O)NH2, v=0
  475151.4050  0.0053 -5.2499 3  613.9675155  71510 30377 176      76 175        syn-C2H3C(O)NH2, v=0
  475151.4221  0.0200 -3.0603 3  613.9675155 -71510 30377 176      76 275        syn-C2H3C(O)NH2, v=0
  475151.4221  0.0200 -3.0603 3  613.9675155 -71510 30377 276      76 175        syn-C2H3C(O)NH2, v=0
  475151.4050  0.0053 -5.2499 3  613.9675155  71510 30377 276      76 275        syn-C2H3C(O)NH2, v=0
  475153.1564  0.0035 -5.2667 3  606.6842147  71510 30373 568      72 567        syn-C2H3C(O)NH2, v=0
  475153.1734  0.0200 -3.1405 3  606.6842147 -71510 30373 568      72 667        syn-C2H3C(O)NH2, v=0
  475153.1734  0.0200 -3.1405 3  606.6842147 -71510 30373 668      72 567        syn-C2H3C(O)NH2, v=0
  475153.1564  0.0035 -5.2667 3  606.6842147  71510 30373 668      72 667        syn-C2H3C(O)NH2, v=0
  475163.0463  0.0069 -5.2432 3  614.5015157  71510 30378 078      77 077        syn-C2H3C(O)NH2, v=0
  475163.0459  0.0200 -3.0408 3  614.5015157 -71510 30378 078      77 177        syn-C2H3C(O)NH2, v=0
  475163.0459  0.0200 -3.0408 3  614.5015157 -71510 30378 178      77 077        syn-C2H3C(O)NH2, v=0
  475163.0463  0.0069 -5.2432 3  614.5015157  71510 30378 178      77 177        syn-C2H3C(O)NH2, v=0
  475192.7259  0.0034 -5.2683 3  603.5381145  71510 30372 666      71 665        syn-C2H3C(O)NH2, v=0
  475192.7495  0.0200 -3.1620 3  603.5381145 -71510 30372 666      71 765        syn-C2H3C(O)NH2, v=0
  475192.7495  0.0200 -3.1620 3  603.5381145 -71510 30372 766      71 665        syn-C2H3C(O)NH2, v=0
  475192.7259  0.0034 -5.2683 3  603.5381145  71510 30372 766      71 765        syn-C2H3C(O)NH2, v=0
  475266.4516  0.0033 -5.2686 3  599.8401143  71510 30371 764      70 763        syn-C2H3C(O)NH2, v=0
  475266.4693  0.0200 -3.1847 3  599.8401143 -71510 30371 764      70 863        syn-C2H3C(O)NH2, v=0
  475266.4693  0.0200 -3.1847 3  599.8401143 -71510 30371 864      70 763        syn-C2H3C(O)NH2, v=0
  475266.4516  0.0033 -5.2686 3  599.8401143  71510 30371 864      70 863        syn-C2H3C(O)NH2, v=0
  475274.9907  0.0088 -4.1791 3 1006.4556155  71510 303773542      773443        syn-C2H3C(O)NH2, v=0
  475274.9907  0.0088 -4.1791 3 1006.4556155  71510 303773543      773444        syn-C2H3C(O)NH2, v=0
  475276.8323  0.0022 -5.4555 3  641.6318129  71510 303642540      632539        syn-C2H3C(O)NH2, v=0
  475276.8335  0.0022 -5.4555 3  641.6318129  71510 303642539      632538        syn-C2H3C(O)NH2, v=0
  475336.9566  0.0992 -5.5023 3 1709.1947229  71510 303B42094      B41995        syn-C2H3C(O)NH2, v=0
  475336.9648  0.0992 -5.5023 3 1709.1947229  71510 303B42194      B42095        syn-C2H3C(O)NH2, v=0
  475390.6604  0.0200 -3.2089 3  595.5745141 -71510 30370 862      69 961        syn-C2H3C(O)NH2, v=0
  475390.6433  0.0031 -5.2678 3  595.5745141  71510 30370 862      69 861        syn-C2H3C(O)NH2, v=0
  475390.6433  0.0031 -5.2678 3  595.5745141  71510 30370 962      69 961        syn-C2H3C(O)NH2, v=0
  475390.6604  0.0200 -3.2089 3  595.5745141 -71510 30370 962      69 861        syn-C2H3C(O)NH2, v=0
  475403.9059  0.0054 -6.0871 3  883.4993131  71510 303654025      644024        syn-C2H3C(O)NH2, v=0
  475403.9059  0.0054 -6.0871 3  883.4993131  71510 303654026      644025        syn-C2H3C(O)NH2, v=0
  475461.1818  0.1806 -6.0857 3 2028.8823247  71510 303C32499      C323A0        syn-C2H3C(O)NH2, v=0
  475461.7613  0.1806 -6.0857 3 2028.8823247  71510 303C32599      C324A0        syn-C2H3C(O)NH2, v=0
  475513.1496  0.0215 -4.2761 3  831.0207173  71510 30386 581      86 482        syn-C2H3C(O)NH2, v=0
  475513.1496  0.0215 -4.2761 3  831.0207173  71510 30386 681      86 582        syn-C2H3C(O)NH2, v=0
  475528.2988  0.0226 -4.3730 3  974.9582183  71510 30391 883      91 784        syn-C2H3C(O)NH2, v=0
  475528.2988  0.0226 -4.3730 3  974.9582183  71510 30391 983      91 884        syn-C2H3C(O)NH2, v=0
  475528.9946  0.0024 -5.4698 3  109.8486 53  71510 303261313      261016        syn-C2H3C(O)NH2, v=0
  475561.1312  0.0041 -4.5740 3   84.3618 57  71510 30328 325      27 226        syn-C2H3C(O)NH2, v=0
  475574.7979  0.0040 -4.5740 3   84.3618 57  71510 30328 425      27 126        syn-C2H3C(O)NH2, v=0
  475589.4634  0.0200 -3.2354 3  590.7208139 -71510 30369 960      681059        syn-C2H3C(O)NH2, v=0
  475589.4462  0.0029 -5.2656 3  590.7208139  71510 303691060      681059        syn-C2H3C(O)NH2, v=0
  475589.4479  0.0029 -5.2656 3  590.7208139  71510 30369 960      68 959        syn-C2H3C(O)NH2, v=0
  475589.4634  0.0200 -3.2354 3  590.7208139 -71510 303691060      68 959        syn-C2H3C(O)NH2, v=0
  475620.2371  0.0024 -5.4696 3  109.8455 53  71510 303261314      261017        syn-C2H3C(O)NH2, v=0
  475674.8747  0.0050 -6.0352 3  865.0235131  71510 303653926      643925        syn-C2H3C(O)NH2, v=0
  475674.8747  0.0050 -6.0352 3  865.0235131  71510 303653927      643926        syn-C2H3C(O)NH2, v=0
  475797.6730  0.0040 -3.9610 3  118.3943 63  71510 30331 625      30 526        syn-C2H3C(O)NH2, v=0
  475813.3882  0.0371 -4.7301 3 1247.6910201  71510 303A01387      A01288        syn-C2H3C(O)NH2, v=0
  475813.3882  0.0371 -4.7301 3 1247.6910201  71510 303A01487      A01388        syn-C2H3C(O)NH2, v=0
  475900.1167  0.0027 -3.2650 3  585.2524137  71510 303681058      671157        syn-C2H3C(O)NH2, v=0
  475900.1767  0.0027 -5.2620 3  585.2524137  71510 303681158      671157        syn-C2H3C(O)NH2, v=0
  475900.2276  0.0027 -5.2620 3  585.2524137  71510 303681058      671057        syn-C2H3C(O)NH2, v=0
  475900.2876  0.0027 -3.2650 3  585.2524137  71510 303681158      671057        syn-C2H3C(O)NH2, v=0
  475910.5654  0.0084 -4.1481 3  987.5081153  71510 303763541      763442        syn-C2H3C(O)NH2, v=0
  475910.5654  0.0084 -4.1481 3  987.5081153  71510 303763542      763443        syn-C2H3C(O)NH2, v=0
  475933.8628  0.0748 -5.9659 3 1991.9822233  71510 303B63878      B63779        syn-C2H3C(O)NH2, v=0
  475934.4426  0.0748 -5.9659 3 1991.9822233  71510 303B63879      B63780        syn-C2H3C(O)NH2, v=0
  475963.0511  0.0046 -5.9850 3  847.0259131  71510 303653827      643826        syn-C2H3C(O)NH2, v=0
  475963.0511  0.0046 -5.9850 3  847.0259131  71510 303653828      643827        syn-C2H3C(O)NH2, v=0
  475969.8764  0.0224 -4.8295 3 1383.0997189  71510 303943658      943559        syn-C2H3C(O)NH2, v=0
  475969.8764  0.0224 -4.8295 3 1383.0997189  71510 303943659      943560        syn-C2H3C(O)NH2, v=0
  475985.9140  0.0054 -4.5703 3  617.6548133  71510 303661947      661650        syn-C2H3C(O)NH2, v=0
  476196.3863  0.0861 -5.3788 3 1639.6313225  71510 303B21993      B21894        syn-C2H3C(O)NH2, v=0
  476196.3886  0.0861 -5.3788 3 1639.6313225  71510 303B22093      B21994        syn-C2H3C(O)NH2, v=0
  476241.4925  0.0200 -3.0208 3  232.2662 81 -71510 303401427      391326        syn-C2H3C(O)NH2, v=0
  476270.5733  0.0043 -5.9364 3  829.5079131  71510 303653728      643727        syn-C2H3C(O)NH2, v=0
  476270.5733  0.0043 -5.9364 3  829.5079131  71510 303653729      643728        syn-C2H3C(O)NH2, v=0
  476327.0350  0.0021 -5.4244 3  630.5722129  71510 303642441      632440        syn-C2H3C(O)NH2, v=0
  476327.0505  0.0021 -5.4244 3  630.5722129  71510 303642440      632439        syn-C2H3C(O)NH2, v=0
  476336.5072  0.0029 -4.5765 3  297.8430 93  71510 303461433      461136        syn-C2H3C(O)NH2, v=0
  476340.2215  0.0200 -3.1383 3  247.3863 85 -71510 303421329      411230        syn-C2H3C(O)NH2, v=0
  476368.2037  0.0435 -5.4092 3 1698.2265213  71510 303A63769      A63670        syn-C2H3C(O)NH2, v=0
  476368.2157  0.0435 -5.4092 3 1698.2265213  71510 303A63770      A63671        syn-C2H3C(O)NH2, v=0
  476376.5337  0.0036 -4.6968 3  281.1326 89  71510 303441529      441232        syn-C2H3C(O)NH2, v=0
  476382.1805  0.0200 -3.2993 3  579.1321135 -71510 303671156      661255        syn-C2H3C(O)NH2, v=0
  476383.6712  0.0025 -5.2566 3  579.1321135  71510 303671256      661255        syn-C2H3C(O)NH2, v=0
  476384.8357  0.0025 -5.2566 3  579.1321135  71510 303671156      661155        syn-C2H3C(O)NH2, v=0
  476386.3144  0.0200 -3.2993 3  579.1321135 -71510 303671256      661155        syn-C2H3C(O)NH2, v=0
  476471.3757  0.0425 -4.8262 3 1309.9529205  71510 303A21488      A21389        syn-C2H3C(O)NH2, v=0
  476471.3757  0.0425 -4.8262 3 1309.9529205  71510 303A21588      A21489        syn-C2H3C(O)NH2, v=0
  476520.7949  0.0080 -4.1178 3  968.8144151  71510 303753540      753441        syn-C2H3C(O)NH2, v=0
  476520.7949  0.0080 -4.1178 3  968.8144151  71510 303753541      753442        syn-C2H3C(O)NH2, v=0
  476599.9122  0.0040 -5.8894 3  812.4707131  71510 303653629      643628        syn-C2H3C(O)NH2, v=0
  476599.9122  0.0040 -5.8894 3  812.4707131  71510 303653630      643629        syn-C2H3C(O)NH2, v=0
  476604.5538  0.1643 -5.8235 3 1562.9516211  71510 303A52976      A43075        syn-C2H3C(O)NH2, v=0
  476672.0653  0.0240 -4.3162 3  745.3530167  71510 30383 380      83 281        syn-C2H3C(O)NH2, v=0
  476672.0653  0.0240 -4.3162 3  745.3530167  71510 30383 480      83 381        syn-C2H3C(O)NH2, v=0
  476712.6800  0.0052 -4.8993 3  221.5669 83  71510 30341 932      41 635        syn-C2H3C(O)NH2, v=0
  476767.4514  0.0747 -5.2594 3 1571.2681221  71510 303B01892      B01793        syn-C2H3C(O)NH2, v=0
  476767.4520  0.0747 -5.2594 3 1571.2681221  71510 303B01992      B01893        syn-C2H3C(O)NH2, v=0
  476784.8211  0.0023 -4.7242 3  232.2481 81  71510 303401427      401130        syn-C2H3C(O)NH2, v=0
  476811.2717  0.0200 -3.0199 3  232.2503 81 -71510 303401426      391327        syn-C2H3C(O)NH2, v=0
  476878.9839  0.0051 -4.5816 3  433.0015111  71510 303551738      551441        syn-C2H3C(O)NH2, v=0
  476906.5814  0.0488 -4.9275 3 1373.4478209  71510 303A41589      A41490        syn-C2H3C(O)NH2, v=0
  476906.5814  0.0488 -4.9275 3 1373.4478209  71510 303A41689      A41590        syn-C2H3C(O)NH2, v=0
  476953.9391  0.0038 -5.8439 3  795.9159131  71510 303653530      643529        syn-C2H3C(O)NH2, v=0
  476953.9391  0.0038 -5.8439 3  795.9159131  71510 303653531      643530        syn-C2H3C(O)NH2, v=0
  477066.7484  0.0647 -5.1443 3 1504.1119217  71510 303A81791      A81692        syn-C2H3C(O)NH2, v=0
  477066.7485  0.0647 -5.1443 3 1504.1119217  71510 303A81891      A81792        syn-C2H3C(O)NH2, v=0
  477092.8926  0.0212 -4.7864 3 1359.8175187  71510 303933657      933558        syn-C2H3C(O)NH2, v=0
  477092.8926  0.0212 -4.7864 3 1359.8175187  71510 303933658      933559        syn-C2H3C(O)NH2, v=0
  477101.2798  0.0018 -5.2750 3  567.9828127  71510 303631945      621944        syn-C2H3C(O)NH2, v=0
  477106.5414  0.0077 -4.0882 3  950.3741149  71510 303743539      743440        syn-C2H3C(O)NH2, v=0
  477106.5414  0.0077 -4.0882 3  950.3741149  71510 303743540      743441        syn-C2H3C(O)NH2, v=0
  477108.8404  0.0562 -5.0336 3 1438.1697213  71510 303A61690      A61591        syn-C2H3C(O)NH2, v=0
  477108.8404  0.0562 -5.0336 3 1438.1697213  71510 303A61790      A61691        syn-C2H3C(O)NH2, v=0
  477112.7007  0.0023 -3.3407 3  572.3071133  71510 303661254      651353        syn-C2H3C(O)NH2, v=0
  477141.5022  0.0023 -5.2492 3  572.3071133  71510 303661354      651353        syn-C2H3C(O)NH2, v=0
  477162.3302  0.0023 -5.2492 3  572.3054133  71510 303661254      651253        syn-C2H3C(O)NH2, v=0
  477191.1317  0.0023 -3.3405 3  572.3054133  71510 303661354      651253        syn-C2H3C(O)NH2, v=0
  477194.8621  0.0248 -4.4370 3 1031.5688187  71510 30393 984      93 885        syn-C2H3C(O)NH2, v=0
  477194.8621  0.0248 -4.4370 3 1031.5688187  71510 303931084      93 985        syn-C2H3C(O)NH2, v=0
  477214.2182  0.0283 -4.6185 3  662.6547161  71510 30380 179      80 080        syn-C2H3C(O)NH2, v=0
  477214.2182  0.0283 -4.6185 3  662.6547161  71510 30380 279      80 180        syn-C2H3C(O)NH2, v=0
  477303.6749  0.0019 -5.2042 3  540.0739127  71510 303631449      621448        syn-C2H3C(O)NH2, v=0
  477336.0108  0.0036 -5.7999 3  779.8452131  71510 303653431      643430        syn-C2H3C(O)NH2, v=0
  477336.0108  0.0036 -5.7999 3  779.8452131  71510 303653432      643431        syn-C2H3C(O)NH2, v=0
  477388.9576  0.0020 -3.2789 3  242.6042 85  71510 303421230      411131        syn-C2H3C(O)NH2, v=0
  477551.9410  0.0021 -5.3946 3  620.0565129  71510 303642342      632341        syn-C2H3C(O)NH2, v=0
  477552.1318  0.0021 -5.3946 3  620.0565129  71510 303642341      632340        syn-C2H3C(O)NH2, v=0
  477555.9145  0.0025 -5.5650 3  103.3874 51  71510 303251312      251015        syn-C2H3C(O)NH2, v=0
  477583.4012  0.1576 -5.9453 3 1953.9803243  71510 303C12398      C12299        syn-C2H3C(O)NH2, v=0
  477583.5839  0.1576 -5.9453 3 1953.9803243  71510 303C12498      C12399        syn-C2H3C(O)NH2, v=0
  477598.1968  0.0025 -5.5650 3  103.3860 51  71510 303251313      251016        syn-C2H3C(O)NH2, v=0
  477668.6350  0.0074 -4.0595 3  932.1871147  71510 303733538      733439        syn-C2H3C(O)NH2, v=0
  477668.6350  0.0074 -4.0595 3  932.1871147  71510 303733539      733440        syn-C2H3C(O)NH2, v=0
  477703.6937  0.0219 -4.3048 3  884.4132177  71510 30388 682      88 583        syn-C2H3C(O)NH2, v=0
  477703.6937  0.0219 -4.3048 3  884.4132177  71510 30388 782      88 683        syn-C2H3C(O)NH2, v=0
  477727.2070  0.0018 -5.2739 3  568.0129127  71510 303631944      621943        syn-C2H3C(O)NH2, v=0
  477750.0793  0.0034 -5.7573 3  764.2607131  71510 303653332      643331        syn-C2H3C(O)NH2, v=0
  477750.0793  0.0034 -5.7573 3  764.2607131  71510 303653333      643332        syn-C2H3C(O)NH2, v=0
  477791.7259  0.0035 -4.6076 3  292.2697 93  71510 303461334      461037        syn-C2H3C(O)NH2, v=0
  477856.8675  0.0021 -3.3952 3  564.7012131  71510 303651352      641451        syn-C2H3C(O)NH2, v=0
  477964.0962  0.0413 -5.3580 3 1671.8447211  71510 303A53768      A53669        syn-C2H3C(O)NH2, v=0
  477964.1025  0.0413 -5.3580 3 1671.8447211  71510 303A53769      A53670        syn-C2H3C(O)NH2, v=0
  478033.6441  0.0709 -5.9079 3 1962.9919231  71510 303B53877      B53778        syn-C2H3C(O)NH2, v=0
  478033.9660  0.0709 -5.9079 3 1962.9919231  71510 303B53878      B53779        syn-C2H3C(O)NH2, v=0
  478174.1413  0.0202 -4.7440 3 1336.7949185  71510 303923656      923557        syn-C2H3C(O)NH2, v=0
  478174.1413  0.0202 -4.7440 3 1336.7949185  71510 303923657      923558        syn-C2H3C(O)NH2, v=0
  478200.8322  0.0032 -5.7161 3  749.1648131  71510 303653233      643232        syn-C2H3C(O)NH2, v=0
  478200.8322  0.0032 -5.7161 3  749.1648131  71510 303653234      643233        syn-C2H3C(O)NH2, v=0
  478207.8752  0.0071 -4.0316 3  914.2529145  71510 303723537      723438        syn-C2H3C(O)NH2, v=0
  478207.8752  0.0071 -4.0316 3  914.2529145  71510 303723538      723439        syn-C2H3C(O)NH2, v=0
  478287.7859  0.0057 -5.1152 3   70.3792 49  71510 30324 717      23 420        syn-C2H3C(O)NH2, v=0
  478293.8150  0.0021 -5.2393 3  564.7012131  71510 303651452      641451        syn-C2H3C(O)NH2, v=0
  478425.4536  0.0039 -4.2970 3   95.4474 59  71510 30329 425      28 326        syn-C2H3C(O)NH2, v=0
  478548.4471  0.0039 -4.2969 3   95.4473 59  71510 30329 525      28 226        syn-C2H3C(O)NH2, v=0
  478574.8773  0.0021 -5.2388 3  564.6773131  71510 303651352      641351        syn-C2H3C(O)NH2, v=0
  478678.8983  0.0275 -4.5093 3 1089.4421191  71510 303951085      95 986        syn-C2H3C(O)NH2, v=0
  478678.8983  0.0275 -4.5093 3 1089.4421191  71510 303951185      951086        syn-C2H3C(O)NH2, v=0
  478693.8786  0.0031 -5.6764 3  734.5602131  71510 303653134      643133        syn-C2H3C(O)NH2, v=0
  478693.8786  0.0031 -5.6764 3  734.5602131  71510 303653135      643134        syn-C2H3C(O)NH2, v=0
  478725.0330  0.0068 -4.0045 3  896.5712143  71510 303713536      713437        syn-C2H3C(O)NH2, v=0
  478725.0330  0.0068 -4.0045 3  896.5712143  71510 303713537      713438        syn-C2H3C(O)NH2, v=0
  478776.4920  0.0018 -5.2179 3  547.0767127  71510 303631648      621647        syn-C2H3C(O)NH2, v=0
  479004.5738  0.0020 -5.3658 3  610.1026129  71510 303642243      632242        syn-C2H3C(O)NH2, v=0
  479006.6393  0.0020 -5.3658 3  610.1027129  71510 303642242      632241        syn-C2H3C(O)NH2, v=0
  479011.8248  0.0021 -3.3930 3  564.6773131  71510 303651452      641351        syn-C2H3C(O)NH2, v=0
  479148.9281  0.0038 -4.1028 3  106.7991 61  71510 30330 525      29 426        syn-C2H3C(O)NH2, v=0
  479152.2811  0.0010 -2.9402 3  218.9828 77  71510 303381524      371423        syn-C2H3C(O)NH2, v=0
  479165.2434  0.0010 -2.9402 3  218.9824 77  71510 303381523      371424        syn-C2H3C(O)NH2, v=0
  479184.4566  0.0234 -4.2946 3  796.7739171  71510 30385 481      85 382        syn-C2H3C(O)NH2, v=0
  479184.4566  0.0234 -4.2946 3  796.7739171  71510 30385 581      85 482        syn-C2H3C(O)NH2, v=0
  479209.2231  0.0043 -5.5494 3  130.1913 63  71510 303311021      31 526        syn-C2H3C(O)NH2, v=0
  479215.2057  0.0192 -4.7023 3 1314.0314183  71510 303913655      913556        syn-C2H3C(O)NH2, v=0
  479215.2057  0.0192 -4.7023 3 1314.0314183  71510 303913656      913557        syn-C2H3C(O)NH2, v=0
  479220.8523  0.0065 -3.9782 3  879.1417141  71510 303703535      703436        syn-C2H3C(O)NH2, v=0
  479220.8523  0.0065 -3.9782 3  879.1417141  71510 303703536      703437        syn-C2H3C(O)NH2, v=0
  479235.9963  0.0030 -5.6380 3  720.4501131  71510 303653035      643034        syn-C2H3C(O)NH2, v=0
  479235.9963  0.0030 -5.6380 3  720.4501131  71510 303653036      643035        syn-C2H3C(O)NH2, v=0
  479316.4362  0.0014 -2.6661 3  171.3257 49  71510 3032422 2      2321 3        syn-C2H3C(O)NH2, v=0
  479316.4362  0.0014 -2.6661 3  171.3257 49  71510 3032422 3      2321 2        syn-C2H3C(O)NH2, v=0
  479320.5868  0.0025 -5.6678 3   97.1874 49  71510 303241311      241014        syn-C2H3C(O)NH2, v=0
  479334.9103  0.1374 -5.8088 3 1880.2489239  71510 303B92297      B92198        syn-C2H3C(O)NH2, v=0
  479334.9659  0.1374 -5.8088 3 1880.2489239  71510 303B92397      B92298        syn-C2H3C(O)NH2, v=0
  479339.3815  0.0025 -5.6678 3   97.1867 49  71510 303241312      241015        syn-C2H3C(O)NH2, v=0
  479500.2452  0.0392 -5.3075 3 1645.7276209  71510 303A43767      A43668        syn-C2H3C(O)NH2, v=0
  479500.2485  0.0392 -5.3075 3 1645.7276209  71510 303A43768      A43669        syn-C2H3C(O)NH2, v=0
  479542.3339  0.0019 -5.2273 3  556.2448129  71510 303641550      631549        syn-C2H3C(O)NH2, v=0
  479567.2962  0.0018 -5.2505 3  560.4890127  71510 303631846      621845        syn-C2H3C(O)NH2, v=0
  479696.0515  0.0063 -3.9527 3  861.9642139  71510 303693534      693435        syn-C2H3C(O)NH2, v=0
  479696.0515  0.0063 -3.9527 3  861.9642139  71510 303693535      693436        syn-C2H3C(O)NH2, v=0
  479728.5393  0.0230 -4.3485 3  939.0848181  71510 30390 783      90 684        syn-C2H3C(O)NH2, v=0
  479728.5393  0.0230 -4.3485 3  939.0848181  71510 30390 883      90 784        syn-C2H3C(O)NH2, v=0
  479740.8479  0.0013 -2.6924 3  173.5960 53  71510 3032621 5      2520 6        syn-C2H3C(O)NH2, v=0
  479740.8479  0.0013 -2.6924 3  173.5960 53  71510 3032621 6      2520 5        syn-C2H3C(O)NH2, v=0
  479835.4684  0.0028 -5.6009 3  706.8384131  71510 303652936      642935        syn-C2H3C(O)NH2, v=0
  479835.4684  0.0028 -5.6009 3  706.8384131  71510 303652937      642936        syn-C2H3C(O)NH2, v=0
  479974.5969  0.0309 -4.5889 3 1148.5724195  71510 303971186      971087        syn-C2H3C(O)NH2, v=0
  479974.5969  0.0309 -4.5889 3 1148.5724195  71510 303971286      971187        syn-C2H3C(O)NH2, v=0
  479987.9170  0.0037 -4.1017 3  106.7988 61  71510 30330 625      29 326        syn-C2H3C(O)NH2, v=0
  480027.6469  0.0270 -4.4163 3  712.0832165  71510 30382 280      82 181        syn-C2H3C(O)NH2, v=0
  480027.6469  0.0270 -4.4163 3  712.0832165  71510 30382 380      82 281        syn-C2H3C(O)NH2, v=0
  480051.2564  0.0671 -5.8506 3 1934.2713229  71510 303B43876      B43777        syn-C2H3C(O)NH2, v=0
  480051.4336  0.0671 -5.8506 3 1934.2713229  71510 303B43877      B43778        syn-C2H3C(O)NH2, v=0
  480116.9459  0.0028 -4.8648 3  202.9678 75  71510 303371423      371126        syn-C2H3C(O)NH2, v=0
  480134.3109  0.0012 -2.7211 3  177.3426 57  71510 3032820 8      2719 9        syn-C2H3C(O)NH2, v=0
  480134.3109  0.0012 -2.7211 3  177.3426 57  71510 3032820 9      2719 8        syn-C2H3C(O)NH2, v=0
  480151.3249  0.0061 -3.9281 3  845.0382137  71510 303683533      683434        syn-C2H3C(O)NH2, v=0
  480151.3249  0.0061 -3.9281 3  845.0382137  71510 303683534      683435        syn-C2H3C(O)NH2, v=0
  480179.2827  0.0035 -3.9562 3  118.3921 63  71510 30331 725      30 426        syn-C2H3C(O)NH2, v=0
  480217.5860  0.0182 -4.6614 3 1291.5266181  71510 303903654      903555        syn-C2H3C(O)NH2, v=0
  480217.5860  0.0182 -4.6614 3 1291.5266181  71510 303903655      903556        syn-C2H3C(O)NH2, v=0
  480242.1092  0.0036 -4.7673 3   79.5125 51  71510 30325 817      24 520        syn-C2H3C(O)NH2, v=0
  480281.9537  0.0010 -2.8796 3  207.4720 73  71510 303361621      351520        syn-C2H3C(O)NH2, v=0
  480282.1154  0.0010 -2.8796 3  207.4720 73  71510 303361620      351521        syn-C2H3C(O)NH2, v=0
  480308.5468  0.0016 -5.1536 3  513.3103123  71510 303611546      601545        syn-C2H3C(O)NH2, v=0
  480418.7279  0.0023 -4.7648 3  222.1388 79  71510 303391426      391129        syn-C2H3C(O)NH2, v=0
  480464.7191  0.0011 -2.7529 3  182.5792 61  71510 303301911      291812        syn-C2H3C(O)NH2, v=0
  480464.7191  0.0011 -2.7529 3  182.5792 61  71510 303301912      291811        syn-C2H3C(O)NH2, v=0
  480502.5525  0.0027 -5.5652 3  693.7297131  71510 303652837      642836        syn-C2H3C(O)NH2, v=0
  480502.5525  0.0027 -5.5652 3  693.7297131  71510 303652838      642837        syn-C2H3C(O)NH2, v=0
  480587.3438  0.0059 -3.9043 3  828.3637135  71510 303673532      673433        syn-C2H3C(O)NH2, v=0
  480587.3438  0.0059 -3.9043 3  828.3637135  71510 303673533      673434        syn-C2H3C(O)NH2, v=0
  480674.1825  0.0010 -2.8304 3  197.6086 69  71510 303341718      331617        syn-C2H3C(O)NH2, v=0
  480674.1836  0.0010 -2.8304 3  197.6086 69  71510 303341717      331618        syn-C2H3C(O)NH2, v=0
  480676.8177  0.0010 -2.7888 3  189.3251 65  71510 303321814      311715        syn-C2H3C(O)NH2, v=0
  480676.8177  0.0010 -2.7888 3  189.3251 65  71510 303321815      311714        syn-C2H3C(O)NH2, v=0
  480690.4408  0.0018 -5.1639 3  517.4781123  71510 303611645      601644        syn-C2H3C(O)NH2, v=0
  480727.1594  0.0018 -5.2304 3  553.6103127  71510 303631747      621746        syn-C2H3C(O)NH2, v=0
  480743.7092  0.1197 -5.6761 3 1807.6962235  71510 303B72196      B72097        syn-C2H3C(O)NH2, v=0
  480743.7255  0.1197 -5.6761 3 1807.6962235  71510 303B72296      B72197        syn-C2H3C(O)NH2, v=0
  480761.3720  0.0020 -5.3380 3  600.7346129  71510 303642144      632143        syn-C2H3C(O)NH2, v=0
  480780.7682  0.0020 -5.3379 3  600.7353129  71510 303642143      632142        syn-C2H3C(O)NH2, v=0
  480857.0195  0.0026 -5.7792 3   91.2464 47  71510 303231310      231013        syn-C2H3C(O)NH2, v=0
  480865.0088  0.0026 -5.7792 3   91.2462 47  71510 303231311      231014        syn-C2H3C(O)NH2, v=0
  480881.1266  0.0035 -3.3875 3  372.9666105  71510 303521439      511338        syn-C2H3C(O)NH2, v=0
  480923.2680  0.0097 -4.6098 3  688.1304141  71510 303701951      701654        syn-C2H3C(O)NH2, v=0
  480979.2822  0.0372 -5.2577 3 1619.8743207  71510 303A33766      A33667        syn-C2H3C(O)NH2, v=0
  480979.2838  0.0372 -5.2577 3 1619.8743207  71510 303A33767      A33668        syn-C2H3C(O)NH2, v=0
  481004.7578  0.0057 -3.8815 3  811.9401133  71510 303663531      663432        syn-C2H3C(O)NH2, v=0
  481004.7578  0.0057 -3.8815 3  811.9401133  71510 303663532      663433        syn-C2H3C(O)NH2, v=0
  481010.4059  0.0031 -3.8499 3  130.1913 65  71510 30332 825      31 526        syn-C2H3C(O)NH2, v=0
  481075.5605  0.0350 -4.6749 3 1208.9539199  71510 303991287      991188        syn-C2H3C(O)NH2, v=0
  481075.5605  0.0350 -4.6749 3 1208.9539199  71510 303991387      991288        syn-C2H3C(O)NH2, v=0
  481169.5448  0.0043 -5.2768 3  627.2173153  71510 30376 373      75 372        syn-C2H3C(O)NH2, v=0
  481169.5448  0.0043 -3.1153 3  627.2173153  71510 30376 373      75 472        syn-C2H3C(O)NH2, v=0
  481169.5448  0.0043 -3.1153 3  627.2173153  71510 30376 473      75 372        syn-C2H3C(O)NH2, v=0
  481169.5448  0.0043 -5.2768 3  627.2173153  71510 30376 473      75 472        syn-C2H3C(O)NH2, v=0
  481170.9323  0.0041 -5.2804 3  625.1398151  71510 30375 471      74 470        syn-C2H3C(O)NH2, v=0
  481170.9323  0.0041 -3.1351 3  625.1398151  71510 30375 471      74 570        syn-C2H3C(O)NH2, v=0
  481170.9323  0.0041 -3.1351 3  625.1398151  71510 30375 571      74 470        syn-C2H3C(O)NH2, v=0
  481170.9323  0.0041 -5.2804 3  625.1398151  71510 30375 571      74 570        syn-C2H3C(O)NH2, v=0
  481176.4342  0.0049 -5.2721 3  628.7741155  71510 30377 275      76 274        syn-C2H3C(O)NH2, v=0
  481176.4342  0.0049 -3.0959 3  628.7741155  71510 30377 275      76 374        syn-C2H3C(O)NH2, v=0
  481176.4342  0.0049 -3.0959 3  628.7741155  71510 30377 375      76 274        syn-C2H3C(O)NH2, v=0
  481176.4342  0.0049 -5.2721 3  628.7741155  71510 30377 375      76 374        syn-C2H3C(O)NH2, v=0
  481182.7067  0.0173 -4.6211 3 1269.2799179  71510 303893653      893554        syn-C2H3C(O)NH2, v=0
  481182.7067  0.0173 -4.6211 3 1269.2799179  71510 303893654      893555        syn-C2H3C(O)NH2, v=0
  481186.3170  0.0039 -5.2829 3  622.5336149  71510 30374 569      73 568        syn-C2H3C(O)NH2, v=0
  481186.3170  0.0039 -3.1554 3  622.5336149  71510 30374 569      73 668        syn-C2H3C(O)NH2, v=0
  481186.3170  0.0039 -3.1554 3  622.5336149  71510 30374 669      73 568        syn-C2H3C(O)NH2, v=0
  481186.3170  0.0039 -5.2829 3  622.5336149  71510 30374 669      73 668        syn-C2H3C(O)NH2, v=0
  481187.3308  0.0060 -5.2665 3  629.8169157  71510 30378 177      77 176        syn-C2H3C(O)NH2, v=0
  481187.3308  0.0060 -3.0766 3  629.8169157  71510 30378 177      77 276        syn-C2H3C(O)NH2, v=0
  481187.3308  0.0060 -3.0766 3  629.8169157  71510 30378 277      77 176        syn-C2H3C(O)NH2, v=0
  481187.3308  0.0060 -5.2665 3  629.8169157  71510 30378 277      77 276        syn-C2H3C(O)NH2, v=0
  481199.0049  0.0076 -5.2599 3  630.3512159  71510 30379 079      78 078        syn-C2H3C(O)NH2, v=0
  481199.0049  0.0076 -3.0574 3  630.3512159  71510 30379 079      78 178        syn-C2H3C(O)NH2, v=0
  481199.0049  0.0076 -3.0574 3  630.3512159  71510 30379 179      78 078        syn-C2H3C(O)NH2, v=0
  481199.0049  0.0076 -5.2599 3  630.3512159  71510 30379 179      78 178        syn-C2H3C(O)NH2, v=0
  481223.4859  0.0038 -5.2844 3  619.3888147  71510 30373 667      72 666        syn-C2H3C(O)NH2, v=0
  481223.4859  0.0038 -3.1764 3  619.3888147  71510 30373 667      72 766        syn-C2H3C(O)NH2, v=0
  481223.4859  0.0038 -3.1764 3  619.3888147  71510 30373 767      72 666        syn-C2H3C(O)NH2, v=0
  481223.4859  0.0038 -5.2844 3  619.3888147  71510 30373 767      72 766        syn-C2H3C(O)NH2, v=0
  481234.2868  0.0023 -5.7089 3   44.9084 35  71510 3031710 8      16 7 9        syn-C2H3C(O)NH2, v=0
  481250.1511  0.0026 -5.5307 3  681.1297131  71510 303652738      642737        syn-C2H3C(O)NH2, v=0
  481250.1511  0.0026 -5.5307 3  681.1297131  71510 303652739      642738        syn-C2H3C(O)NH2, v=0
  481293.2492  0.0037 -5.2846 3  615.6933145  71510 30372 765      71 764        syn-C2H3C(O)NH2, v=0
  481293.2492  0.0037 -3.1984 3  615.6933145  71510 30372 765      71 864        syn-C2H3C(O)NH2, v=0
  481293.2492  0.0037 -3.1984 3  615.6933145  71510 30372 865      71 764        syn-C2H3C(O)NH2, v=0
  481293.2492  0.0037 -5.2846 3  615.6933145  71510 30372 865      71 864        syn-C2H3C(O)NH2, v=0
  481328.3423  0.0023 -5.7088 3   44.9052 35  71510 3031710 7      16 710        syn-C2H3C(O)NH2, v=0
  481404.1960  0.0056 -3.8595 3  795.7674131  71510 303653530      653431        syn-C2H3C(O)NH2, v=0
  481404.1960  0.0056 -3.8595 3  795.7674131  71510 303653531      653432        syn-C2H3C(O)NH2, v=0
  481410.9843  0.0035 -5.2837 3  611.4318143  71510 30371 863      70 862        syn-C2H3C(O)NH2, v=0
  481410.9843  0.0035 -3.2220 3  611.4318143  71510 30371 863      70 962        syn-C2H3C(O)NH2, v=0
  481410.9843  0.0035 -3.2220 3  611.4318143  71510 30371 963      70 862        syn-C2H3C(O)NH2, v=0
  481410.9843  0.0035 -5.2837 3  611.4318143  71510 30371 963      70 962        syn-C2H3C(O)NH2, v=0
  481540.6514  0.0234 -4.3039 3  849.4847175  71510 30387 582      87 483        syn-C2H3C(O)NH2, v=0
  481540.6514  0.0234 -4.3039 3  849.4847175  71510 30387 682      87 583        syn-C2H3C(O)NH2, v=0
  481583.4196  0.0246 -4.4040 3  995.0303185  71510 30392 884      92 785        syn-C2H3C(O)NH2, v=0
  481583.4196  0.0246 -4.4040 3  995.0303185  71510 30392 984      92 885        syn-C2H3C(O)NH2, v=0
  481599.2573  0.0033 -3.2476 3  606.5848141  71510 30370 961      691060        syn-C2H3C(O)NH2, v=0
  481599.2583  0.0033 -5.2815 3  606.5848141  71510 303701061      691060        syn-C2H3C(O)NH2, v=0
  481599.2592  0.0033 -5.2815 3  606.5848141  71510 30370 961      69 960        syn-C2H3C(O)NH2, v=0
  481599.2603  0.0033 -3.2476 3  606.5848141  71510 303701061      69 960        syn-C2H3C(O)NH2, v=0
  481772.0120  0.0020 -5.2037 3  538.4712125  71510 303621745      611744        syn-C2H3C(O)NH2, v=0
  481786.2678  0.0054 -3.8385 3  779.8452129  71510 303643529      643430        syn-C2H3C(O)NH2, v=0
  481786.2678  0.0054 -3.8385 3  779.8452129  71510 303643530      643431        syn-C2H3C(O)NH2, v=0
  481833.6762  0.1042 -5.5474 3 1736.3301231  71510 303B52095      B51996        syn-C2H3C(O)NH2, v=0
  481833.6808  0.1042 -5.5474 3 1736.3301231  71510 303B52195      B52096        syn-C2H3C(O)NH2, v=0
  481892.5361  0.0030 -3.2761 3  601.1267139  71510 303691059      681158        syn-C2H3C(O)NH2, v=0
  481892.5684  0.0030 -5.2778 3  601.1267139  71510 303691159      681158        syn-C2H3C(O)NH2, v=0
  481892.5961  0.0030 -5.2778 3  601.1267139  71510 303691059      681058        syn-C2H3C(O)NH2, v=0
  481892.6284  0.0030 -3.2761 3  601.1267139  71510 303691159      681058        syn-C2H3C(O)NH2, v=0
  481905.0189  0.0031 -4.5731 3  309.5377 95  71510 303471434      471137        syn-C2H3C(O)NH2, v=0
  481974.7271  0.0398 -4.7668 3 1270.5809203  71510 303A11388      A11289        syn-C2H3C(O)NH2, v=0
  481974.7271  0.0398 -4.7668 3 1270.5809203  71510 303A11488      A11389        syn-C2H3C(O)NH2, v=0
  481990.9859  0.0637 -5.7941 3 1905.8193227  71510 303B33875      B33776        syn-C2H3C(O)NH2, v=0
  481991.0826  0.0637 -5.7941 3 1905.8193227  71510 303B33876      B33777        syn-C2H3C(O)NH2, v=0
  482094.8001  0.0025 -5.4975 3  669.0454131  71510 303652640      642639        syn-C2H3C(O)NH2, v=0
  482094.8002  0.0025 -5.4975 3  669.0454131  71510 303652639      642638        syn-C2H3C(O)NH2, v=0
  482111.9214  0.0165 -4.5816 3 1247.2910177  71510 303883652      883553        syn-C2H3C(O)NH2, v=0
  482111.9214  0.0165 -4.5816 3 1247.2910177  71510 303883653      883554        syn-C2H3C(O)NH2, v=0
  482149.6879  0.0020 -5.2219 3  555.9951129  71510 303641450      631449        syn-C2H3C(O)NH2, v=0
  482151.5639  0.0053 -3.8185 3  764.1732127  71510 303633528      633429        syn-C2H3C(O)NH2, v=0
  482151.5639  0.0053 -3.8185 3  764.1732127  71510 303633529      633430        syn-C2H3C(O)NH2, v=0
  482192.5888  0.0026 -5.9006 3   85.5630 45  71510 3032213 9      221012        syn-C2H3C(O)NH2, v=0
  482195.8244  0.0026 -5.9006 3   85.5628 45  71510 303221310      221013        syn-C2H3C(O)NH2, v=0
  482246.8325  0.0012 -3.0367 3  242.3208 83  71510 303411428      401327        syn-C2H3C(O)NH2, v=0
  482317.8535  0.0055 -4.5775 3  513.3103121  71510 303601842      601545        syn-C2H3C(O)NH2, v=0
  482324.5708  0.0040 -5.9321 3   47.2092 41  71510 30320 714      19 217        syn-C2H3C(O)NH2, v=0
  482345.6446  0.0028 -3.3089 3  595.0226137  71510 303681157      671256        syn-C2H3C(O)NH2, v=0
  482346.4638  0.0028 -5.2724 3  595.0226137  71510 303681257      671256        syn-C2H3C(O)NH2, v=0
  482347.1187  0.0028 -5.2724 3  595.0225137  71510 303681157      671156        syn-C2H3C(O)NH2, v=0
  482347.9379  0.0028 -3.3089 3  595.0225137  71510 303681257      671156        syn-C2H3C(O)NH2, v=0
  482353.6211  0.0021 -3.4772 3  572.2407131  71510 303651451      641550        syn-C2H3C(O)NH2, v=0
  482379.6443  0.1840 -5.9918 3 1655.3628217  71510 303A83078      A73177        syn-C2H3C(O)NH2, v=0
  482403.6645  0.0354 -5.2087 3 1594.2844205  71510 303A23765      A23666        syn-C2H3C(O)NH2, v=0
  482403.6654  0.0354 -5.2087 3 1594.2844205  71510 303A23766      A23667        syn-C2H3C(O)NH2, v=0
  482500.6573  0.0052 -3.7994 3  748.7513125  71510 303623527      623428        syn-C2H3C(O)NH2, v=0
  482500.6573  0.0052 -3.7994 3  748.7513125  71510 303623528      623429        syn-C2H3C(O)NH2, v=0
  482547.4220  0.0020 -4.7671 3   76.7969 49  71510 30324 915      23 618        syn-C2H3C(O)NH2, v=0
  482625.3813  0.0906 -5.4228 3 1666.1579227  71510 303B31994      B31895        syn-C2H3C(O)NH2, v=0
  482625.3826  0.0906 -5.4228 3 1666.1579227  71510 303B32094      B31995        syn-C2H3C(O)NH2, v=0
  482664.2779  0.0454 -4.8642 3 1333.4475207  71510 303A31489      A31390        syn-C2H3C(O)NH2, v=0
  482664.2779  0.0454 -4.8642 3 1333.4475207  71510 303A31589      A31490        syn-C2H3C(O)NH2, v=0
  482692.8186  0.0260 -4.3419 3  762.8121169  71510 30384 381      84 282        syn-C2H3C(O)NH2, v=0
  482692.8186  0.0260 -4.3419 3  762.8121169  71510 30384 481      84 382        syn-C2H3C(O)NH2, v=0
  482834.1039  0.0050 -3.7814 3  733.5791123  71510 303613526      613427        syn-C2H3C(O)NH2, v=0
  482834.1039  0.0050 -3.7814 3  733.5791123  71510 303613527      613428        syn-C2H3C(O)NH2, v=0
  482913.5379  0.0020 -5.3111 3  591.9859129  71510 303642045      632044        syn-C2H3C(O)NH2, v=0
  482939.5952  0.0020 -5.2448 3  560.6838127  71510 303631845      621844        syn-C2H3C(O)NH2, v=0
  482958.9483  0.0923 -5.8241 3 1551.9669211  71510 303A52878      A42975        syn-C2H3C(O)NH2, v=0
  483006.5188  0.0157 -4.5427 3 1225.5593175  71510 303873651      873552        syn-C2H3C(O)NH2, v=0
  483006.5188  0.0157 -4.5427 3 1225.5593175  71510 303873652      873553        syn-C2H3C(O)NH2, v=0
  483037.3224  0.0026 -3.3481 3  588.2228135  71510 303671255      661354        syn-C2H3C(O)NH2, v=0
  483053.9235  0.0026 -5.2651 3  588.2228135  71510 303671355      661354        syn-C2H3C(O)NH2, v=0
  483058.1836  0.0025 -5.4655 3  657.4853131  71510 303652541      642540        syn-C2H3C(O)NH2, v=0
  483058.1860  0.0025 -5.4655 3  657.4853131  71510 303652540      642539        syn-C2H3C(O)NH2, v=0
  483066.1239  0.0026 -5.2651 3  588.2219135  71510 303671255      661254        syn-C2H3C(O)NH2, v=0
  483068.3750  0.0020 -5.3108 3  591.9926129  71510 303642044      632043        syn-C2H3C(O)NH2, v=0
  483082.7250  0.0026 -3.3480 3  588.2219135  71510 303671355      661254        syn-C2H3C(O)NH2, v=0
  483111.6793  0.0053 -6.0412 3  880.8903133  71510 303663927      653926        syn-C2H3C(O)NH2, v=0
  483111.6793  0.0053 -6.0412 3  880.8903133  71510 303663928      653927        syn-C2H3C(O)NH2, v=0
  483135.5277  0.0520 -4.9667 3 1397.5476211  71510 303A51590      A51491        syn-C2H3C(O)NH2, v=0
  483135.5277  0.0520 -4.9667 3 1397.5476211  71510 303A51690      A51591        syn-C2H3C(O)NH2, v=0
  483136.6931  0.0788 -5.3022 3 1597.1868223  71510 303B11893      B11794        syn-C2H3C(O)NH2, v=0
  483136.6934  0.0788 -5.3022 3 1597.1868223  71510 303B11993      B11894        syn-C2H3C(O)NH2, v=0
  483152.4437  0.0050 -3.7644 3  718.6563121  71510 303603525      603426        syn-C2H3C(O)NH2, v=0
  483152.4437  0.0050 -3.7644 3  718.6563121  71510 303603526      603427        syn-C2H3C(O)NH2, v=0
  483236.4366  0.0305 -4.6421 3  679.1083163  71510 30381 180      81 081        syn-C2H3C(O)NH2, v=0
  483236.4366  0.0305 -4.6421 3  679.1083163  71510 30381 280      81 181        syn-C2H3C(O)NH2, v=0
  483263.6744  0.0269 -4.4693 3 1052.2441189  71510 30394 985      94 886        syn-C2H3C(O)NH2, v=0
  483263.6744  0.0269 -4.4693 3 1052.2441189  71510 303941085      94 986        syn-C2H3C(O)NH2, v=0
  483294.3064  0.0011 -3.0351 3  242.2917 83  71510 303411427      401328        syn-C2H3C(O)NH2, v=0
  483350.1586  0.0027 -6.0337 3   80.1355 43  71510 3032113 8      211011        syn-C2H3C(O)NH2, v=0
  483351.4014  0.0027 -6.0337 3   80.1354 43  71510 3032113 9      211012        syn-C2H3C(O)NH2, v=0
  483378.7950  0.0597 -5.0740 3 1462.8750215  71510 303A71691      A71592        syn-C2H3C(O)NH2, v=0
  483378.7950  0.0597 -5.0740 3 1462.8750215  71510 303A71791      A71692        syn-C2H3C(O)NH2, v=0
  483383.2439  0.0685 -5.1859 3 1529.4236219  71510 303A91792      A91693        syn-C2H3C(O)NH2, v=0
  483383.2440  0.0685 -5.1859 3 1529.4236219  71510 303A91892      A91793        syn-C2H3C(O)NH2, v=0
  483412.2231  0.0050 -5.9915 3  862.9024133  71510 303663828      653827        syn-C2H3C(O)NH2, v=0
  483412.2231  0.0050 -5.9915 3  862.9024133  71510 303663829      653828        syn-C2H3C(O)NH2, v=0
  483456.2007  0.0049 -3.7485 3  703.9829119  71510 303593524      593425        syn-C2H3C(O)NH2, v=0
  483456.2007  0.0049 -3.7485 3  703.9829119  71510 303593525      593426        syn-C2H3C(O)NH2, v=0
  483733.1318  0.0047 -5.9434 3  845.3946133  71510 303663729      653728        syn-C2H3C(O)NH2, v=0
  483733.1318  0.0047 -5.9434 3  845.3946133  71510 303663730      653729        syn-C2H3C(O)NH2, v=0
  483737.1616  0.0239 -4.3338 3  903.4801179  71510 30389 683      89 584        syn-C2H3C(O)NH2, v=0
  483737.1616  0.0239 -4.3338 3  903.4801179  71510 30389 783      89 684        syn-C2H3C(O)NH2, v=0
  483745.8844  0.0048 -3.7338 3  689.5584117  71510 303583523      583424        syn-C2H3C(O)NH2, v=0
  483745.8844  0.0048 -3.7338 3  689.5584117  71510 303583524      583425        syn-C2H3C(O)NH2, v=0
  483775.6924  0.0336 -5.1603 3 1568.9571203  71510 303A13764      A13665        syn-C2H3C(O)NH2, v=0
  483775.6928  0.0336 -5.1603 3 1568.9571203  71510 303A13765      A13666        syn-C2H3C(O)NH2, v=0
  483856.7641  0.0604 -5.7384 3 1877.6353225  71510 303B23874      B23775        syn-C2H3C(O)NH2, v=0
  483856.8164  0.0604 -5.7384 3 1877.6353225  71510 303B23875      B23776        syn-C2H3C(O)NH2, v=0
  483867.7270  0.0149 -4.5046 3 1204.0846173  71510 303863650      863551        syn-C2H3C(O)NH2, v=0
  483867.7270  0.0149 -4.5046 3 1204.0846173  71510 303863651      863552        syn-C2H3C(O)NH2, v=0
  483879.6810  0.0023 -3.3986 3  580.6554133  71510 303661353      651452        syn-C2H3C(O)NH2, v=0
  483982.1427  0.0025 -3.4654 3  524.3061125  71510 303621548      611447        syn-C2H3C(O)NH2, v=0
  484021.9899  0.0048 -3.7203 3  675.3828115  71510 303573522      573423        syn-C2H3C(O)NH2, v=0
  484021.9899  0.0048 -3.7203 3  675.3828115  71510 303573523      573424        syn-C2H3C(O)NH2, v=0
  484077.0122  0.0044 -5.8969 3  828.3683133  71510 303663630      653629        syn-C2H3C(O)NH2, v=0
  484077.0122  0.0044 -5.8969 3  828.3683133  71510 303663631      653630        syn-C2H3C(O)NH2, v=0
  484143.0919  0.0023 -5.2553 3  580.6554133  71510 303661453      651452        syn-C2H3C(O)NH2, v=0
  484169.5560  0.0024 -5.4347 3  646.4607131  71510 303652442      642441        syn-C2H3C(O)NH2, v=0
  484169.5878  0.0024 -5.4347 3  646.4607131  71510 303652441      642440        syn-C2H3C(O)NH2, v=0
  484187.9042  0.0064 -5.8137 3  118.3921 61  71510 30330 921      30 426        syn-C2H3C(O)NH2, v=0
  484208.2884  0.0063 -6.0294 3  109.4271 63  71510 30331 427      31 130        syn-C2H3C(O)NH2, v=0
  484245.1623  0.0063 -6.0294 3  109.4271 63  71510 30331 527      31 230        syn-C2H3C(O)NH2, v=0
  484284.9986  0.0047 -3.7081 3  661.4557113  71510 303563521      563422        syn-C2H3C(O)NH2, v=0
  484284.9986  0.0047 -3.7081 3  661.4557113  71510 303563522      563423        syn-C2H3C(O)NH2, v=0
  484308.3256  0.1641 -5.9944 3 1983.1446245  71510 303C22399      C222A0        syn-C2H3C(O)NH2, v=0
  484308.4315  0.1641 -5.9944 3 1983.1446245  71510 303C22499      C223A0        syn-C2H3C(O)NH2, v=0
  484316.6286  0.0023 -5.2550 3  580.6408133  71510 303661353      651352        syn-C2H3C(O)NH2, v=0
  484419.5452  0.0023 -4.8085 3  212.2827 77  71510 303381425      381128        syn-C2H3C(O)NH2, v=0
  484446.8967  0.0041 -5.8518 3  811.8253133  71510 303663531      653530        syn-C2H3C(O)NH2, v=0
  484446.8967  0.0041 -5.8518 3  811.8253133  71510 303663532      653531        syn-C2H3C(O)NH2, v=0
  484535.3788  0.0047 -3.6972 3  647.7769111  71510 303553520      553421        syn-C2H3C(O)NH2, v=0
  484535.3788  0.0047 -3.6972 3  647.7769111  71510 303553521      553422        syn-C2H3C(O)NH2, v=0
  484580.0394  0.0023 -3.3973 3  580.6408133  71510 303661453      651352        syn-C2H3C(O)NH2, v=0
  484696.7179  0.0142 -4.4672 3 1182.8663171  71510 303853649      853550        syn-C2H3C(O)NH2, v=0
  484696.7179  0.0142 -4.4672 3 1182.8663171  71510 303853650      853551        syn-C2H3C(O)NH2, v=0
  484764.2048  0.0298 -4.5429 3 1110.7206193  71510 303961086      96 987        syn-C2H3C(O)NH2, v=0
  484764.2048  0.0298 -4.5429 3 1110.7206193  71510 303961186      961087        syn-C2H3C(O)NH2, v=0
  484773.5859  0.0047 -3.6877 3  634.3463109  71510 303543519      543420        syn-C2H3C(O)NH2, v=0
  484773.5859  0.0047 -3.6877 3  634.3463109  71510 303543520      543421        syn-C2H3C(O)NH2, v=0
  484791.4665  0.0023 -3.4630 3  540.0739127  71510 303631549      621448        syn-C2H3C(O)NH2, v=0
  484846.3349  0.0039 -5.8082 3  795.7674133  71510 303663432      653431        syn-C2H3C(O)NH2, v=0
  484846.3349  0.0039 -5.8082 3  795.7674133  71510 303663433      653432        syn-C2H3C(O)NH2, v=0
  484917.8638  0.0028 -3.4683 3  508.6850123  71510 303611547      601446        syn-C2H3C(O)NH2, v=0
  484972.4662  0.0084 -3.9181 3  678.0521141  71510 303701753      691852        syn-C2H3C(O)NH2, v=0
  484991.7176  0.0013 -3.1658 3  258.0118 87  71510 303431330      421231        syn-C2H3C(O)NH2, v=0
  485000.0633  0.0047 -3.6797 3  621.1636107  71510 303533518      533419        syn-C2H3C(O)NH2, v=0
  485000.0633  0.0047 -3.6797 3  621.1636107  71510 303533519      533420        syn-C2H3C(O)NH2, v=0
  485060.5486  0.1478 -6.0456 3 1682.7718219  71510 303A93080      A83177        syn-C2H3C(O)NH2, v=0
  485097.5227  0.0320 -5.1127 3 1543.8920201  71510 303A03763      A03664        syn-C2H3C(O)NH2, v=0
  485097.5229  0.0320 -5.1127 3 1543.8920201  71510 303A03764      A03665        syn-C2H3C(O)NH2, v=0
  485206.8474  0.0255 -4.3215 3  814.8360173  71510 30386 482      86 383        syn-C2H3C(O)NH2, v=0
  485206.8474  0.0255 -4.3215 3  814.8360173  71510 30386 582      86 483        syn-C2H3C(O)NH2, v=0
  485215.2424  0.0048 -3.6734 3  608.2286105  71510 303523517      523418        syn-C2H3C(O)NH2, v=0
  485215.2424  0.0048 -3.6734 3  608.2286105  71510 303523518      523419        syn-C2H3C(O)NH2, v=0
  485279.5110  0.0037 -5.7660 3  780.1968133  71510 303663333      653332        syn-C2H3C(O)NH2, v=0
  485279.5110  0.0037 -5.7660 3  780.1968133  71510 303663334      653333        syn-C2H3C(O)NH2, v=0
  485419.5434  0.0048 -3.6689 3  595.5410103  71510 303513516      513417        syn-C2H3C(O)NH2, v=0
  485419.5434  0.0048 -3.6689 3  595.5410103  71510 303513517      513418        syn-C2H3C(O)NH2, v=0
  485428.8171  0.0020 -5.2321 3  563.0470129  71510 303641649      631648        syn-C2H3C(O)NH2, v=0
  485445.1595  0.0020 -5.2851 3  583.8972129  71510 303641946      631945        syn-C2H3C(O)NH2, v=0
  485469.7699  0.0023 -5.4050 3  635.9860131  71510 303652343      642342        syn-C2H3C(O)NH2, v=0
  485470.1449  0.0023 -5.4050 3  635.9860131  71510 303652342      642341        syn-C2H3C(O)NH2, v=0
  485484.1011  0.0021 -5.2432 3  572.2407131  71510 303651551      641550        syn-C2H3C(O)NH2, v=0
  485494.6110  0.0136 -4.4305 3 1161.9042169  71510 303843648      843549        syn-C2H3C(O)NH2, v=0
  485494.6110  0.0136 -4.4305 3 1161.9042169  71510 303843649      843550        syn-C2H3C(O)NH2, v=0
  485613.3751  0.0049 -3.6662 3  583.1008101  71510 303503515      503416        syn-C2H3C(O)NH2, v=0
  485613.3751  0.0049 -3.6662 3  583.1008101  71510 303503516      503417        syn-C2H3C(O)NH2, v=0
  485652.2106  0.0574 -5.6834 3 1849.7185223  71510 303B13873      B13774        syn-C2H3C(O)NH2, v=0
  485652.2387  0.0574 -5.6834 3 1849.7185223  71510 303B13874      B13775        syn-C2H3C(O)NH2, v=0
  485751.3967  0.0036 -5.7252 3  765.1159133  71510 303663234      653233        syn-C2H3C(O)NH2, v=0
  485751.3967  0.0036 -5.7252 3  765.1159133  71510 303663235      653234        syn-C2H3C(O)NH2, v=0
  485770.1965  0.0250 -4.3788 3  958.7547183  71510 30391 784      91 685        syn-C2H3C(O)NH2, v=0
  485770.1965  0.0250 -4.3788 3  958.7547183  71510 30391 884      91 785        syn-C2H3C(O)NH2, v=0
  485797.1360  0.0049 -3.6657 3  570.9077 99  71510 303493514      493415        syn-C2H3C(O)NH2, v=0
  485797.1360  0.0049 -3.6657 3  570.9077 99  71510 303493515      493416        syn-C2H3C(O)NH2, v=0
  485854.4957  0.0018 -5.1709 3  529.3317125  71510 303621547      611546        syn-C2H3C(O)NH2, v=0
  485886.7931  0.0011 -2.9503 3  228.4420 79  71510 303391525      381424        syn-C2H3C(O)NH2, v=0
  485913.7975  0.0011 -2.9503 3  228.4412 79  71510 303391524      381425        syn-C2H3C(O)NH2, v=0
  485962.2751  0.1211 -5.9251 3 1616.6033215  71510 303A72979      A63076        syn-C2H3C(O)NH2, v=0
  485965.3798  0.1434 -5.8568 3 1908.8014241  71510 303C02298      C02199        syn-C2H3C(O)NH2, v=0
  485965.4116  0.1434 -5.8568 3 1908.8014241  71510 303C02398      C02299        syn-C2H3C(O)NH2, v=0
  485971.2138  0.0050 -3.6675 3  558.9615 97  71510 303483513      483414        syn-C2H3C(O)NH2, v=0
  485971.2138  0.0050 -3.6675 3  558.9615 97  71510 303483514      483415        syn-C2H3C(O)NH2, v=0
  486047.7764  0.0291 -4.4412 3  729.1402167  71510 30383 281      83 182        syn-C2H3C(O)NH2, v=0
  486047.7764  0.0291 -4.4412 3  729.1402167  71510 30383 381      83 282        syn-C2H3C(O)NH2, v=0
  486079.4188  0.0333 -4.6237 3 1170.4544197  71510 303981187      981088        syn-C2H3C(O)NH2, v=0
  486079.4188  0.0333 -4.6237 3 1170.4544197  71510 303981287      981188        syn-C2H3C(O)NH2, v=0
  486135.9862  0.0051 -3.6719 3  547.2620 95  71510 303473512      473413        syn-C2H3C(O)NH2, v=0
  486135.9862  0.0051 -3.6719 3  547.2620 95  71510 303473513      473414        syn-C2H3C(O)NH2, v=0
  486160.8153  0.0016 -2.6413 3  175.8742 47  71510 3032323 0      2222 1        syn-C2H3C(O)NH2, v=0
  486160.8153  0.0016 -2.6413 3  175.8742 47  71510 3032323 1      2222 0        syn-C2H3C(O)NH2, v=0
  486240.6457  0.0051 -5.0273 3  196.6188 79  71510 30339 831      39 534        syn-C2H3C(O)NH2, v=0
  486262.4770  0.0129 -4.3946 3 1141.1978167  71510 303833647      833548        syn-C2H3C(O)NH2, v=0
  486262.4770  0.0129 -4.3946 3 1141.1978167  71510 303833648      833549        syn-C2H3C(O)NH2, v=0
  486267.9520  0.0034 -5.6858 3  750.5277133  71510 303663135      653134        syn-C2H3C(O)NH2, v=0
  486267.9520  0.0034 -5.6858 3  750.5277133  71510 303663136      653135        syn-C2H3C(O)NH2, v=0
  486291.8212  0.0052 -3.6793 3  535.8091 93  71510 303463511      463412        syn-C2H3C(O)NH2, v=0
  486291.8212  0.0052 -3.6793 3  535.8091 93  71510 303463512      463413        syn-C2H3C(O)NH2, v=0
  486371.1824  0.0304 -5.0657 3 1519.0885199  71510 303993762      993663        syn-C2H3C(O)NH2, v=0
  486371.1825  0.0304 -5.0657 3 1519.0885199  71510 303993763      993664        syn-C2H3C(O)NH2, v=0
  486439.0770  0.0053 -3.6901 3  524.6025 91  71510 303453510      453411        syn-C2H3C(O)NH2, v=0
  486439.0770  0.0053 -3.6901 3  524.6025 91  71510 303453511      453412        syn-C2H3C(O)NH2, v=0
  486458.1088  0.0021 -5.2834 3  583.9482129  71510 303641945      631944        syn-C2H3C(O)NH2, v=0
  486470.2519  0.0029 -3.5953 3  595.6462133  71510 303661551      651650        syn-C2H3C(O)NH2, v=0
  486578.1024  0.0054 -3.7049 3  513.6421 89  71510 3034435 9      443410        syn-C2H3C(O)NH2, v=0
  486578.1024  0.0054 -3.7049 3  513.6421 89  71510 303443510      443411        syn-C2H3C(O)NH2, v=0
  486578.7480  0.0052 -4.8175 3  258.1812 89  71510 303441034      44 737        syn-C2H3C(O)NH2, v=0
  486595.2429  0.0014 -2.6662 3  177.1707 51  71510 3032522 3      2421 4        syn-C2H3C(O)NH2, v=0
  486595.2429  0.0014 -2.6662 3  177.1707 51  71510 3032522 4      2421 3        syn-C2H3C(O)NH2, v=0
  486709.2373  0.0055 -3.7244 3  502.9278 87  71510 3034335 8      4334 9        syn-C2H3C(O)NH2, v=0
  486709.2373  0.0055 -3.7244 3  502.9278 87  71510 3034335 9      433410        syn-C2H3C(O)NH2, v=0
  486832.8123  0.0057 -3.7497 3  492.4593 85  71510 3034235 7      4234 8        syn-C2H3C(O)NH2, v=0
  486832.8123  0.0057 -3.7497 3  492.4593 85  71510 3034235 8      4234 9        syn-C2H3C(O)NH2, v=0
  486836.3948  0.0033 -5.6477 3  736.4357133  71510 303663036      653035        syn-C2H3C(O)NH2, v=0
  486836.3948  0.0033 -5.6477 3  736.4357133  71510 303663037      653036        syn-C2H3C(O)NH2, v=0
  486949.1494  0.0058 -3.7821 3  482.2365 83  71510 3034135 6      4134 7        syn-C2H3C(O)NH2, v=0
  486949.1494  0.0058 -3.7821 3  482.2365 83  71510 3034135 7      4134 8        syn-C2H3C(O)NH2, v=0
  487001.3412  0.0124 -4.3594 3 1120.7467165  71510 303823646      823547        syn-C2H3C(O)NH2, v=0
  487001.3412  0.0124 -4.3594 3 1120.7467165  71510 303823647      823548        syn-C2H3C(O)NH2, v=0
  487012.6826  0.0013 -2.6929 3  179.9365 55  71510 3032721 6      2620 7        syn-C2H3C(O)NH2, v=0
  487012.6826  0.0013 -2.6929 3  179.9365 55  71510 3032721 7      2620 6        syn-C2H3C(O)NH2, v=0
  487017.7733  0.0023 -5.3764 3  626.0805131  71510 303652244      642243        syn-C2H3C(O)NH2, v=0
  487021.6532  0.0023 -5.3764 3  626.0806131  71510 303652243      642242        syn-C2H3C(O)NH2, v=0
  487030.1256  0.0022 -3.4618 3  555.9951129  71510 303641550      631449        syn-C2H3C(O)NH2, v=0
  487058.5620  0.0060 -3.8238 3  472.2592 81  71510 3034035 5      4034 6        syn-C2H3C(O)NH2, v=0
  487058.5620  0.0060 -3.8238 3  472.2592 81  71510 3034035 6      4034 7        syn-C2H3C(O)NH2, v=0
  487116.0998  0.0025 -6.0514 3   45.4621 39  71510 30319 812      18 315        syn-C2H3C(O)NH2, v=0
  487161.3550  0.0061 -3.8781 3  462.5273 79  71510 3033935 4      3934 5        syn-C2H3C(O)NH2, v=0
  487161.3550  0.0061 -3.8781 3  462.5273 79  71510 3033935 5      3934 6        syn-C2H3C(O)NH2, v=0
  487203.1701  0.0376 -4.7110 3 1231.4396201  71510 303A01288      A01189        syn-C2H3C(O)NH2, v=0
  487203.1701  0.0376 -4.7110 3 1231.4396201  71510 303A01388      A01289        syn-C2H3C(O)NH2, v=0
  487204.2772  0.0049 -5.2938 3  643.2674155  71510 30377 374      76 373        syn-C2H3C(O)NH2, v=0
  487204.2772  0.0049 -3.1317 3  643.2674155  71510 30377 374      76 473        syn-C2H3C(O)NH2, v=0
  487204.2772  0.0049 -3.1317 3  643.2674155  71510 30377 474      76 373        syn-C2H3C(O)NH2, v=0
  487204.2772  0.0049 -5.2938 3  643.2674155  71510 30377 474      76 473        syn-C2H3C(O)NH2, v=0
  487204.9082  0.0046 -5.2973 3  641.1900153  71510 30376 472      75 471        syn-C2H3C(O)NH2, v=0
  487204.9082  0.0046 -3.1511 3  641.1900153  71510 30376 472      75 571        syn-C2H3C(O)NH2, v=0
  487204.9082  0.0046 -3.1511 3  641.1900153  71510 30376 572      75 471        syn-C2H3C(O)NH2, v=0
  487204.9082  0.0046 -5.2973 3  641.1900153  71510 30376 572      75 571        syn-C2H3C(O)NH2, v=0
  487211.5513  0.0055 -5.2893 3  644.8244157  71510 30378 276      77 275        syn-C2H3C(O)NH2, v=0
  487211.5513  0.0055 -3.1126 3  644.8244157  71510 30378 276      77 375        syn-C2H3C(O)NH2, v=0
  487211.5513  0.0055 -3.1126 3  644.8244157  71510 30378 376      77 275        syn-C2H3C(O)NH2, v=0
  487211.5513  0.0055 -5.2893 3  644.8244157  71510 30378 376      77 375        syn-C2H3C(O)NH2, v=0
  487211.9802  0.0042 -3.8520 3  137.8065 67  71510 30333 726      32 627        syn-C2H3C(O)NH2, v=0
  487218.9431  0.0044 -5.2997 3  638.5843151  71510 30375 570      74 569        syn-C2H3C(O)NH2, v=0
  487218.9431  0.0044 -3.1709 3  638.5843151  71510 30375 570      74 669        syn-C2H3C(O)NH2, v=0
  487218.9431  0.0044 -3.1709 3  638.5843151  71510 30375 670      74 569        syn-C2H3C(O)NH2, v=0
  487218.9431  0.0044 -5.2997 3  638.5843151  71510 30375 670      74 669        syn-C2H3C(O)NH2, v=0
  487222.6073  0.0066 -5.2838 3  645.8675159  71510 30379 178      78 177        syn-C2H3C(O)NH2, v=0
  487222.6073  0.0066 -3.0936 3  645.8675159  71510 30379 178      78 277        syn-C2H3C(O)NH2, v=0
  487222.6073  0.0066 -3.0936 3  645.8675159  71510 30379 278      78 177        syn-C2H3C(O)NH2, v=0
  487222.6073  0.0066 -5.2838 3  645.8675159  71510 30379 278      78 277        syn-C2H3C(O)NH2, v=0
  487234.0588  0.0022 -5.2397 3  572.0779131  71510 303651451      641450        syn-C2H3C(O)NH2, v=0
  487234.3124  0.0083 -5.2773 3  646.4023161  71510 30380 080      79 079        syn-C2H3C(O)NH2, v=0
  487234.3124  0.0083 -3.0746 3  646.4023161  71510 30380 080      79 179        syn-C2H3C(O)NH2, v=0
  487234.3124  0.0083 -3.0746 3  646.4023161  71510 30380 180      79 079        syn-C2H3C(O)NH2, v=0
  487234.3124  0.0083 -5.2773 3  646.4023161  71510 30380 180      79 179        syn-C2H3C(O)NH2, v=0
  487253.8286  0.0043 -5.3011 3  635.4407149  71510 30374 668      73 667        syn-C2H3C(O)NH2, v=0
  487253.8286  0.0043 -3.1915 3  635.4407149  71510 30374 668      73 767        syn-C2H3C(O)NH2, v=0
  487253.8286  0.0043 -3.1915 3  635.4407149  71510 30374 768      73 667        syn-C2H3C(O)NH2, v=0
  487253.8286  0.0043 -5.3011 3  635.4407149  71510 30374 768      73 767        syn-C2H3C(O)NH2, v=0
  487257.8248  0.0063 -3.9504 3  453.0406 77  71510 3033835 3      3834 4        syn-C2H3C(O)NH2, v=0
  487257.8248  0.0063 -3.9504 3  453.0406 77  71510 3033835 4      3834 5        syn-C2H3C(O)NH2, v=0
  487260.9186  0.0010 -2.8866 3  216.3780 75  71510 303371622      361521        syn-C2H3C(O)NH2, v=0
  487261.3017  0.0010 -2.8866 3  216.3779 75  71510 303371621      361522        syn-C2H3C(O)NH2, v=0
  487272.1586  0.0023 -5.5653 3   49.1227 37  71510 3031810 9      17 710        syn-C2H3C(O)NH2, v=0
  487291.2130  0.1252 -5.7230 3 1835.6382237  71510 303B82197      B82098        syn-C2H3C(O)NH2, v=0
  487291.2222  0.1252 -5.7230 3 1835.6382237  71510 303B82297      B82198        syn-C2H3C(O)NH2, v=0
  487319.8421  0.0041 -5.3013 3  631.7475147  71510 30373 766      72 765        syn-C2H3C(O)NH2, v=0
  487319.8421  0.0041 -3.2130 3  631.7475147  71510 30373 766      72 865        syn-C2H3C(O)NH2, v=0
  487319.8421  0.0041 -3.2130 3  631.7475147  71510 30373 866      72 765        syn-C2H3C(O)NH2, v=0
  487319.8421  0.0041 -5.3013 3  631.7475147  71510 30373 866      72 865        syn-C2H3C(O)NH2, v=0
  487348.2597  0.0064 -4.0511 3  443.7990 75  71510 3033735 2      3734 3        syn-C2H3C(O)NH2, v=0
  487348.2597  0.0064 -4.0511 3  443.7990 75  71510 3033735 3      3734 4        syn-C2H3C(O)NH2, v=0
  487380.6695  0.0545 -5.6291 3 1822.0680221  71510 303B03872      B03773        syn-C2H3C(O)NH2, v=0
  487380.6844  0.0545 -5.6291 3 1822.0680221  71510 303B03873      B03774        syn-C2H3C(O)NH2, v=0
  487391.8068  0.0012 -2.7222 3  184.1822 59  71510 3032920 9      281910        syn-C2H3C(O)NH2, v=0
  487391.8068  0.0012 -2.7222 3  184.1822 59  71510 303292010      2819 9        syn-C2H3C(O)NH2, v=0
  487431.5032  0.0039 -3.2358 3  627.4899145  71510 30372 864      71 963        syn-C2H3C(O)NH2, v=0
  487431.5032  0.0039 -5.3003 3  627.4899145  71510 30372 964      71 963        syn-C2H3C(O)NH2, v=0
  487431.5033  0.0039 -5.3003 3  627.4899145  71510 30372 864      71 863        syn-C2H3C(O)NH2, v=0
  487431.5033  0.0039 -3.2358 3  627.4899145  71510 30372 964      71 863        syn-C2H3C(O)NH2, v=0
  487432.9401  0.0066 -4.2031 3  434.8023 73  71510 3033635 1      3634 2        syn-C2H3C(O)NH2, v=0
  487432.9401  0.0066 -4.2031 3  434.8023 73  71510 3033635 2      3634 3        syn-C2H3C(O)NH2, v=0
  487465.5708  0.0032 -5.6109 3  722.8440133  71510 303662937      652936        syn-C2H3C(O)NH2, v=0
  487465.5708  0.0032 -5.6109 3  722.8440133  71510 303662938      652937        syn-C2H3C(O)NH2, v=0
  487486.5818  0.0023 -3.7953 3  142.1279 67  71510 30333 925      32 626        syn-C2H3C(O)NH2, v=0
  487489.7624  0.0023 -5.5650 3   49.1154 37  71510 3031810 8      17 711        syn-C2H3C(O)NH2, v=0
  487512.1382  0.0068 -4.4804 3  426.0505 71  71510 3033535 0      3534 1        syn-C2H3C(O)NH2, v=0
  487512.1382  0.0068 -4.4804 3  426.0505 71  71510 3033535 1      3534 2        syn-C2H3C(O)NH2, v=0
  487566.6110  0.0255 -4.3321 3  868.1497177  71510 30388 583      88 484        syn-C2H3C(O)NH2, v=0
  487566.6110  0.0255 -4.3321 3  868.1497177  71510 30388 683      88 584        syn-C2H3C(O)NH2, v=0
  487569.4576  0.0026 -4.9113 3  193.5227 73  71510 303361422      361125        syn-C2H3C(O)NH2, v=0
  487598.5791  0.0289 -5.0195 3 1494.5460197  71510 303983761      983662        syn-C2H3C(O)NH2, v=0
  487598.5792  0.0289 -5.0195 3 1494.5460197  71510 303983762      983663        syn-C2H3C(O)NH2, v=0
  487609.9433  0.0037 -3.2606 3  622.6492143  71510 30371 962      701061        syn-C2H3C(O)NH2, v=0
  487609.9439  0.0037 -5.2980 3  622.6492143  71510 303711062      701061        syn-C2H3C(O)NH2, v=0
  487609.9444  0.0037 -5.2980 3  622.6492143  71510 30371 962      70 961        syn-C2H3C(O)NH2, v=0
  487609.9449  0.0037 -3.2606 3  622.6492143  71510 303711062      70 961        syn-C2H3C(O)NH2, v=0
  487635.6292  0.0268 -4.4356 3 1015.3031187  71510 30393 885      93 786        syn-C2H3C(O)NH2, v=0
  487635.6292  0.0268 -4.4356 3 1015.3031187  71510 30393 985      93 886        syn-C2H3C(O)NH2, v=0
  487696.1186  0.0011 -2.7549 3  189.9227 63  71510 303311912      301813        syn-C2H3C(O)NH2, v=0
  487696.1186  0.0011 -2.7549 3  189.9227 63  71510 303311913      301812        syn-C2H3C(O)NH2, v=0
  487712.1862  0.0118 -4.3249 3 1100.5506163  71510 303813645      813546        syn-C2H3C(O)NH2, v=0
  487712.1862  0.0118 -4.3249 3 1100.5506163  71510 303813646      813547        syn-C2H3C(O)NH2, v=0
  487780.3058  0.0020 -5.2614 3  576.4857129  71510 303641847      631846        syn-C2H3C(O)NH2, v=0
  487784.2780  0.0010 -2.8352 3  205.9819 71  71510 303351719      341618        syn-C2H3C(O)NH2, v=0
  487784.2810  0.0010 -2.8352 3  205.9819 71  71510 303351718      341619        syn-C2H3C(O)NH2, v=0
  487806.3336  0.0032 -3.4704 3  493.2085121  71510 303601546      591445        syn-C2H3C(O)NH2, v=0
  487816.4100  0.0039 -4.6881 3  275.1467 91  71510 303451234      45 937        syn-C2H3C(O)NH2, v=0
  487849.3100  0.0042 -4.6463 3  346.3672 99  71510 303491633      491336        syn-C2H3C(O)NH2, v=0
  487863.2071  0.0010 -2.7921 3  197.1790 67  71510 303331815      321716        syn-C2H3C(O)NH2, v=0
  487863.2071  0.0010 -2.7921 3  197.1790 67  71510 303331816      321715        syn-C2H3C(O)NH2, v=0
  487887.1140  0.0034 -3.2881 3  617.2009141  71510 303701060      691159        syn-C2H3C(O)NH2, v=0
  487887.1313  0.0034 -5.2942 3  617.2009141  71510 303701160      691159        syn-C2H3C(O)NH2, v=0
  487887.1463  0.0034 -5.2942 3  617.2009141  71510 303701060      691059        syn-C2H3C(O)NH2, v=0
  487887.1636  0.0034 -3.2881 3  617.2009141  71510 303701160      691059        syn-C2H3C(O)NH2, v=0
  487911.8307  0.0012 -3.0550 3  252.6551 85  71510 303421429      411328        syn-C2H3C(O)NH2, v=0
  488074.8055  0.0041 -4.7756 3  247.7485 87  71510 303431133      43 836        syn-C2H3C(O)NH2, v=0
  488128.6851  0.0426 -4.8041 3 1293.6707205  71510 303A21389      A21290        syn-C2H3C(O)NH2, v=0
  488128.6851  0.0426 -4.8041 3 1293.6707205  71510 303A21489      A21390        syn-C2H3C(O)NH2, v=0
  488166.4702  0.0030 -5.5755 3  709.7576133  71510 303662838      652837        syn-C2H3C(O)NH2, v=0
  488166.4702  0.0030 -5.5755 3  709.7576133  71510 303662839      652838        syn-C2H3C(O)NH2, v=0
  488201.0582  0.0033 -3.3589 3  359.5256103  71510 303511438      501337        syn-C2H3C(O)NH2, v=0
  488305.0794  0.0020 -5.2428 3  569.6457129  71510 303641748      631747        syn-C2H3C(O)NH2, v=0
  488308.0900  0.1093 -5.5932 3 1763.6628233  71510 303B62096      B61997        syn-C2H3C(O)NH2, v=0
  488308.0926  0.1093 -5.5932 3 1763.6628233  71510 303B62196      B62097        syn-C2H3C(O)NH2, v=0
  488313.4537  0.0031 -3.3194 3  611.1119139  71510 303691158      681257        syn-C2H3C(O)NH2, v=0
  488313.9067  0.0031 -5.2889 3  611.1119139  71510 303691258      681257        syn-C2H3C(O)NH2, v=0
  488314.2729  0.0031 -5.2889 3  611.1119139  71510 303691158      681157        syn-C2H3C(O)NH2, v=0
  488314.7259  0.0031 -3.3194 3  611.1119139  71510 303691258      681157        syn-C2H3C(O)NH2, v=0
  488354.0161  0.0076 -4.6450 3  731.2627145  71510 303722052      721755        syn-C2H3C(O)NH2, v=0
  488395.9548  0.0113 -4.2911 3 1080.6091161  71510 303803644      803545        syn-C2H3C(O)NH2, v=0
  488395.9548  0.0113 -4.2911 3 1080.6091161  71510 303803645      803546        syn-C2H3C(O)NH2, v=0
  488447.0454  0.0059 -5.6619 3  129.3083 67  71510 30333 528      33 231        syn-C2H3C(O)NH2, v=0
  488462.3584  0.0034 -3.4462 3  227.6586 83  71510 303411130      401031        syn-C2H3C(O)NH2, v=0
  488557.7135  0.0060 -4.5993 3  600.4030131  71510 303651946      651649        syn-C2H3C(O)NH2, v=0
  488584.9251  0.0023 -4.8553 3  202.6850 75  71510 303371424      371127        syn-C2H3C(O)NH2, v=0
  488604.7906  0.0059 -5.6617 3  129.3083 67  71510 30333 628      33 331        syn-C2H3C(O)NH2, v=0
  488626.0449  0.1416 -5.3518 3 1326.0002195  71510 303972671      962770        syn-C2H3C(O)NH2, v=0
  488712.5672  0.0282 -4.3681 3  780.4722171  71510 30385 382      85 283        syn-C2H3C(O)NH2, v=0
  488712.5672  0.0282 -4.3681 3  780.4722171  71510 30385 482      85 383        syn-C2H3C(O)NH2, v=0
  488781.5120  0.0275 -4.9739 3 1470.2640195  71510 303973760      973661        syn-C2H3C(O)NH2, v=0
  488781.5121  0.0275 -4.9739 3 1470.2640195  71510 303973761      973662        syn-C2H3C(O)NH2, v=0
  488848.4781  0.0485 -4.9028 3 1357.1416209  71510 303A41490      A41391        syn-C2H3C(O)NH2, v=0
  488848.4781  0.0485 -4.9028 3 1357.1416209  71510 303A41590      A41491        syn-C2H3C(O)NH2, v=0
  488896.9975  0.0023 -5.3487 3  616.7710131  71510 303652145      642144        syn-C2H3C(O)NH2, v=0
  488931.7120  0.0023 -5.3487 3  616.7724131  71510 303652144      642143        syn-C2H3C(O)NH2, v=0
  488952.9732  0.0029 -5.5413 3  697.1825133  71510 303662739      652738        syn-C2H3C(O)NH2, v=0
  488952.9732  0.0029 -5.5413 3  697.1825133  71510 303662740      652739        syn-C2H3C(O)NH2, v=0
  488965.5349  0.0029 -3.3566 3  604.3358137  71510 303681256      671355        syn-C2H3C(O)NH2, v=0
  488975.0425  0.0029 -5.2816 3  604.3358137  71510 303681356      671355        syn-C2H3C(O)NH2, v=0
  488982.1360  0.0029 -5.2816 3  604.3352137  71510 303681256      671255        syn-C2H3C(O)NH2, v=0
  488991.6436  0.0029 -3.3566 3  604.3352137  71510 303681356      671255        syn-C2H3C(O)NH2, v=0
  489035.2774  0.0953 -5.4673 3 1692.8823229  71510 303B41995      B41896        syn-C2H3C(O)NH2, v=0
  489035.2781  0.0953 -5.4673 3 1692.8823229  71510 303B42095      B41996        syn-C2H3C(O)NH2, v=0
  489045.2389  0.0519 -5.5755 3 1794.6832219  71510 303A93871      A93772        syn-C2H3C(O)NH2, v=0
  489045.2468  0.0519 -5.5755 3 1794.6832219  71510 303A93872      A93773        syn-C2H3C(O)NH2, v=0
  489053.5527  0.0108 -4.2581 3 1060.9219159  71510 303793643      793544        syn-C2H3C(O)NH2, v=0
  489053.5527  0.0108 -4.2581 3 1060.9219159  71510 303793644      793545        syn-C2H3C(O)NH2, v=0
  489248.2590  0.1593 -5.5139 3 1411.2136201  71510 303A02773      992872        syn-C2H3C(O)NH2, v=0
  489257.9532  0.0327 -4.6662 3  695.7633165  71510 30382 181      82 082        syn-C2H3C(O)NH2, v=0
  489257.9532  0.0327 -4.6662 3  695.7633165  71510 30382 281      82 182        syn-C2H3C(O)NH2, v=0
  489328.9590  0.0292 -4.5022 3 1073.1199191  71510 30395 986      95 887        syn-C2H3C(O)NH2, v=0
  489328.9590  0.0292 -4.5022 3 1073.1199191  71510 303951086      95 987        syn-C2H3C(O)NH2, v=0
  489354.2507  0.0553 -5.0065 3 1421.8466213  71510 303A61591      A61492        syn-C2H3C(O)NH2, v=0
  489354.2507  0.0553 -5.0065 3 1421.8466213  71510 303A61691      A61592        syn-C2H3C(O)NH2, v=0
  489359.2337  0.1230 -5.1911 3 1243.4331189  71510 303942569      932668        syn-C2H3C(O)NH2, v=0
  489388.4533  0.0024 -3.4731 3  588.4347133  71510 303661452      651551        syn-C2H3C(O)NH2, v=0
  489450.6427  0.0042 -3.5706 3  203.3679 79  71510 303391029      38 930        syn-C2H3C(O)NH2, v=0
  489459.5240  0.0033 -4.5762 3  321.4369 97  71510 303481435      481138        syn-C2H3C(O)NH2, v=0
  489471.8286  0.0043 -5.0248 3   79.1203 57  71510 30328 226      27 127        syn-C2H3C(O)NH2, v=0
  489472.3803  0.0043 -5.0248 3   79.1203 57  71510 30328 326      27 027        syn-C2H3C(O)NH2, v=0
  489483.0706  0.0904 -5.8820 3 1578.8494213  71510 303A62879      A52976        syn-C2H3C(O)NH2, v=0
  489489.5756  0.0831 -5.3456 3 1623.3037225  71510 303B21894      B21795        syn-C2H3C(O)NH2, v=0
  489489.5758  0.0831 -5.3456 3 1623.3037225  71510 303B21994      B21895        syn-C2H3C(O)NH2, v=0
  489636.7717  0.0633 -5.1150 3 1487.7794217  71510 303A81692      A81593        syn-C2H3C(O)NH2, v=0
  489636.7717  0.0633 -5.1150 3 1487.7794217  71510 303A81792      A81693        syn-C2H3C(O)NH2, v=0
  489685.7329  0.0725 -5.2281 3 1554.9339221  71510 303B01793      B01694        syn-C2H3C(O)NH2, v=0
  489685.7330  0.0725 -5.2281 3 1554.9339221  71510 303B01893      B01794        syn-C2H3C(O)NH2, v=0
  489685.8501  0.0104 -4.2258 3 1041.4887157  71510 303783642      783543        syn-C2H3C(O)NH2, v=0
  489685.8501  0.0104 -4.2258 3 1041.4887157  71510 303783643      783544        syn-C2H3C(O)NH2, v=0
  489768.7256  0.0260 -4.3633 3  922.7479181  71510 30390 684      90 585        syn-C2H3C(O)NH2, v=0
  489768.7256  0.0260 -4.3633 3  922.7479181  71510 30390 784      90 685        syn-C2H3C(O)NH2, v=0
  489789.0403  0.0012 -3.0523 3  252.6035 85  71510 303421428      411329        syn-C2H3C(O)NH2, v=0
  489815.7196  0.0043 -4.8857 3  221.5676 83  71510 303411032      41 735        syn-C2H3C(O)NH2, v=0
  489840.8506  0.0026 -3.4037 3  596.8047135  71510 303671354      661453        syn-C2H3C(O)NH2, v=0
  489842.9594  0.0028 -5.5083 3  685.1263133  71510 303662641      652640        syn-C2H3C(O)NH2, v=0
  489842.9598  0.0028 -5.5083 3  685.1263133  71510 303662640      652639        syn-C2H3C(O)NH2, v=0
  489876.8773  0.0019 -5.1726 3  533.5122125  71510 303621646      611645        syn-C2H3C(O)NH2, v=0
  489921.6803  0.0262 -4.9291 3 1446.2420193  71510 303963759      963660        syn-C2H3C(O)NH2, v=0
  489921.6804  0.0262 -4.9291 3 1446.2420193  71510 303963760      963661        syn-C2H3C(O)NH2, v=0
  489998.2685  0.0026 -5.2720 3  596.8047135  71510 303671454      661453        syn-C2H3C(O)NH2, v=0
  490043.7870  0.0067 -4.6403 3  712.6769143  71510 303712051      711754        syn-C2H3C(O)NH2, v=0
  490104.2614  0.0026 -5.2718 3  596.7959135  71510 303671354      661353        syn-C2H3C(O)NH2, v=0
  490173.9448  0.0033 -4.7305 3  269.6652 87  71510 303431528      431231        syn-C2H3C(O)NH2, v=0
  490261.6794  0.0026 -3.4029 3  596.7959135  71510 303671454      661353        syn-C2H3C(O)NH2, v=0
  490293.6848  0.0099 -4.1943 3 1022.3091155  71510 303773641      773542        syn-C2H3C(O)NH2, v=0
  490293.6848  0.0099 -4.1943 3 1022.3091155  71510 303773642      773543        syn-C2H3C(O)NH2, v=0
  490316.8552  0.0052 -5.1890 3  172.9171 75  71510 30337 730      37 433        syn-C2H3C(O)NH2, v=0
  490364.5388  0.0023 -3.4619 3  572.0779131  71510 303651551      641450        syn-C2H3C(O)NH2, v=0
  490414.5057  0.0027 -5.6499 3  126.5828 61  71510 303301119      30 624        syn-C2H3C(O)NH2, v=0
  490554.0609  0.0057 -6.0483 3  897.0052135  71510 303673928      663927        syn-C2H3C(O)NH2, v=0
  490554.0609  0.0057 -6.0483 3  897.0052135  71510 303673929      663928        syn-C2H3C(O)NH2, v=0
  490648.7974  0.0493 -5.5226 3 1767.5634217  71510 303A83870      A83771        syn-C2H3C(O)NH2, v=0
  490648.8015  0.0493 -5.5226 3 1767.5634217  71510 303A83871      A83772        syn-C2H3C(O)NH2, v=0
  490683.0246  0.0055 -5.3945 3  150.4759 71  71510 30335 629      35 332        syn-C2H3C(O)NH2, v=0
  490686.0167  0.0020 -5.1903 3  545.5380127  71510 303631548      621547        syn-C2H3C(O)NH2, v=0
  490845.2680  0.0322 -4.5770 3 1132.1995195  71510 303971087      97 988        syn-C2H3C(O)NH2, v=0
  490845.2680  0.0322 -4.5770 3 1132.1995195  71510 303971187      971088        syn-C2H3C(O)NH2, v=0
  490860.0247  0.0028 -5.4765 3  673.5984133  71510 303662542      652541        syn-C2H3C(O)NH2, v=0
  490860.0297  0.0028 -5.4765 3  673.5984133  71510 303662541      652540        syn-C2H3C(O)NH2, v=0
  490862.6013  0.0038 -4.6241 3  303.7472 95  71510 303471335      471038        syn-C2H3C(O)NH2, v=0
  490867.3697  0.0054 -5.9992 3  879.0273135  71510 303673829      663828        syn-C2H3C(O)NH2, v=0
  490867.3697  0.0054 -5.9992 3  879.0273135  71510 303673830      663829        syn-C2H3C(O)NH2, v=0
  490877.8631  0.0096 -4.1636 3 1003.3827153  71510 303763640      763541        syn-C2H3C(O)NH2, v=0
  490877.8631  0.0096 -4.1636 3 1003.3827153  71510 303763641      763542        syn-C2H3C(O)NH2, v=0
  490979.4863  0.0048 -3.7378 3  636.2359137  71510 303681652      671751        syn-C2H3C(O)NH2, v=0
  490999.4577  0.1709 -6.0441 3 2012.5043247  71510 303C323A0      C322A1        syn-C2H3C(O)NH2, v=0
  490999.5187  0.1709 -6.0441 3 2012.5043247  71510 303C324A0      C323A1        syn-C2H3C(O)NH2, v=0
  491020.6915  0.0249 -4.8849 3 1422.4796191  71510 303953758      953659        syn-C2H3C(O)NH2, v=0
  491020.6915  0.0249 -4.8849 3 1422.4796191  71510 303953759      953660        syn-C2H3C(O)NH2, v=0
  491191.8483  0.0023 -5.3219 3  608.0941131  71510 303652046      642045        syn-C2H3C(O)NH2, v=0
  491198.4885  0.1035 -5.0309 3 1163.5126183  71510 303912467      902566        syn-C2H3C(O)NH2, v=0
  491202.1033  0.0051 -5.9516 3  861.5302135  71510 303673730      663729        syn-C2H3C(O)NH2, v=0
  491202.1033  0.0051 -5.9516 3  861.5302135  71510 303673731      663730        syn-C2H3C(O)NH2, v=0
  491228.0016  0.0277 -4.3491 3  833.0991175  71510 30387 483      87 384        syn-C2H3C(O)NH2, v=0
  491228.0016  0.0277 -4.3491 3  833.0991175  71510 30387 583      87 484        syn-C2H3C(O)NH2, v=0
  491262.9828  0.0054 -5.3937 3  150.4759 71  71510 30335 729      35 432        syn-C2H3C(O)NH2, v=0
  491280.5254  0.1767 -5.6785 3 1499.0726207  71510 303A32875      A22974        syn-C2H3C(O)NH2, v=0
  491368.6927  0.0024 -5.2599 3  588.4347133  71510 303661552      651551        syn-C2H3C(O)NH2, v=0
  491386.0904  0.0029 -5.7738 3  119.0762 59  71510 303291118      29 623        syn-C2H3C(O)NH2, v=0
  491439.1625  0.0092 -4.1336 3  984.7094151  71510 303753639      753540        syn-C2H3C(O)NH2, v=0
  491439.1625  0.0092 -4.1336 3  984.7094151  71510 303753640      753541        syn-C2H3C(O)NH2, v=0
  491454.3115  0.0023 -5.3215 3  608.1061131  71510 303652045      642044        syn-C2H3C(O)NH2, v=0
  491525.0522  0.0046 -5.0207 3  196.6190 79  71510 30339 931      39 634        syn-C2H3C(O)NH2, v=0
  491561.0117  0.0048 -5.9055 3  844.5154135  71510 303673631      663630        syn-C2H3C(O)NH2, v=0
  491561.0117  0.0048 -5.9055 3  844.5154135  71510 303673632      663631        syn-C2H3C(O)NH2, v=0
  491805.6633  0.0021 -4.6998 3   82.7294 51  71510 30325 916      24 619        syn-C2H3C(O)NH2, v=0
  491809.5182  0.0272 -4.4096 3  978.6253185  71510 30392 785      92 686        syn-C2H3C(O)NH2, v=0
  491809.5182  0.0272 -4.4096 3  978.6253185  71510 30392 885      92 786        syn-C2H3C(O)NH2, v=0
  491871.6384  0.0022 -5.2476 3  579.2392131  71510 303651650      641649        syn-C2H3C(O)NH2, v=0
  491947.2965  0.0045 -5.8609 3  827.9847135  71510 303673532      663531        syn-C2H3C(O)NH2, v=0
  491947.2965  0.0045 -5.8609 3  827.9847135  71510 303673533      663532        syn-C2H3C(O)NH2, v=0
  491978.3328  0.0088 -4.1044 3  966.2887149  71510 303743638      743539        syn-C2H3C(O)NH2, v=0
  491978.3328  0.0088 -4.1044 3  966.2887149  71510 303743639      743540        syn-C2H3C(O)NH2, v=0
  492036.2595  0.0027 -5.4459 3  662.6109133  71510 303662443      652442        syn-C2H3C(O)NH2, v=0
  492036.3238  0.0027 -5.4459 3  662.6109133  71510 303662442      652441        syn-C2H3C(O)NH2, v=0
  492067.0766  0.0314 -4.4666 3  746.3985169  71510 30384 282      84 183        syn-C2H3C(O)NH2, v=0
  492067.0766  0.0314 -4.4666 3  746.3985169  71510 30384 382      84 283        syn-C2H3C(O)NH2, v=0
  492080.0685  0.0238 -4.8415 3 1398.9763189  71510 303943757      943658        syn-C2H3C(O)NH2, v=0
  492080.0685  0.0238 -4.8415 3 1398.9763189  71510 303943758      943659        syn-C2H3C(O)NH2, v=0
  492151.6534  0.0028 -5.5556 3  134.2652 63  71510 303311120      31 625        syn-C2H3C(O)NH2, v=0
  492179.1712  0.0359 -4.6591 3 1192.5366199  71510 303991188      991089        syn-C2H3C(O)NH2, v=0
  492179.1712  0.0359 -4.6591 3 1192.5366199  71510 303991288      991189        syn-C2H3C(O)NH2, v=0
  492182.5140  0.0050 -5.1865 3  172.9172 75  71510 30337 830      37 533        syn-C2H3C(O)NH2, v=0
  492194.0258  0.0469 -5.4704 3 1740.7080215  71510 303A73869      A73770        syn-C2H3C(O)NH2, v=0
  492194.0279  0.0469 -5.4704 3 1740.7080215  71510 303A73870      A73771        syn-C2H3C(O)NH2, v=0
  492256.2665  0.0022 -5.2101 3  554.5414127  71510 303631746      621745        syn-C2H3C(O)NH2, v=0
  492338.1015  0.0140 -4.0654 3  739.4950147  71510 303731855      721954        syn-C2H3C(O)NH2, v=0
  492357.3814  0.0046 -3.6781 3  180.3007 75  71510 30337 928      36 829        syn-C2H3C(O)NH2, v=0
  492364.7105  0.0043 -5.8176 3  811.9401135  71510 303673433      663432        syn-C2H3C(O)NH2, v=0
  492364.7105  0.0043 -5.8176 3  811.9401135  71510 303673434      663433        syn-C2H3C(O)NH2, v=0
  492496.0978  0.0085 -4.0760 3  948.1204147  71510 303733637      733538        syn-C2H3C(O)NH2, v=0
  492496.0978  0.0085 -4.0760 3  948.1204147  71510 303733638      733539        syn-C2H3C(O)NH2, v=0
  492518.9333  0.0024 -5.2576 3  588.3302133  71510 303661452      651451        syn-C2H3C(O)NH2, v=0
  492540.1542  0.0011 -2.9617 3  238.1654 81  71510 303401526      391425        syn-C2H3C(O)NH2, v=0
  492567.0043  0.1497 -5.9054 3 1937.5500243  71510 303C12299      C121A0        syn-C2H3C(O)NH2, v=0
  492567.0224  0.1497 -5.9054 3 1937.5500243  71510 303C12399      C122A0        syn-C2H3C(O)NH2, v=0
  492594.9741  0.0011 -2.9616 3  238.1639 81  71510 303401525      391426        syn-C2H3C(O)NH2, v=0
  492627.5151  0.0045 -3.7654 3  158.4459 71  71510 30335 827      34 728        syn-C2H3C(O)NH2, v=0
  492650.8610  0.0036 -3.4698 3  477.8825119  71510 303591545      581444        syn-C2H3C(O)NH2, v=0
  492695.0814  0.0787 -6.0315 3 2037.0454235  71510 303B73978      B73879        syn-C2H3C(O)NH2, v=0
  492695.1972  0.0787 -6.0315 3 2037.0454235  71510 303B73979      B73880        syn-C2H3C(O)NH2, v=0
  492740.1142  0.0023 -5.2530 3  576.7929129  71510 303641846      631845        syn-C2H3C(O)NH2, v=0
  492749.9772  0.0023 -4.9049 3  193.3497 73  71510 303361423      361126        syn-C2H3C(O)NH2, v=0
  492817.6838  0.0041 -5.7758 3  796.3839135  71510 303673334      663333        syn-C2H3C(O)NH2, v=0
  492817.6838  0.0041 -5.7758 3  796.3839135  71510 303673335      663334        syn-C2H3C(O)NH2, v=0
  492974.8856  0.0023 -5.4332 3   53.5994 39  71510 303191010      18 711        syn-C2H3C(O)NH2, v=0
  492993.1568  0.0082 -4.0484 3  930.2042145  71510 303723636      723537        syn-C2H3C(O)NH2, v=0
  492993.1568  0.0082 -4.0484 3  930.2042145  71510 303723637      723538        syn-C2H3C(O)NH2, v=0
  493081.9941  0.0105 -4.6689 3  749.9830147  71510 303732053      731756        syn-C2H3C(O)NH2, v=0
  493094.0714  0.0013 -3.0760 3  263.2753 87  71510 303431430      421329        syn-C2H3C(O)NH2, v=0
  493101.2563  0.0226 -4.7988 3 1375.7316187  71510 303933756      933657        syn-C2H3C(O)NH2, v=0
  493101.2563  0.0226 -4.7988 3 1375.7316187  71510 303933757      933658        syn-C2H3C(O)NH2, v=0
  493238.2757  0.0051 -5.3149 3  657.4414155  71510 30377 473      76 472        syn-C2H3C(O)NH2, v=0
  493238.2757  0.0051 -3.1677 3  657.4414155  71510 30377 473      76 572        syn-C2H3C(O)NH2, v=0
  493238.2757  0.0051 -3.1677 3  657.4414155  71510 30377 573      76 472        syn-C2H3C(O)NH2, v=0
  493238.2757  0.0051 -5.3149 3  657.4414155  71510 30377 573      76 572        syn-C2H3C(O)NH2, v=0
  493238.3712  0.0055 -5.3115 3  659.5188157  71510 30378 375      77 374        syn-C2H3C(O)NH2, v=0
  493238.3712  0.0055 -3.1487 3  659.5188157  71510 30378 375      77 474        syn-C2H3C(O)NH2, v=0
  493238.3712  0.0055 -3.1487 3  659.5188157  71510 30378 475      77 374        syn-C2H3C(O)NH2, v=0
  493238.3712  0.0055 -5.3115 3  659.5188157  71510 30378 475      77 474        syn-C2H3C(O)NH2, v=0
  493246.0163  0.0062 -5.3071 3  661.0760159  71510 30379 277      78 276        syn-C2H3C(O)NH2, v=0
  493246.0163  0.0062 -3.1299 3  661.0760159  71510 30379 277      78 376        syn-C2H3C(O)NH2, v=0
  493246.0163  0.0062 -3.1299 3  661.0760159  71510 30379 377      78 276        syn-C2H3C(O)NH2, v=0
  493246.0163  0.0062 -5.3071 3  661.0760159  71510 30379 377      78 376        syn-C2H3C(O)NH2, v=0
  493251.0195  0.0049 -5.3172 3  654.8361153  71510 30376 571      75 570        syn-C2H3C(O)NH2, v=0
  493251.0195  0.0049 -3.1872 3  654.8361153  71510 30376 571      75 670        syn-C2H3C(O)NH2, v=0
  493251.0195  0.0049 -3.1872 3  654.8361153  71510 30376 671      75 570        syn-C2H3C(O)NH2, v=0
  493251.0195  0.0049 -5.3172 3  654.8361153  71510 30376 671      75 670        syn-C2H3C(O)NH2, v=0
  493257.2261  0.0074 -5.3016 3  662.1195161  71510 30380 179      79 178        syn-C2H3C(O)NH2, v=0
  493257.2261  0.0074 -3.1112 3  662.1195161  71510 30380 179      79 278        syn-C2H3C(O)NH2, v=0
  493257.2261  0.0074 -3.1112 3  662.1195161  71510 30380 279      79 178        syn-C2H3C(O)NH2, v=0
  493257.2261  0.0074 -5.3016 3  662.1195161  71510 30380 279      79 278        syn-C2H3C(O)NH2, v=0
  493268.9605  0.0092 -5.2952 3  662.6547163  71510 30381 081      80 080        syn-C2H3C(O)NH2, v=0
  493268.9605  0.0092 -3.0925 3  662.6547163  71510 30381 081      80 180        syn-C2H3C(O)NH2, v=0
  493268.9605  0.0092 -3.0925 3  662.6547163  71510 30381 181      80 080        syn-C2H3C(O)NH2, v=0
  493268.9605  0.0092 -5.2952 3  662.6547163  71510 30381 181      80 180        syn-C2H3C(O)NH2, v=0
  493283.7305  0.0048 -5.3185 3  651.6938151  71510 30375 669      74 668        syn-C2H3C(O)NH2, v=0
  493283.7305  0.0048 -3.2072 3  651.6938151  71510 30375 669      74 768        syn-C2H3C(O)NH2, v=0
  493283.7305  0.0048 -3.2072 3  651.6938151  71510 30375 769      74 668        syn-C2H3C(O)NH2, v=0
  493283.7305  0.0048 -5.3185 3  651.6938151  71510 30375 769      74 768        syn-C2H3C(O)NH2, v=0
  493311.4889  0.0039 -5.7353 3  781.3188135  71510 303673235      663234        syn-C2H3C(O)NH2, v=0
  493311.4889  0.0039 -5.7353 3  781.3188135  71510 303673236      663235        syn-C2H3C(O)NH2, v=0
  493324.7587  0.0403 -4.7476 3 1254.1254203  71510 303A11289      A11190        syn-C2H3C(O)NH2, v=0
  493324.7587  0.0403 -4.7476 3 1254.1254203  71510 303A11389      A11290        syn-C2H3C(O)NH2, v=0
  493346.1908  0.0046 -5.3186 3  648.0028149  71510 30374 767      73 766        syn-C2H3C(O)NH2, v=0
  493346.1908  0.0046 -3.2282 3  648.0028149  71510 30374 767      73 866        syn-C2H3C(O)NH2, v=0
  493346.1908  0.0046 -3.2282 3  648.0028149  71510 30374 867      73 766        syn-C2H3C(O)NH2, v=0
  493346.1908  0.0046 -5.3186 3  648.0028149  71510 30374 867      73 866        syn-C2H3C(O)NH2, v=0
  493374.2886  0.0961 -5.9517 3 1606.0749215  71510 303A72880      A62977        syn-C2H3C(O)NH2, v=0
  493416.8823  0.0026 -5.4164 3  652.1795133  71510 303662344      652343        syn-C2H3C(O)NH2, v=0
  493417.6081  0.0026 -5.4164 3  652.1795133  71510 303662343      652342        syn-C2H3C(O)NH2, v=0
  493441.0700  0.0015 -2.6416 3  181.4715 49  71510 3032423 1      2322 2        syn-C2H3C(O)NH2, v=0
  493441.0700  0.0015 -2.6416 3  181.4715 49  71510 3032423 2      2322 1        syn-C2H3C(O)NH2, v=0
  493447.7658  0.0023 -5.4327 3   53.5837 39  71510 3031910 9      18 712        syn-C2H3C(O)NH2, v=0
  493452.1296  0.0044 -5.3175 3  643.7489147  71510 30373 865      72 864        syn-C2H3C(O)NH2, v=0
  493452.1296  0.0044 -3.2504 3  643.7489147  71510 30373 865      72 964        syn-C2H3C(O)NH2, v=0
  493452.1296  0.0044 -3.2504 3  643.7489147  71510 30373 965      72 864        syn-C2H3C(O)NH2, v=0
  493452.1296  0.0044 -5.3175 3  643.7489147  71510 30373 965      72 964        syn-C2H3C(O)NH2, v=0
  493470.1859  0.0080 -4.0217 3  912.5397143  71510 303713635      713536        syn-C2H3C(O)NH2, v=0
  493470.1859  0.0080 -4.0217 3  912.5397143  71510 303713636      713537        syn-C2H3C(O)NH2, v=0
  493591.0457  0.0277 -4.3609 3  887.0157179  71510 30389 584      89 485        syn-C2H3C(O)NH2, v=0
  493591.0457  0.0277 -4.3609 3  887.0157179  71510 30389 684      89 585        syn-C2H3C(O)NH2, v=0
  493594.4232  0.0056 -4.7567 3  297.4494 95  71510 303471136      47 839        syn-C2H3C(O)NH2, v=0
  493609.2975  0.0025 -3.3280 3  253.2002 87  71510 303431231      421132        syn-C2H3C(O)NH2, v=0
  493621.3694  0.0041 -3.2744 3  638.9141145  71510 30372 963      711062        syn-C2H3C(O)NH2, v=0
  493621.3697  0.0041 -5.3151 3  638.9141145  71510 303721063      711062        syn-C2H3C(O)NH2, v=0
  493621.3700  0.0041 -5.3151 3  638.9141145  71510 30372 963      71 962        syn-C2H3C(O)NH2, v=0
  493621.3702  0.0041 -3.2744 3  638.9141145  71510 303721063      71 962        syn-C2H3C(O)NH2, v=0
  493683.4269  0.0447 -5.4190 3 1714.1164213  71510 303A63868      A63769        syn-C2H3C(O)NH2, v=0
  493683.4280  0.0447 -5.4190 3 1714.1164213  71510 303A63869      A63770        syn-C2H3C(O)NH2, v=0
  493684.9955  0.0291 -4.4677 3 1035.7765189  71510 30394 886      94 787        syn-C2H3C(O)NH2, v=0
  493684.9955  0.0291 -4.4677 3 1035.7765189  71510 30394 986      94 887        syn-C2H3C(O)NH2, v=0
  493687.5306  0.0838 -4.8700 3 1086.2383177  71510 303882365      872464        syn-C2H3C(O)NH2, v=0
  493730.2128  0.0024 -4.9615 3  184.3820 71  71510 303351421      351124        syn-C2H3C(O)NH2, v=0
  493800.0448  0.0023 -5.2963 3  600.0899131  71510 303651947      641946        syn-C2H3C(O)NH2, v=0
  493814.0255  0.1310 -5.7705 3 1863.7770239  71510 303B92198      B92099        syn-C2H3C(O)NH2, v=0
  493814.0307  0.1310 -5.7705 3 1863.7770239  71510 303B92298      B92199        syn-C2H3C(O)NH2, v=0
  493852.4594  0.0038 -5.6962 3  766.7478135  71510 303673136      663135        syn-C2H3C(O)NH2, v=0
  493852.4594  0.0038 -5.6962 3  766.7478135  71510 303673137      663136        syn-C2H3C(O)NH2, v=0
  493870.8574  0.0041 -4.5703 3   90.3251 59  71510 30329 326      28 227        syn-C2H3C(O)NH2, v=0
  493871.9007  0.0014 -2.6667 3  183.2616 53  71510 3032622 4      2521 5        syn-C2H3C(O)NH2, v=0
  493871.9007  0.0014 -2.6667 3  183.2616 53  71510 3032622 5      2521 4        syn-C2H3C(O)NH2, v=0
  493878.0421  0.0041 -4.5702 3   90.3251 59  71510 30329 426      28 127        syn-C2H3C(O)NH2, v=0
  493883.5926  0.0038 -3.3009 3  633.4751143  71510 303711061      701160        syn-C2H3C(O)NH2, v=0
  493883.6018  0.0038 -5.3113 3  633.4751143  71510 303711161      701160        syn-C2H3C(O)NH2, v=0
  493883.6099  0.0038 -5.3113 3  633.4751143  71510 303711061      701060        syn-C2H3C(O)NH2, v=0
  493883.6192  0.0038 -3.3009 3  633.4751143  71510 303711161      701060        syn-C2H3C(O)NH2, v=0
  493902.7045  0.1195 -6.0357 3 1633.6585217  71510 303A82881      A72978        syn-C2H3C(O)NH2, v=0
  493927.8388  0.0077 -3.9957 3  895.1268141  71510 303703634      703535        syn-C2H3C(O)NH2, v=0
  493927.8388  0.0077 -3.9957 3  895.1268141  71510 303703635      703536        syn-C2H3C(O)NH2, v=0
  494085.6280  0.0216 -4.7567 3 1352.7451185  71510 303923755      923656        syn-C2H3C(O)NH2, v=0
  494085.6280  0.0216 -4.7567 3 1352.7451185  71510 303923756      923657        syn-C2H3C(O)NH2, v=0
  494180.4991  0.0049 -5.5642 3  137.7972 65  71510 303321022      32 527        syn-C2H3C(O)NH2, v=0
  494197.7574  0.0010 -2.8946 3  225.5422 77  71510 303381623      371522        syn-C2H3C(O)NH2, v=0
  494198.6384  0.0010 -2.8946 3  225.5421 77  71510 303381622      371523        syn-C2H3C(O)NH2, v=0
  494275.5285  0.0456 -4.8420 3 1316.9602207  71510 303A31390      A31291        syn-C2H3C(O)NH2, v=0
  494275.5285  0.0456 -4.8420 3 1316.9602207  71510 303A31490      A31391        syn-C2H3C(O)NH2, v=0
  494280.5803  0.0013 -2.6940 3  186.5238 57  71510 3032821 7      2720 8        syn-C2H3C(O)NH2, v=0
  494280.5803  0.0013 -2.6940 3  186.5238 57  71510 3032821 8      2720 7        syn-C2H3C(O)NH2, v=0
  494285.2263  0.0035 -3.3309 3  627.4003141  71510 303701159      691258        syn-C2H3C(O)NH2, v=0
  494285.4755  0.0035 -5.3059 3  627.4003141  71510 303701259      691258        syn-C2H3C(O)NH2, v=0
  494285.6792  0.0035 -5.3059 3  627.4003141  71510 303701159      691158        syn-C2H3C(O)NH2, v=0
  494285.9285  0.0035 -3.3309 3  627.4003141  71510 303701259      691158        syn-C2H3C(O)NH2, v=0
  494366.7487  0.0075 -3.9706 3  877.9651139  71510 303693633      693534        syn-C2H3C(O)NH2, v=0
  494366.7487  0.0075 -3.9706 3  877.9651139  71510 303693634      693535        syn-C2H3C(O)NH2, v=0
  494393.7832  0.0096 -4.6264 3  588.3302131  71510 303651748      651451        syn-C2H3C(O)NH2, v=0
  494448.2841  0.0036 -5.6584 3  752.6748135  71510 303673037      663036        syn-C2H3C(O)NH2, v=0
  494448.2841  0.0036 -5.6584 3  752.6748135  71510 303673038      663037        syn-C2H3C(O)NH2, v=0
  494499.1727  0.0025 -3.4635 3  588.3302133  71510 303661552      651451        syn-C2H3C(O)NH2, v=0
  494633.2044  0.0748 -5.9734 3 2007.8576233  71510 303B63977      B63878        syn-C2H3C(O)NH2, v=0
  494633.2675  0.0748 -5.9734 3 2007.8576233  71510 303B63978      B63879        syn-C2H3C(O)NH2, v=0
  494633.5262  0.1948 -5.8465 3 1589.5757213  71510 303A62977      A53076        syn-C2H3C(O)NH2, v=0
  494642.7222  0.0011 -2.7240 3  191.2698 61  71510 303302010      291911        syn-C2H3C(O)NH2, v=0
  494642.7222  0.0011 -2.7240 3  191.2698 61  71510 303302011      291910        syn-C2H3C(O)NH2, v=0
  494645.5571  0.0031 -3.3227 3  346.3672101  71510 303501437      491336        syn-C2H3C(O)NH2, v=0
  494671.7386  0.0111 -4.6379 3  645.9326137  71510 303681850      681553        syn-C2H3C(O)NH2, v=0
  494731.3117  0.0305 -4.3949 3  798.3335173  71510 30386 383      86 284        syn-C2H3C(O)NH2, v=0
  494731.3117  0.0305 -4.3949 3  798.3335173  71510 30386 483      86 384        syn-C2H3C(O)NH2, v=0
  494761.3295  0.1146 -5.6395 3 1791.1928235  71510 303B72097      B71998        syn-C2H3C(O)NH2, v=0
  494761.3309  0.1146 -5.6395 3 1791.1928235  71510 303B72197      B72098        syn-C2H3C(O)NH2, v=0
  494787.5286  0.0073 -3.9464 3  861.0544137  71510 303683632      683533        syn-C2H3C(O)NH2, v=0
  494787.5286  0.0073 -3.9464 3  861.0544137  71510 303683633      683534        syn-C2H3C(O)NH2, v=0
  494868.5196  0.0010 -2.8410 3  214.6096 73  71510 303361720      351619        syn-C2H3C(O)NH2, v=0
  494868.5275  0.0010 -2.8410 3  214.6096 73  71510 303361719      351620        syn-C2H3C(O)NH2, v=0
  494898.7559  0.0032 -3.3663 3  620.6462139  71510 303691257      681356        syn-C2H3C(O)NH2, v=0
  494904.1680  0.0032 -5.2987 3  620.6462139  71510 303691357      681356        syn-C2H3C(O)NH2, v=0
  494908.2635  0.0032 -5.2987 3  620.6459139  71510 303691257      681256        syn-C2H3C(O)NH2, v=0
  494913.6757  0.0032 -3.3662 3  620.6459139  71510 303691357      681256        syn-C2H3C(O)NH2, v=0
  494917.0149  0.0011 -2.7577 3  197.5157 65  71510 303321913      311814        syn-C2H3C(O)NH2, v=0
  494917.0149  0.0011 -2.7577 3  197.5157 65  71510 303321914      311813        syn-C2H3C(O)NH2, v=0
  494987.1357  0.0015 -3.1983 3  268.8962 89  71510 303441331      431232        syn-C2H3C(O)NH2, v=0
  495024.3077  0.0517 -4.9419 3 1381.0353211  71510 303A51491      A51392        syn-C2H3C(O)NH2, v=0
  495024.3077  0.0517 -4.9419 3 1381.0353211  71510 303A51591      A51492        syn-C2H3C(O)NH2, v=0
  495033.1498  0.0010 -2.7962 3  205.2845 69  71510 303341816      331717        syn-C2H3C(O)NH2, v=0
  495033.1498  0.0010 -2.7962 3  205.2845 69  71510 303341817      331716        syn-C2H3C(O)NH2, v=0
  495034.4898  0.0206 -4.7154 3 1330.0163183  71510 303913754      913655        syn-C2H3C(O)NH2, v=0
  495034.4898  0.0206 -4.7154 3 1330.0163183  71510 303913755      913656        syn-C2H3C(O)NH2, v=0
  495047.7783  0.0033 -5.9288 3  111.7434 57  71510 303281117      28 622        syn-C2H3C(O)NH2, v=0
  495067.3553  0.0026 -5.3880 3  642.3256133  71510 303662245      652244        syn-C2H3C(O)NH2, v=0
  495071.9272  0.0022 -5.2108 3  561.9055129  71510 303641549      631548        syn-C2H3C(O)NH2, v=0
  495074.5329  0.0026 -5.3879 3  642.3259133  71510 303662244      652243        syn-C2H3C(O)NH2, v=0
  495108.4128  0.0035 -5.6220 3  739.1041135  71510 303672938      662937        syn-C2H3C(O)NH2, v=0
  495108.4128  0.0035 -5.6220 3  739.1041135  71510 303672939      662938        syn-C2H3C(O)NH2, v=0
  495119.3418  0.0425 -5.3683 3 1687.7879211  71510 303A53867      A53768        syn-C2H3C(O)NH2, v=0
  495119.3424  0.0425 -5.3683 3 1687.7879211  71510 303A53868      A53769        syn-C2H3C(O)NH2, v=0
  495190.7729  0.0071 -3.9231 3  844.3943135  71510 303673631      673532        syn-C2H3C(O)NH2, v=0
  495190.7729  0.0071 -3.9231 3  844.3943135  71510 303673632      673533        syn-C2H3C(O)NH2, v=0
  495278.7612  0.0352 -4.6909 3  712.6195167  71510 30383 182      83 083        syn-C2H3C(O)NH2, v=0
  495278.7612  0.0352 -4.6909 3  712.6195167  71510 30383 282      83 183        syn-C2H3C(O)NH2, v=0
  495390.8081  0.0316 -4.5356 3 1094.1962193  71510 30396 987      96 888        syn-C2H3C(O)NH2, v=0
  495390.8081  0.0316 -4.5356 3 1094.1962193  71510 303961087      96 988        syn-C2H3C(O)NH2, v=0
  495403.8927  0.0024 -5.2937 3  600.1747131  71510 303651946      641945        syn-C2H3C(O)NH2, v=0
  495426.9975  0.1002 -5.5125 3 1719.8045231  71510 303B51996      B51897        syn-C2H3C(O)NH2, v=0
  495426.9979  0.1002 -5.5125 3 1719.8045231  71510 303B52096      B51997        syn-C2H3C(O)NH2, v=0
  495506.6465  0.0050 -4.6209 3  418.5013109  71510 303541737      541440        syn-C2H3C(O)NH2, v=0
  495563.1595  0.0588 -5.0468 3 1446.3448215  71510 303A71592      A71493        syn-C2H3C(O)NH2, v=0
  495563.1595  0.0588 -5.0468 3 1446.3448215  71510 303A71692      A71593        syn-C2H3C(O)NH2, v=0
  495577.0578  0.0069 -3.9007 3  827.9847133  71510 303663630      663531        syn-C2H3C(O)NH2, v=0
  495577.0578  0.0069 -3.9007 3  827.9847133  71510 303663631      663532        syn-C2H3C(O)NH2, v=0
  495651.9192  0.0022 -5.2566 3  585.9338131  71510 303651749      641748        syn-C2H3C(O)NH2, v=0
  495766.7870  0.0088 -4.6271 3  533.3157125  71510 303621646      621349        syn-C2H3C(O)NH2, v=0
  495768.8430  0.0030 -3.4103 3  613.1492137  71510 303681355      671454        syn-C2H3C(O)NH2, v=0
  495781.4605  0.1194 -5.9705 3 1643.8681217  71510 303A82980      A73077        syn-C2H3C(O)NH2, v=0
  495798.4151  0.0283 -4.3934 3  942.2166183  71510 30391 685      91 586        syn-C2H3C(O)NH2, v=0
  495798.4151  0.0283 -4.3934 3  942.2166183  71510 30391 785      91 686        syn-C2H3C(O)NH2, v=0
  495826.8532  0.0876 -5.3896 3 1649.6189227  71510 303B31895      B31796        syn-C2H3C(O)NH2, v=0
  495826.8533  0.0876 -5.3896 3 1649.6189227  71510 303B31995      B31896        syn-C2H3C(O)NH2, v=0
  495844.6278  0.0034 -5.5867 3  726.0411135  71510 303672839      662838        syn-C2H3C(O)NH2, v=0
  495844.6278  0.0034 -5.5867 3  726.0411135  71510 303672840      662839        syn-C2H3C(O)NH2, v=0
  495862.1591  0.0030 -5.2892 3  613.1492137  71510 303681455      671454        syn-C2H3C(O)NH2, v=0
  495883.2732  0.0671 -5.1566 3 1512.8827219  71510 303A91693      A91594        syn-C2H3C(O)NH2, v=0
  495883.2732  0.0671 -5.1566 3 1512.8827219  71510 303A91793      A91694        syn-C2H3C(O)NH2, v=0
  495888.3826  0.0023 -5.2734 3  592.7563131  71510 303651848      641847        syn-C2H3C(O)NH2, v=0
  495926.2610  0.0030 -5.2891 3  613.1440137  71510 303681355      671354        syn-C2H3C(O)NH2, v=0
  495946.9423  0.0067 -3.8792 3  811.8253131  71510 303653629      653530        syn-C2H3C(O)NH2, v=0
  495946.9423  0.0067 -3.8792 3  811.8253131  71510 303653630      653531        syn-C2H3C(O)NH2, v=0
  495949.0860  0.0196 -4.6747 3 1307.5449181  71510 303903753      903654        syn-C2H3C(O)NH2, v=0
  495949.0860  0.0196 -4.6747 3 1307.5449181  71510 303903754      903655        syn-C2H3C(O)NH2, v=0
  495974.8317  0.0766 -5.2709 3 1580.6429223  71510 303B11794      B11695        syn-C2H3C(O)NH2, v=0
  495974.8317  0.0766 -5.2709 3 1580.6429223  71510 303B11894      B11795        syn-C2H3C(O)NH2, v=0
  495980.8055  0.0027 -3.4726 3  604.8250135  71510 303671453      661552        syn-C2H3C(O)NH2, v=0
  496019.5771  0.0030 -3.4099 3  613.1440137  71510 303681455      671354        syn-C2H3C(O)NH2, v=0
  496100.7359  0.0038 -3.9563 3  125.5798 65  71510 30332 626      31 527        syn-C2H3C(O)NH2, v=0
  496130.1171  0.0074 -5.6916 3   61.4762 47  71510 30323 617      22 320        syn-C2H3C(O)NH2, v=0
  496200.7423  0.0649 -4.7079 3 1011.6089171  71510 303852263      842362        syn-C2H3C(O)NH2, v=0
  496300.9691  0.0066 -3.8587 3  795.9159129  71510 303643628      643529        syn-C2H3C(O)NH2, v=0
  496300.9691  0.0066 -3.8587 3  795.9159129  71510 303643629      643530        syn-C2H3C(O)NH2, v=0
  496372.7810  0.0012 -3.0715 3  263.1862 87  71510 303431429      421330        syn-C2H3C(O)NH2, v=0
  496480.5507  0.0030 -3.5772 3  612.2622135  71510 303671552      661651        syn-C2H3C(O)NH2, v=0
  496499.5699  0.0711 -5.9160 3 1978.9374231  71510 303B53976      B53877        syn-C2H3C(O)NH2, v=0
  496499.6040  0.0711 -5.9160 3 1978.9374231  71510 303B53977      B53878        syn-C2H3C(O)NH2, v=0
  496503.9655  0.0405 -5.3182 3 1661.7220209  71510 303A43866      A43767        syn-C2H3C(O)NH2, v=0
  496503.9658  0.0405 -5.3182 3 1661.7220209  71510 303A43867      A43768        syn-C2H3C(O)NH2, v=0
  496556.2045  0.0030 -5.4881 3  142.1279 65  71510 303321121      32 626        syn-C2H3C(O)NH2, v=0
  496639.6654  0.0065 -3.8391 3  780.2561127  71510 303633627      633528        syn-C2H3C(O)NH2, v=0
  496639.6654  0.0065 -3.8391 3  780.2561127  71510 303633628      633529        syn-C2H3C(O)NH2, v=0
  496671.8739  0.0033 -5.5528 3  713.4922135  71510 303672741      662740        syn-C2H3C(O)NH2, v=0
  496671.8740  0.0033 -5.5528 3  713.4922135  71510 303672740      662739        syn-C2H3C(O)NH2, v=0
  496693.0540  0.0222 -4.2210 3  803.5688153  71510 303761957      752056        syn-C2H3C(O)NH2, v=0
  496789.7045  0.0023 -4.9576 3  184.2799 71  71510 303351422      351125        syn-C2H3C(O)NH2, v=0
  496830.6035  0.0187 -4.6348 3 1285.3304179  71510 303893752      893653        syn-C2H3C(O)NH2, v=0
  496830.6035  0.0187 -4.6348 3 1285.3304179  71510 303893753      893654        syn-C2H3C(O)NH2, v=0
  496922.2097  0.0347 -4.6117 3 1153.8788197  71510 303981088      98 989        syn-C2H3C(O)NH2, v=0
  496922.2097  0.0347 -4.6117 3 1153.8788197  71510 303981188      981089        syn-C2H3C(O)NH2, v=0
  496946.6969  0.0039 -4.2938 3  101.8157 61  71510 30330 426      29 327        syn-C2H3C(O)NH2, v=0
  496963.5433  0.0063 -3.8206 3  764.8458125  71510 303623626      623527        syn-C2H3C(O)NH2, v=0
  496963.5433  0.0063 -3.8206 3  764.8458125  71510 303623627      623528        syn-C2H3C(O)NH2, v=0
  497014.5165  0.0039 -4.2937 3  101.8157 61  71510 30330 526      29 227        syn-C2H3C(O)NH2, v=0
  497077.0977  0.0026 -5.3604 3  633.0789133  71510 303662146      652145        syn-C2H3C(O)NH2, v=0
  497138.2445  0.0026 -5.3603 3  633.0815133  71510 303662145      652144        syn-C2H3C(O)NH2, v=0
  497218.1134  0.0027 -5.2772 3  604.8250135  71510 303671553      661552        syn-C2H3C(O)NH2, v=0
  497247.9265  0.0300 -4.3771 3  851.5633177  71510 30388 484      88 385        syn-C2H3C(O)NH2, v=0
  497247.9265  0.0300 -4.3771 3  851.5633177  71510 30388 584      88 485        syn-C2H3C(O)NH2, v=0
  497273.1004  0.0063 -3.8032 3  749.6847123  71510 303613625      613526        syn-C2H3C(O)NH2, v=0
  497273.1004  0.0063 -3.8032 3  749.6847123  71510 303613626      613527        syn-C2H3C(O)NH2, v=0
  497568.8207  0.0062 -3.7868 3  734.7726121  71510 303603624      603525        syn-C2H3C(O)NH2, v=0
  497568.8207  0.0062 -3.7868 3  734.7726121  71510 303603625      603526        syn-C2H3C(O)NH2, v=0
  497592.1408  0.0014 -3.1004 3  274.1894 89  71510 303441431      431330        syn-C2H3C(O)NH2, v=0
  497609.5063  0.0032 -5.5200 3  701.4657135  71510 303672642      662641        syn-C2H3C(O)NH2, v=0
  497609.5070  0.0032 -5.5200 3  701.4657135  71510 303672641      662640        syn-C2H3C(O)NH2, v=0
  497662.3832  0.0071 -4.6521 3  694.2291141  71510 303702050      701753        syn-C2H3C(O)NH2, v=0
  497668.9102  0.0132 -4.6652 3  706.1085143  71510 303711952      711655        syn-C2H3C(O)NH2, v=0
  497680.1757  0.0179 -4.5956 3 1263.3725177  71510 303883751      883652        syn-C2H3C(O)NH2, v=0
  497680.1757  0.0179 -4.5956 3 1263.3725177  71510 303883752      883653        syn-C2H3C(O)NH2, v=0
  497725.9802  0.0083 -4.6371 3  480.9015119  71510 303591544      591247        syn-C2H3C(O)NH2, v=0
  497821.6938  0.0062 -4.7119 3  339.3637101  71510 303501238      50 941        syn-C2H3C(O)NH2, v=0
  497839.3592  0.0386 -5.2689 3 1635.9181207  71510 303A33865      A33766        syn-C2H3C(O)NH2, v=0
  497839.3594  0.0386 -5.2689 3 1635.9181207  71510 303A33866      A33767        syn-C2H3C(O)NH2, v=0
  497846.5496  0.0296 -4.4410 3  998.6967187  71510 30393 786      93 687        syn-C2H3C(O)NH2, v=0
  497846.5496  0.0296 -4.4410 3  998.6967187  71510 30393 886      93 787        syn-C2H3C(O)NH2, v=0
  497851.1752  0.0061 -3.7716 3  720.1092119  71510 303593623      593524        syn-C2H3C(O)NH2, v=0
  497851.1752  0.0061 -3.7716 3  720.1092119  71510 303593624      593525        syn-C2H3C(O)NH2, v=0
  497961.0449  0.0027 -5.2757 3  604.7589135  71510 303671453      661452        syn-C2H3C(O)NH2, v=0
  497988.9572  0.0027 -5.9012 3   50.0592 41  71510 30320 813      19 316        syn-C2H3C(O)NH2, v=0
  498002.1231  0.0062 -6.0567 3  913.3683137  71510 303683929      673928        syn-C2H3C(O)NH2, v=0
  498002.1231  0.0062 -6.0567 3  913.3683137  71510 303683930      673929        syn-C2H3C(O)NH2, v=0
  498017.1979  0.0479 -4.5448 3  939.6226165  71510 303822161      812260        syn-C2H3C(O)NH2, v=0
  498085.5431  0.0338 -4.4927 3  763.8579171  71510 30385 283      85 184        syn-C2H3C(O)NH2, v=0
  498085.5431  0.0338 -4.4927 3  763.8579171  71510 30385 383      85 284        syn-C2H3C(O)NH2, v=0
  498120.6220  0.0061 -3.7577 3  705.6945117  71510 303583622      583523        syn-C2H3C(O)NH2, v=0
  498120.6220  0.0061 -3.7577 3  705.6945117  71510 303583623      583524        syn-C2H3C(O)NH2, v=0
  498133.3790  0.0025 -5.2641 3  595.6462133  71510 303661651      651650        syn-C2H3C(O)NH2, v=0
  498160.2562  0.0038 -4.0995 3  113.5744 63  71510 30331 526      30 427        syn-C2H3C(O)NH2, v=0
  498163.0817  0.0025 -4.1256 3  129.4776 63  71510 303311022      30 723        syn-C2H3C(O)NH2, v=0
  498177.1625  0.0020 -5.1845 3  549.8527127  71510 303631647      621646        syn-C2H3C(O)NH2, v=0
  498234.0852  0.0022 -5.3109 3   58.3434 41  71510 303201011      19 712        syn-C2H3C(O)NH2, v=0
  498274.0110  0.0386 -4.6950 3 1214.8190201  71510 303A01189      A01090        syn-C2H3C(O)NH2, v=0
  498274.0110  0.0386 -4.6950 3 1214.8190201  71510 303A01289      A01190        syn-C2H3C(O)NH2, v=0
  498297.5883  0.0677 -5.8593 3 1950.2841229  71510 303B43975      B43876        syn-C2H3C(O)NH2, v=0
  498297.6066  0.0677 -5.8593 3 1950.2841229  71510 303B43976      B43877        syn-C2H3C(O)NH2, v=0
  498328.6043  0.0058 -6.0081 3  895.4008137  71510 303683830      673829        syn-C2H3C(O)NH2, v=0
  498328.6043  0.0058 -6.0081 3  895.4008137  71510 303683831      673830        syn-C2H3C(O)NH2, v=0
  498377.6068  0.0060 -3.7449 3  691.5280115  71510 303573621      573522        syn-C2H3C(O)NH2, v=0
  498377.6068  0.0060 -3.7449 3  691.5280115  71510 303573622      573523        syn-C2H3C(O)NH2, v=0
  498404.4699  0.0335 -4.3818 3  870.2768159  71510 303792059      782158        syn-C2H3C(O)NH2, v=0
  498498.8860  0.0171 -4.5570 3 1241.6707175  71510 303873750      873651        syn-C2H3C(O)NH2, v=0
  498498.8860  0.0171 -4.5570 3 1241.6707175  71510 303873751      873652        syn-C2H3C(O)NH2, v=0
  498622.5639  0.0060 -3.7336 3  677.6097113  71510 303563620      563521        syn-C2H3C(O)NH2, v=0
  498622.5639  0.0060 -3.7336 3  677.6097113  71510 303563621      563522        syn-C2H3C(O)NH2, v=0
  498648.4967  0.0037 -4.0988 3  113.5743 63  71510 30331 626      30 327        syn-C2H3C(O)NH2, v=0
  498677.6133  0.0055 -5.9609 3  877.9149137  71510 303683731      673730        syn-C2H3C(O)NH2, v=0
  498677.6133  0.0055 -5.9609 3  877.9149137  71510 303683732      673731        syn-C2H3C(O)NH2, v=0
  498683.2426  0.0031 -5.4885 3  689.9718135  71510 303672543      662542        syn-C2H3C(O)NH2, v=0
  498683.2531  0.0031 -5.4885 3  689.9718135  71510 303672542      662541        syn-C2H3C(O)NH2, v=0
  498762.0824  0.0032 -3.8438 3  137.7972 67  71510 30333 826      32 527        syn-C2H3C(O)NH2, v=0
  498826.9705  0.0035 -3.9531 3  125.5785 65  71510 30332 726      31 427        syn-C2H3C(O)NH2, v=0
  498855.9160  0.0060 -3.7236 3  663.9393111  71510 303553619      553520        syn-C2H3C(O)NH2, v=0
  498855.9160  0.0060 -3.7236 3  663.9393111  71510 303553620      553521        syn-C2H3C(O)NH2, v=0
  498869.5178  0.0024 -5.0157 3  175.5354 69  71510 303341420      341123        syn-C2H3C(O)NH2, v=0
  499011.2667  0.0036 -4.5856 3  333.5377 99  71510 303491436      491139        syn-C2H3C(O)NH2, v=0
  499052.0498  0.0052 -5.9152 3  860.9121137  71510 303683632      673631        syn-C2H3C(O)NH2, v=0
  499052.0498  0.0052 -5.9152 3  860.9121137  71510 303683633      673632        syn-C2H3C(O)NH2, v=0
  499078.0750  0.0060 -3.7152 3  650.5166109  71510 303543618      543519        syn-C2H3C(O)NH2, v=0
  499078.0750  0.0060 -3.7152 3  650.5166109  71510 303543619      543520        syn-C2H3C(O)NH2, v=0
  499096.4843  0.0011 -2.9745 3  248.1550 83  71510 303411527      401426        syn-C2H3C(O)NH2, v=0
  499109.5936  0.0021 -4.0139 3  137.4916 65  71510 303321023      31 724        syn-C2H3C(O)NH2, v=0
  499127.4628  0.0368 -5.2202 3 1610.3756205  71510 303A23864      A23765        syn-C2H3C(O)NH2, v=0
  499127.4629  0.0368 -5.2202 3 1610.3756205  71510 303A23865      A23766        syn-C2H3C(O)NH2, v=0
  499137.0641  0.2146 -6.0186 3 1682.7211219  71510 303A93079      A83178        syn-C2H3C(O)NH2, v=0
  499141.3563  0.1562 -5.9545 3 1966.4950245  71510 303C222A0      C221A1        syn-C2H3C(O)NH2, v=0
  499141.3666  0.1562 -5.9545 3 1966.4950245  71510 303C223A0      C222A1        syn-C2H3C(O)NH2, v=0
  499187.2295  0.0029 -4.2465 3  121.6633 61  71510 303301021      29 722        syn-C2H3C(O)NH2, v=0
  499197.6315  0.0039 -3.4642 3  462.7226117  71510 303581544      571443        syn-C2H3C(O)NH2, v=0
  499198.3528  0.0027 -3.4666 3  604.7589135  71510 303671553      661452        syn-C2H3C(O)NH2, v=0
  499204.0845  0.0022 -5.3100 3   58.3110 41  71510 303201010      19 713        syn-C2H3C(O)NH2, v=0
  499205.0171  0.0011 -2.9744 3  248.1519 83  71510 303411526      401427        syn-C2H3C(O)NH2, v=0
  499271.0237  0.0058 -5.3331 3  673.8940157  71510 30378 474      77 473        syn-C2H3C(O)NH2, v=0
  499271.0237  0.0058 -3.1850 3  673.8940157  71510 30378 474      77 573        syn-C2H3C(O)NH2, v=0
  499271.0237  0.0058 -3.1850 3  673.8940157  71510 30378 574      77 473        syn-C2H3C(O)NH2, v=0
  499271.0237  0.0058 -5.3331 3  673.8940157  71510 30378 574      77 573        syn-C2H3C(O)NH2, v=0
  499271.8176  0.0062 -5.3298 3  675.9714159  71510 30379 376      78 375        syn-C2H3C(O)NH2, v=0
  499271.8176  0.0062 -3.1664 3  675.9714159  71510 30379 376      78 475        syn-C2H3C(O)NH2, v=0
  499271.8176  0.0062 -3.1664 3  675.9714159  71510 30379 476      78 375        syn-C2H3C(O)NH2, v=0
  499271.8176  0.0062 -5.3298 3  675.9714159  71510 30379 476      78 475        syn-C2H3C(O)NH2, v=0
  499276.7068  0.0078 -4.6544 3  431.0984113  71510 303561442      561145        syn-C2H3C(O)NH2, v=0
  499279.8205  0.0069 -5.3254 3  677.5289161  71510 30380 278      79 277        syn-C2H3C(O)NH2, v=0
  499279.8205  0.0069 -3.1479 3  677.5289161  71510 30380 278      79 377        syn-C2H3C(O)NH2, v=0
  499279.8205  0.0069 -3.1479 3  677.5289161  71510 30380 378      79 277        syn-C2H3C(O)NH2, v=0
  499279.8205  0.0069 -5.3254 3  677.5289161  71510 30380 378      79 377        syn-C2H3C(O)NH2, v=0
  499282.5311  0.0055 -5.3353 3  671.2892155  71510 30377 572      76 571        syn-C2H3C(O)NH2, v=0
  499282.5311  0.0055 -3.2041 3  671.2892155  71510 30377 572      76 671        syn-C2H3C(O)NH2, v=0
  499282.5311  0.0055 -3.2041 3  671.2892155  71510 30377 672      76 571        syn-C2H3C(O)NH2, v=0
  499282.5311  0.0055 -5.3353 3  671.2892155  71510 30377 672      76 671        syn-C2H3C(O)NH2, v=0
  499287.7716  0.0164 -4.5192 3 1220.2247173  71510 303863749      863650        syn-C2H3C(O)NH2, v=0
  499287.7716  0.0164 -4.5192 3 1220.2247173  71510 303863750      863651        syn-C2H3C(O)NH2, v=0
  499289.4420  0.0061 -3.7084 3  637.3414107  71510 303533617      533518        syn-C2H3C(O)NH2, v=0
  499289.4420  0.0061 -3.7084 3  637.3414107  71510 303533618      533519        syn-C2H3C(O)NH2, v=0
  499291.1790  0.0082 -5.3201 3  678.5728163  71510 30381 180      80 179        syn-C2H3C(O)NH2, v=0
  499291.1790  0.0082 -3.1295 3  678.5728163  71510 30381 180      80 279        syn-C2H3C(O)NH2, v=0
  499291.1790  0.0082 -3.1295 3  678.5728163  71510 30381 280      80 179        syn-C2H3C(O)NH2, v=0
  499291.1790  0.0082 -5.3201 3  678.5728163  71510 30381 280      80 279        syn-C2H3C(O)NH2, v=0
  499302.9411  0.0101 -5.3138 3  679.1083165  71510 30382 082      81 081        syn-C2H3C(O)NH2, v=0
  499302.9411  0.0101 -3.1110 3  679.1083165  71510 30382 082      81 181        syn-C2H3C(O)NH2, v=0
  499302.9411  0.0101 -3.1110 3  679.1083165  71510 30382 182      81 081        syn-C2H3C(O)NH2, v=0
  499302.9411  0.0101 -5.3138 3  679.1083165  71510 30382 182      81 181        syn-C2H3C(O)NH2, v=0
  499303.3172  0.0024 -5.2318 3  578.4194131  71510 303651550      641549        syn-C2H3C(O)NH2, v=0
  499313.1692  0.0053 -5.3365 3  668.1479153  71510 30376 670      75 669        syn-C2H3C(O)NH2, v=0
  499313.1692  0.0053 -3.2237 3  668.1479153  71510 30376 670      75 769        syn-C2H3C(O)NH2, v=0
  499313.1692  0.0053 -3.2237 3  668.1479153  71510 30376 770      75 669        syn-C2H3C(O)NH2, v=0
  499313.1692  0.0053 -5.3365 3  668.1479153  71510 30376 770      75 769        syn-C2H3C(O)NH2, v=0
  499372.2587  0.0051 -5.3365 3  664.4590151  71510 30375 768      74 767        syn-C2H3C(O)NH2, v=0
  499372.2587  0.0051 -3.2441 3  664.4590151  71510 30375 768      74 867        syn-C2H3C(O)NH2, v=0
  499372.2587  0.0051 -3.2441 3  664.4590151  71510 30375 868      74 767        syn-C2H3C(O)NH2, v=0
  499372.2587  0.0051 -5.3365 3  664.4590151  71510 30375 868      74 867        syn-C2H3C(O)NH2, v=0
  499440.5255  0.0432 -4.7848 3 1277.0111205  71510 303A21290      A21191        syn-C2H3C(O)NH2, v=0
  499440.5255  0.0432 -4.7848 3 1277.0111205  71510 303A21390      A21291        syn-C2H3C(O)NH2, v=0
  499455.2941  0.0050 -5.8710 3  844.3943137  71510 303683533      673532        syn-C2H3C(O)NH2, v=0
  499455.2941  0.0050 -5.8710 3  844.3943137  71510 303683534      673533        syn-C2H3C(O)NH2, v=0
  499472.7986  0.0049 -5.3353 3  660.2087149  71510 30374 866      73 865        syn-C2H3C(O)NH2, v=0
  499472.7986  0.0049 -3.2657 3  660.2087149  71510 30374 866      73 965        syn-C2H3C(O)NH2, v=0
  499472.7986  0.0049 -3.2657 3  660.2087149  71510 30374 966      73 865        syn-C2H3C(O)NH2, v=0
  499472.7986  0.0049 -5.3353 3  660.2087149  71510 30374 966      73 965        syn-C2H3C(O)NH2, v=0
  499490.4079  0.0061 -3.7034 3  624.4136105  71510 303523616      523517        syn-C2H3C(O)NH2, v=0
  499490.4079  0.0061 -3.7034 3  624.4136105  71510 303523617      523518        syn-C2H3C(O)NH2, v=0
  499512.2079  0.0026 -5.3337 3  624.4785133  71510 303662047      652046        syn-C2H3C(O)NH2, v=0
  499545.5165  0.0070 -4.6788 3  383.9162107  71510 303531340      531043        syn-C2H3C(O)NH2, v=0
  499613.9716  0.0301 -4.3903 3  906.0826181  71510 30390 585      90 486        syn-C2H3C(O)NH2, v=0
  499613.9716  0.0301 -4.3903 3  906.0826181  71510 30390 685      90 586        syn-C2H3C(O)NH2, v=0
  499633.4153  0.0046 -3.2889 3  655.3796147  71510 30373 964      721063        syn-C2H3C(O)NH2, v=0
  499633.4154  0.0046 -5.3329 3  655.3796147  71510 303731064      721063        syn-C2H3C(O)NH2, v=0
  499633.4156  0.0046 -5.3329 3  655.3796147  71510 30373 964      72 963        syn-C2H3C(O)NH2, v=0
  499633.4157  0.0046 -3.2889 3  655.3796147  71510 303731064      72 963        syn-C2H3C(O)NH2, v=0
  499654.7825  0.0028 -3.2817 3  333.5162 99  71510 303491436      481335        syn-C2H3C(O)NH2, v=0
  499681.3536  0.0062 -3.7003 3  611.7329103  71510 303513615      513516        syn-C2H3C(O)NH2, v=0
  499681.3536  0.0062 -3.7003 3  611.7329103  71510 303513616      513517        syn-C2H3C(O)NH2, v=0
  499731.5825  0.0315 -4.5004 3 1056.4506191  71510 30395 887      95 788        syn-C2H3C(O)NH2, v=0
  499731.5825  0.0315 -4.5004 3 1056.4506191  71510 30395 987      95 888        syn-C2H3C(O)NH2, v=0
  499831.3050  0.0043 -4.7917 3   85.4868 53  71510 30326 818      25 521        syn-C2H3C(O)NH2, v=0
  499862.6505  0.0062 -3.6993 3  599.2991101  71510 303503614      503515        syn-C2H3C(O)NH2, v=0
  499862.6505  0.0062 -3.6993 3  599.2991101  71510 303503615      503516        syn-C2H3C(O)NH2, v=0
  499881.7403  0.0043 -3.3145 3  649.9492145  71510 303721062      711161        syn-C2H3C(O)NH2, v=0
  499881.7452  0.0043 -5.3290 3  649.9492145  71510 303721162      711161        syn-C2H3C(O)NH2, v=0
  499881.7496  0.0043 -5.3290 3  649.9492145  71510 303721062      711061        syn-C2H3C(O)NH2, v=0
  499881.7545  0.0043 -3.3145 3  649.9492145  71510 303721162      711061        syn-C2H3C(O)NH2, v=0
  499891.3130  0.0048 -5.8281 3  828.3637137  71510 303683434      673433        syn-C2H3C(O)NH2, v=0
  499891.3130  0.0048 -5.8281 3  828.3637137  71510 303683435      673434        syn-C2H3C(O)NH2, v=0
  499928.3564  0.0030 -5.4581 3  679.0234135  71510 303672444      662443        syn-C2H3C(O)NH2, v=0
  499928.4843  0.0030 -5.4581 3  679.0234135  71510 303672443      662442        syn-C2H3C(O)NH2, v=0
  499949.2281  0.0026 -5.3330 3  624.4992133  71510 303662046      652045        syn-C2H3C(O)NH2, v=0
  500030.4180  0.0644 -5.8034 3 1921.8968227  71510 303B33974      B33875        syn-C2H3C(O)NH2, v=0
  500030.4277  0.0644 -5.8034 3 1921.8968227  71510 303B33975      B33876        syn-C2H3C(O)NH2, v=0
  500034.6602  0.0063 -3.7007 3  587.1122 99  71510 303493613      493514        syn-C2H3C(O)NH2, v=0
  500034.6602  0.0063 -3.7007 3  587.1122 99  71510 303493614      493515        syn-C2H3C(O)NH2, v=0
  500047.8258  0.0156 -4.4821 3 1199.0341171  71510 303853748      853649        syn-C2H3C(O)NH2, v=0
  500047.8258  0.0156 -4.4821 3 1199.0341171  71510 303853749      853650        syn-C2H3C(O)NH2, v=0
  500197.7356  0.0064 -3.7046 3  575.1718 97  71510 303483612      483513        syn-C2H3C(O)NH2, v=0
  500197.7356  0.0064 -3.7046 3  575.1718 97  71510 303483613      483514        syn-C2H3C(O)NH2, v=0
  500260.5648  0.0040 -3.3433 3  643.8879143  71510 303711160      701259        syn-C2H3C(O)NH2, v=0
  500260.7014  0.0040 -5.3236 3  643.8879143  71510 303711260      701259        syn-C2H3C(O)NH2, v=0
  500260.8141  0.0040 -5.3236 3  643.8879143  71510 303711160      701159        syn-C2H3C(O)NH2, v=0
  500260.9507  0.0040 -3.3433 3  643.8879143  71510 303711260      701159        syn-C2H3C(O)NH2, v=0
  500313.4250  0.1371 -5.8185 3 1892.1127241  71510 303C02199      C020A0        syn-C2H3C(O)NH2, v=0
  500313.4280  0.1371 -5.8185 3 1892.1127241  71510 303C02299      C021A0        syn-C2H3C(O)NH2, v=0
  500325.6635  0.0048 -4.9196 3  231.3853 85  71510 30342 933      42 636        syn-C2H3C(O)NH2, v=0
  500352.2202  0.0065 -3.7116 3  563.4778 95  71510 303473611      473512        syn-C2H3C(O)NH2, v=0
  500352.2202  0.0065 -3.7116 3  563.4778 95  71510 303473612      473513        syn-C2H3C(O)NH2, v=0
  500364.7966  0.0045 -5.7866 3  812.8226137  71510 303683335      673334        syn-C2H3C(O)NH2, v=0
  500364.7966  0.0045 -5.7866 3  812.8226137  71510 303683336      673335        syn-C2H3C(O)NH2, v=0
  500370.1044  0.0351 -5.1723 3 1585.0941203  71510 303A13863      A13764        syn-C2H3C(O)NH2, v=0
  500370.1044  0.0351 -5.1723 3 1585.0941203  71510 303A13864      A13765        syn-C2H3C(O)NH2, v=0
  500415.5070  0.0487 -4.8804 3 1340.4496209  71510 303A41391      A41292        syn-C2H3C(O)NH2, v=0
  500415.5070  0.0487 -4.8804 3 1340.4496209  71510 303A41491      A41392        syn-C2H3C(O)NH2, v=0
  500498.4491  0.0066 -3.7219 3  552.0300 93  71510 303463610      463511        syn-C2H3C(O)NH2, v=0
  500498.4491  0.0066 -3.7219 3  552.0300 93  71510 303463611      463512        syn-C2H3C(O)NH2, v=0
  500617.3760  0.0023 -5.0134 3  175.4770 69  71510 303341421      341124        syn-C2H3C(O)NH2, v=0
  500636.7489  0.0068 -3.7363 3  540.8284 91  71510 3034536 9      453510        syn-C2H3C(O)NH2, v=0
  500636.7489  0.0068 -3.7363 3  540.8284 91  71510 303453610      453511        syn-C2H3C(O)NH2, v=0
  500640.9869  0.0058 -4.6168 3  497.5038119  71510 303591841      591544        syn-C2H3C(O)NH2, v=0
  500720.0309  0.0015 -2.6423 3  187.3139 51  71510 3032523 2      2422 3        syn-C2H3C(O)NH2, v=0
  500720.0309  0.0015 -2.6423 3  187.3139 51  71510 3032523 3      2422 2        syn-C2H3C(O)NH2, v=0
  500749.0521  0.0329 -4.4222 3  816.3959175  71510 30387 384      87 285        syn-C2H3C(O)NH2, v=0
  500749.0521  0.0329 -4.4222 3  816.3959175  71510 30387 484      87 385        syn-C2H3C(O)NH2, v=0
  500767.4375  0.0069 -3.7553 3  529.8726 89  71510 3034436 8      4435 9        syn-C2H3C(O)NH2, v=0
  500767.4375  0.0069 -3.7553 3  529.8726 89  71510 3034436 9      443510        syn-C2H3C(O)NH2, v=0
  500780.0016  0.0150 -4.4457 3 1178.0985169  71510 303843747      843648        syn-C2H3C(O)NH2, v=0
  500780.0016  0.0150 -4.4457 3 1178.0985169  71510 303843748      843649        syn-C2H3C(O)NH2, v=0
  500837.4970  0.0036 -3.3770 3  637.1544141  71510 303701258      691357        syn-C2H3C(O)NH2, v=0
  500840.5602  0.0036 -5.3164 3  637.1544141  71510 303701358      691357        syn-C2H3C(O)NH2, v=0
  500842.9092  0.0036 -5.3164 3  637.1543141  71510 303701258      691257        syn-C2H3C(O)NH2, v=0
  500845.9724  0.0036 -3.3770 3  637.1543141  71510 303701358      691257        syn-C2H3C(O)NH2, v=0
  500881.3370  0.0044 -5.7465 3  797.7739137  71510 303683236      673235        syn-C2H3C(O)NH2, v=0
  500881.3370  0.0044 -5.7465 3  797.7739137  71510 303683237      673236        syn-C2H3C(O)NH2, v=0
  500890.8251  0.0070 -3.7801 3  519.1627 87  71510 3034336 7      4335 8        syn-C2H3C(O)NH2, v=0
  500890.8251  0.0070 -3.7801 3  519.1627 87  71510 3034336 8      4335 9        syn-C2H3C(O)NH2, v=0
  501007.2135  0.0072 -3.8122 3  508.6983 85  71510 3034236 6      4235 7        syn-C2H3C(O)NH2, v=0
  501007.2135  0.0072 -3.8122 3  508.6983 85  71510 3034236 7      4235 8        syn-C2H3C(O)NH2, v=0
  501087.7662  0.0011 -2.9037 3  234.9656 79  71510 303391624      381523        syn-C2H3C(O)NH2, v=0
  501089.7358  0.0011 -2.9037 3  234.9656 79  71510 303391623      381524        syn-C2H3C(O)NH2, v=0
  501116.8968  0.0073 -3.8535 3  498.4793 83  71510 3034136 5      4135 6        syn-C2H3C(O)NH2, v=0
  501116.8968  0.0073 -3.8535 3  498.4793 83  71510 3034136 6      4135 7        syn-C2H3C(O)NH2, v=0
  501137.9745  0.0016 -3.1286 3  285.4072 91  71510 303451432      441331        syn-C2H3C(O)NH2, v=0
  501145.9413  0.0014 -2.6678 3  189.5984 55  71510 3032722 5      2621 6        syn-C2H3C(O)NH2, v=0
  501145.9413  0.0014 -2.6678 3  189.5984 55  71510 3032722 6      2621 5        syn-C2H3C(O)NH2, v=0
  501192.0764  0.0551 -4.9815 3 1405.1286213  71510 303A61492      A61393        syn-C2H3C(O)NH2, v=0
  501192.0764  0.0551 -4.9815 3 1405.1286213  71510 303A61592      A61493        syn-C2H3C(O)NH2, v=0
  501194.4384  0.1202 -5.6864 3 1818.9202237  71510 303B82098      B81999        syn-C2H3C(O)NH2, v=0
  501194.4392  0.1202 -5.6864 3 1818.9202237  71510 303B82198      B82099        syn-C2H3C(O)NH2, v=0
  501220.1613  0.0075 -3.9073 3  488.5057 81  71510 3034036 4      4035 5        syn-C2H3C(O)NH2, v=0
  501220.1613  0.0075 -3.9073 3  488.5057 81  71510 3034036 5      4035 6        syn-C2H3C(O)NH2, v=0
  501298.8539  0.0378 -4.7162 3  729.6769169  71510 30384 183      84 084        syn-C2H3C(O)NH2, v=0
  501298.8539  0.0378 -4.7162 3  729.6769169  71510 30384 283      84 184        syn-C2H3C(O)NH2, v=0
  501317.2859  0.0077 -3.9793 3  478.7772 79  71510 3033936 3      3935 4        syn-C2H3C(O)NH2, v=0
  501317.2859  0.0077 -3.9793 3  478.7772 79  71510 3033936 4      3935 5        syn-C2H3C(O)NH2, v=0
  501394.9802  0.0030 -5.4287 3  668.6381135  71510 303672345      662344        syn-C2H3C(O)NH2, v=0
  501396.3644  0.0030 -5.4287 3  668.6381135  71510 303672344      662343        syn-C2H3C(O)NH2, v=0
  501408.5417  0.0078 -4.0795 3  469.2938 77  71510 3033836 2      3835 3        syn-C2H3C(O)NH2, v=0
  501408.5417  0.0078 -4.0795 3  469.2938 77  71510 3033836 3      3835 4        syn-C2H3C(O)NH2, v=0
  501447.6657  0.0042 -5.7077 3  783.2210137  71510 303683137      673136        syn-C2H3C(O)NH2, v=0
  501447.6657  0.0042 -5.7077 3  783.2210137  71510 303683138      673137        syn-C2H3C(O)NH2, v=0
  501449.3084  0.0341 -4.5695 3 1115.4730195  71510 30397 988      97 889        syn-C2H3C(O)NH2, v=0
  501449.3084  0.0341 -4.5695 3 1115.4730195  71510 303971088      97 989        syn-C2H3C(O)NH2, v=0
  501485.2136  0.0144 -4.4101 3 1157.4177167  71510 303833746      833647        syn-C2H3C(O)NH2, v=0
  501485.2136  0.0144 -4.4101 3 1157.4177167  71510 303833747      833648        syn-C2H3C(O)NH2, v=0
  501494.1925  0.0080 -4.2312 3  460.0552 75  71510 3033736 1      3735 2        syn-C2H3C(O)NH2, v=0
  501494.1925  0.0080 -4.2312 3  460.0552 75  71510 3033736 2      3735 3        syn-C2H3C(O)NH2, v=0
  501543.9042  0.0012 -2.6956 3  193.3581 59  71510 3032921 8      2820 9        syn-C2H3C(O)NH2, v=0
  501543.9042  0.0012 -2.6956 3  193.3581 59  71510 3032921 9      2820 8        syn-C2H3C(O)NH2, v=0
  501557.8196  0.0032 -4.3694 3  114.0699 59  71510 303291020      28 721        syn-C2H3C(O)NH2, v=0
  501569.0101  0.0335 -5.1250 3 1560.0731201  71510 303A03862      A03763        syn-C2H3C(O)NH2, v=0
  501569.0101  0.0335 -5.1250 3 1560.0731201  71510 303A03863      A03764        syn-C2H3C(O)NH2, v=0
  501574.4949  0.0082 -4.5081 3  451.0613 73  71510 3033636 0      3635 1        syn-C2H3C(O)NH2, v=0
  501574.4949  0.0082 -4.5081 3  451.0613 73  71510 3033636 1      3635 2        syn-C2H3C(O)NH2, v=0
  501681.1709  0.0033 -3.4184 3  629.6894139  71510 303691356      681455        syn-C2H3C(O)NH2, v=0
  501700.9919  0.0614 -5.7482 3 1893.7751225  71510 303B23973      B23874        syn-C2H3C(O)NH2, v=0
  501700.9971  0.0614 -5.7482 3 1893.7751225  71510 303B23974      B23875        syn-C2H3C(O)NH2, v=0
  501736.0705  0.0033 -5.3071 3  629.6894139  71510 303691456      681455        syn-C2H3C(O)NH2, v=0
  501762.6362  0.0625 -5.0877 3 1471.0424217  71510 303A81593      A81494        syn-C2H3C(O)NH2, v=0
  501762.6362  0.0625 -5.0877 3 1471.0424217  71510 303A81693      A81594        syn-C2H3C(O)NH2, v=0
  501774.4869  0.0033 -5.3070 3  629.6863139  71510 303691356      681355        syn-C2H3C(O)NH2, v=0
  501801.3960  0.1053 -5.5582 3 1746.9245233  71510 303B61997      B61898        syn-C2H3C(O)NH2, v=0
  501801.3962  0.1053 -5.5582 3 1746.9245233  71510 303B62097      B61998        syn-C2H3C(O)NH2, v=0
  501826.2580  0.0307 -4.4241 3  961.8862185  71510 30392 686      92 587        syn-C2H3C(O)NH2, v=0
  501826.2580  0.0307 -4.4241 3  961.8862185  71510 30392 786      92 687        syn-C2H3C(O)NH2, v=0
  501829.3865  0.0033 -3.4181 3  629.6863139  71510 303691456      681355        syn-C2H3C(O)NH2, v=0
  501886.1897  0.0011 -2.7265 3  198.6057 63  71510 303312011      301912        syn-C2H3C(O)NH2, v=0
  501886.1897  0.0011 -2.7265 3  198.6057 63  71510 303312012      301911        syn-C2H3C(O)NH2, v=0
  501924.2639  0.0010 -2.8477 3  223.4925 75  71510 303371721      361620        syn-C2H3C(O)NH2, v=0
  501924.2841  0.0010 -2.8477 3  223.4925 75  71510 303371720      361621        syn-C2H3C(O)NH2, v=0
  502071.9755  0.0040 -5.6702 3  769.1678137  71510 303683038      673037        syn-C2H3C(O)NH2, v=0
  502071.9755  0.0040 -5.6702 3  769.1678137  71510 303683039      673038        syn-C2H3C(O)NH2, v=0
  502104.8986  0.0030 -4.7634 3  258.5281 85  71510 303421527      421230        syn-C2H3C(O)NH2, v=0
  502118.7684  0.0711 -5.1987 3 1538.1850221  71510 303B01694      B01595        syn-C2H3C(O)NH2, v=0
  502118.7684  0.0711 -5.1987 3 1538.1850221  71510 303B01794      B01695        syn-C2H3C(O)NH2, v=0
  502126.2064  0.0011 -2.7613 3  205.3588 67  71510 303331914      321815        syn-C2H3C(O)NH2, v=0
  502126.2064  0.0011 -2.7613 3  205.3588 67  71510 303331915      321814        syn-C2H3C(O)NH2, v=0
  502143.9308  0.0026 -5.3085 3  616.5613133  71510 303661948      651947        syn-C2H3C(O)NH2, v=0
  502149.2258  0.0923 -5.4341 3 1676.1324229  71510 303B41896      B41797        syn-C2H3C(O)NH2, v=0
  502149.2258  0.0923 -5.4341 3 1676.1324229  71510 303B41996      B41897        syn-C2H3C(O)NH2, v=0
  502164.3409  0.0138 -4.3752 3 1136.9913165  71510 303823745      823646        syn-C2H3C(O)NH2, v=0
  502164.3409  0.0138 -4.3752 3 1136.9913165  71510 303823746      823647        syn-C2H3C(O)NH2, v=0
  502184.9213  0.0010 -2.8011 3  213.6421 71  71510 303351818      341717        syn-C2H3C(O)NH2, v=0
  502184.9214  0.0010 -2.8011 3  213.6421 71  71510 303351817      341718        syn-C2H3C(O)NH2, v=0
  502234.5242  0.0027 -4.6042 3  314.8990 95  71510 303471533      471236        syn-C2H3C(O)NH2, v=0
  502251.1137  0.0810 -5.3142 3 1606.5504225  71510 303B21795      B21696        syn-C2H3C(O)NH2, v=0
  502251.1137  0.0810 -5.3142 3 1606.5504225  71510 303B21895      B21796        syn-C2H3C(O)NH2, v=0
  502284.5480  0.0030 -3.4749 3  621.4104137  71510 303681454      671553        syn-C2H3C(O)NH2, v=0
  502309.2949  0.0025 -3.7756 3  150.1758 69  71510 30334 926      33 627        syn-C2H3C(O)NH2, v=0
  502436.3440  0.0028 -4.5878 3  326.9804 97  71510 303481534      481237        syn-C2H3C(O)NH2, v=0
  502491.3221  0.0017 -3.9179 3  145.6885 67  71510 303331024      32 725        syn-C2H3C(O)NH2, v=0
  502556.1194  0.0023 -4.6474 3   88.8829 53  71510 30326 917      25 620        syn-C2H3C(O)NH2, v=0
  502604.1664  0.0024 -5.2179 3  570.9613129  71510 303641747      631746        syn-C2H3C(O)NH2, v=0
  502666.4476  0.0064 -6.0453 3  116.1985 65  71510 30332 428      32 131        syn-C2H3C(O)NH2, v=0
  502686.3903  0.0064 -6.0452 3  116.1985 65  71510 30332 528      32 231        syn-C2H3C(O)NH2, v=0
  502725.8122  0.0319 -5.0784 3 1535.3120199  71510 303993861      993762        syn-C2H3C(O)NH2, v=0
  502725.8122  0.0319 -5.0784 3 1535.3120199  71510 303993862      993763        syn-C2H3C(O)NH2, v=0
  502754.8104  0.0025 -5.2717 3  602.4670133  71510 303661750      651749        syn-C2H3C(O)NH2, v=0
  502764.3665  0.0039 -5.6339 3  755.6191137  71510 303682939      672938        syn-C2H3C(O)NH2, v=0
  502764.3665  0.0039 -5.6339 3  755.6191137  71510 303682940      672939        syn-C2H3C(O)NH2, v=0
  502818.2289  0.0132 -4.3410 3 1116.8189163  71510 303813744      813645        syn-C2H3C(O)NH2, v=0
  502818.2289  0.0132 -4.3410 3 1116.8189163  71510 303813745      813646        syn-C2H3C(O)NH2, v=0
  502843.7650  0.0024 -3.2392 3  320.9904 97  71510 303481435      471334        syn-C2H3C(O)NH2, v=0
  502896.9414  0.0022 -5.1969 3   63.3606 43  71510 303211012      20 713        syn-C2H3C(O)NH2, v=0
  502917.1262  0.0027 -5.2617 3  593.2290131  71510 303651847      641846        syn-C2H3C(O)NH2, v=0
  502995.1441  0.0374 -4.6469 3 1175.7585199  71510 303991089      99 990        syn-C2H3C(O)NH2, v=0
  502995.1441  0.0374 -4.6469 3 1175.7585199  71510 303991189      991090        syn-C2H3C(O)NH2, v=0
  503048.5955  0.0045 -5.9108 3   51.7637 43  71510 30321 715      20 218        syn-C2H3C(O)NH2, v=0
  503049.1525  0.0030 -5.2952 3  621.4104137  71510 303681554      671553        syn-C2H3C(O)NH2, v=0
  503155.5655  0.0029 -5.4004 3  658.8393135  71510 303672246      662245        syn-C2H3C(O)NH2, v=0
  503168.6438  0.0029 -5.4004 3  658.8398135  71510 303672245      662244        syn-C2H3C(O)NH2, v=0
  503168.9220  0.0013 -3.0929 3  274.0395 89  71510 303441430      431331        syn-C2H3C(O)NH2, v=0
  503212.6547  0.0023 -5.0738 3  166.9741 67  71510 303331419      331122        syn-C2H3C(O)NH2, v=0
  503266.6284  0.0325 -4.4058 3  870.2285179  71510 30389 485      89 386        syn-C2H3C(O)NH2, v=0
  503266.6284  0.0325 -4.4058 3  870.2285179  71510 30389 585      89 486        syn-C2H3C(O)NH2, v=0
  503312.0407  0.0585 -5.6937 3 1865.9181223  71510 303B13972      B13873        syn-C2H3C(O)NH2, v=0
  503312.0434  0.0585 -5.6937 3 1865.9181223  71510 303B13973      B13874        syn-C2H3C(O)NH2, v=0
  503407.3581  0.0018 -3.1612 3  296.9400 93  71510 303461433      451332        syn-C2H3C(O)NH2, v=0
  503447.6913  0.0127 -4.3075 3 1096.9002161  71510 303803743      803644        syn-C2H3C(O)NH2, v=0
  503447.6913  0.0127 -4.3075 3 1096.9002161  71510 303803744      803645        syn-C2H3C(O)NH2, v=0
  503463.1221  0.0026 -4.6256 3  303.0426 93  71510 303461532      461235        syn-C2H3C(O)NH2, v=0
  503521.8558  0.0031 -5.2943 3  621.3691137  71510 303681454      671453        syn-C2H3C(O)NH2, v=0
  503537.4785  0.0038 -5.5990 3  742.5806137  71510 303682840      672839        syn-C2H3C(O)NH2, v=0
  503537.4785  0.0038 -5.5990 3  742.5806137  71510 303682841      672840        syn-C2H3C(O)NH2, v=0
  503599.8737  0.0034 -5.4447 3  150.1758 67  71510 303331122      33 627        syn-C2H3C(O)NH2, v=0
  503615.2116  0.0026 -5.2528 3  595.0743133  71510 303661551      651550        syn-C2H3C(O)NH2, v=0
  503842.0565  0.0305 -5.0325 3 1510.8105197  71510 303983860      983761        syn-C2H3C(O)NH2, v=0
  503842.0565  0.0305 -5.0325 3 1510.8105197  71510 303983861      983762        syn-C2H3C(O)NH2, v=0
  503851.9966  0.0026 -5.2867 3  609.2973133  71510 303661849      651848        syn-C2H3C(O)NH2, v=0
  503881.3325  0.0321 -4.4730 3 1018.9688189  71510 30394 787      94 688        syn-C2H3C(O)NH2, v=0
  503881.3325  0.0321 -4.4730 3 1018.9688189  71510 30394 887      94 788        syn-C2H3C(O)NH2, v=0
  504053.5121  0.0122 -4.2748 3 1077.2350159  71510 303793742      793643        syn-C2H3C(O)NH2, v=0
  504053.5121  0.0122 -4.2748 3 1077.2350159  71510 303793743      793644        syn-C2H3C(O)NH2, v=0
  504064.0747  0.0021 -3.1983 3  308.7985 95  71510 303471434      461333        syn-C2H3C(O)NH2, v=0
  504103.1717  0.0364 -4.5192 3  781.5185173  71510 30386 284      86 185        syn-C2H3C(O)NH2, v=0
  504103.1717  0.0364 -4.5192 3  781.5185173  71510 30386 384      86 285        syn-C2H3C(O)NH2, v=0
  504107.1501  0.1152 -6.0230 3 1671.4532219  71510 303A92981      A83078        syn-C2H3C(O)NH2, v=0
  504179.7550  0.0023 -5.0725 3  166.9418 67  71510 303331420      331123        syn-C2H3C(O)NH2, v=0
  504246.6984  0.0028 -5.2815 3  612.2622135  71510 303671652      661651        syn-C2H3C(O)NH2, v=0
  504286.4604  0.0031 -3.4713 3  621.3691137  71510 303681554      671453        syn-C2H3C(O)NH2, v=0
  504294.1166  0.0030 -4.5770 3  339.2800 99  71510 303491535      491238        syn-C2H3C(O)NH2, v=0
  504364.0856  0.0415 -4.7315 3 1237.3016203  71510 303A11190      A11091        syn-C2H3C(O)NH2, v=0
  504364.0856  0.0415 -4.7315 3 1237.3016203  71510 303A11290      A11191        syn-C2H3C(O)NH2, v=0
  504380.0723  0.0151 -4.7116 3  768.8419149  71510 303742054      741757        syn-C2H3C(O)NH2, v=0
  504407.4180  0.0037 -5.5652 3  730.0594137  71510 303682742      672741        syn-C2H3C(O)NH2, v=0
  504407.4181  0.0037 -5.5652 3  730.0594137  71510 303682741      672740        syn-C2H3C(O)NH2, v=0
  504411.5893  0.0083 -3.8680 3  695.8515143  71510 303711754      701853        syn-C2H3C(O)NH2, v=0
  504415.6415  0.0039 -4.6775 3  333.5162 97  71510 303481632      481335        syn-C2H3C(O)NH2, v=0
  504585.6800  0.0033 -4.4882 3  106.7200 57  71510 303281019      27 720        syn-C2H3C(O)NH2, v=0
  504622.9103  0.0028 -5.3045 3  616.6996133  71510 303661947      651946        syn-C2H3C(O)NH2, v=0
  504636.4475  0.0118 -4.2428 3 1057.8228157  71510 303783741      783642        syn-C2H3C(O)NH2, v=0
  504636.4475  0.0118 -4.2428 3 1057.8228157  71510 303783742      783643        syn-C2H3C(O)NH2, v=0
  504780.9076  0.0022 -5.1955 3   63.2978 43  71510 303211011      20 714        syn-C2H3C(O)NH2, v=0
  504866.1123  0.0558 -5.6399 3 1838.3252221  71510 303B03971      B03872        syn-C2H3C(O)NH2, v=0
  504866.1137  0.0558 -5.6399 3 1838.3252221  71510 303B03972      B03873        syn-C2H3C(O)NH2, v=0
  504919.2091  0.0291 -4.9873 3 1486.5680195  71510 303973859      973760        syn-C2H3C(O)NH2, v=0
  504919.2091  0.0291 -4.9873 3 1486.5680195  71510 303973860      973761        syn-C2H3C(O)NH2, v=0
  504925.1075  0.0040 -4.7122 3  286.2001 93  71510 303461235      46 938        syn-C2H3C(O)NH2, v=0
  504949.4662  0.0065 -4.6340 3  583.3314129  71510 303641945      641648        syn-C2H3C(O)NH2, v=0
  505014.6058  0.0048 -3.7044 3  653.4558139  71510 303691653      681752        syn-C2H3C(O)NH2, v=0
  505166.7275  0.0033 -3.5664 3  629.0820137  71510 303681553      671652        syn-C2H3C(O)NH2, v=0
  505197.2268  0.0113 -4.2116 3 1038.6635155  71510 303773740      773641        syn-C2H3C(O)NH2, v=0
  505197.2268  0.0113 -4.2116 3 1038.6635155  71510 303773741      773642        syn-C2H3C(O)NH2, v=0
  505303.1086  0.0029 -5.3730 3  649.6596135  71510 303672147      662146        syn-C2H3C(O)NH2, v=0
  505303.1411  0.0064 -5.3519 3  690.5479159  71510 30379 475      78 474        syn-C2H3C(O)NH2, v=0
  505303.1411  0.0064 -3.2030 3  690.5479159  71510 30379 475      78 574        syn-C2H3C(O)NH2, v=0
  505303.1411  0.0064 -3.2030 3  690.5479159  71510 30379 575      78 474        syn-C2H3C(O)NH2, v=0
  505303.1411  0.0064 -5.3519 3  690.5479159  71510 30379 575      78 574        syn-C2H3C(O)NH2, v=0
  505304.6071  0.0069 -5.3487 3  692.6253161  71510 30380 377      79 376        syn-C2H3C(O)NH2, v=0
  505304.6071  0.0069 -3.1847 3  692.6253161  71510 30380 377      79 476        syn-C2H3C(O)NH2, v=0
  505304.6071  0.0069 -3.1847 3  692.6253161  71510 30380 477      79 376        syn-C2H3C(O)NH2, v=0
  505304.6071  0.0069 -5.3487 3  692.6253161  71510 30380 477      79 476        syn-C2H3C(O)NH2, v=0
  505312.9555  0.0077 -5.3444 3  694.1831163  71510 30381 279      80 278        syn-C2H3C(O)NH2, v=0
  505312.9555  0.0077 -3.1665 3  694.1831163  71510 30381 279      80 378        syn-C2H3C(O)NH2, v=0
  505312.9555  0.0077 -3.1665 3  694.1831163  71510 30381 379      80 278        syn-C2H3C(O)NH2, v=0
  505312.9555  0.0077 -5.3444 3  694.1831163  71510 30381 379      80 378        syn-C2H3C(O)NH2, v=0
  505313.4638  0.0061 -5.3540 3  687.9435157  71510 30378 573      77 572        syn-C2H3C(O)NH2, v=0
  505313.4638  0.0061 -3.2216 3  687.9435157  71510 30378 573      77 672        syn-C2H3C(O)NH2, v=0
  505313.4638  0.0061 -3.2216 3  687.9435157  71510 30378 673      77 572        syn-C2H3C(O)NH2, v=0
  505313.4638  0.0061 -5.3540 3  687.9435157  71510 30378 673      77 672        syn-C2H3C(O)NH2, v=0
  505324.4577  0.0091 -5.3392 3  695.2274165  71510 30382 181      81 180        syn-C2H3C(O)NH2, v=0
  505324.4577  0.0091 -3.1483 3  695.2274165  71510 30382 181      81 280        syn-C2H3C(O)NH2, v=0
  505324.4577  0.0091 -3.1483 3  695.2274165  71510 30382 281      81 180        syn-C2H3C(O)NH2, v=0
  505324.4577  0.0091 -5.3392 3  695.2274165  71510 30382 281      81 280        syn-C2H3C(O)NH2, v=0
  505336.2459  0.0111 -5.3330 3  695.7633167  71510 30383 083      82 082        syn-C2H3C(O)NH2, v=0
  505336.2459  0.0111 -3.1301 3  695.7633167  71510 30383 083      82 182        syn-C2H3C(O)NH2, v=0
  505336.2459  0.0111 -3.1301 3  695.7633167  71510 30383 183      82 082        syn-C2H3C(O)NH2, v=0
  505336.2459  0.0111 -5.3330 3  695.7633167  71510 30383 183      82 182        syn-C2H3C(O)NH2, v=0
  505342.1237  0.0059 -5.3551 3  684.8032155  71510 30377 671      76 670        syn-C2H3C(O)NH2, v=0
  505342.1237  0.0059 -3.2408 3  684.8032155  71510 30377 671      76 770        syn-C2H3C(O)NH2, v=0
  505342.1237  0.0059 -3.2408 3  684.8032155  71510 30377 771      76 670        syn-C2H3C(O)NH2, v=0
  505342.1237  0.0059 -5.3551 3  684.8032155  71510 30377 771      76 770        syn-C2H3C(O)NH2, v=0
  505395.1646  0.0036 -5.5327 3  718.0642137  71510 303682643      672642        syn-C2H3C(O)NH2, v=0
  505395.1662  0.0036 -5.5327 3  718.0642137  71510 303682642      672641        syn-C2H3C(O)NH2, v=0
  505398.0115  0.0057 -5.3551 3  681.1163153  71510 30376 769      75 768        syn-C2H3C(O)NH2, v=0
  505398.0115  0.0057 -3.2607 3  681.1163153  71510 30376 769      75 868        syn-C2H3C(O)NH2, v=0
  505398.0115  0.0057 -3.2607 3  681.1163153  71510 30376 869      75 768        syn-C2H3C(O)NH2, v=0
  505398.0115  0.0057 -5.3551 3  681.1163153  71510 30376 869      75 868        syn-C2H3C(O)NH2, v=0
  505409.0947  0.0030 -5.3728 3  649.6642135  71510 303672146      662145        syn-C2H3C(O)NH2, v=0
  505486.8546  0.0022 -5.1997 3  566.4701129  71510 303641648      631647        syn-C2H3C(O)NH2, v=0
  505493.4508  0.0054 -5.3538 3  676.8693151  71510 30375 867      74 866        syn-C2H3C(O)NH2, v=0
  505493.4508  0.0054 -3.2817 3  676.8693151  71510 30375 867      74 966        syn-C2H3C(O)NH2, v=0
  505493.4508  0.0054 -3.2817 3  676.8693151  71510 30375 967      74 866        syn-C2H3C(O)NH2, v=0
  505493.4508  0.0054 -5.3538 3  676.8693151  71510 30375 967      74 966        syn-C2H3C(O)NH2, v=0
  505533.2899  0.0012 -2.9888 3  258.4127 85  71510 303421528      411427        syn-C2H3C(O)NH2, v=0
  505550.6573  0.0463 -4.8225 3 1300.0969207  71510 303A31291      A31192        syn-C2H3C(O)NH2, v=0
  505550.6573  0.0463 -4.8225 3 1300.0969207  71510 303A31391      A31292        syn-C2H3C(O)NH2, v=0
  505580.7500  0.0040 -4.6449 3  315.4233 97  71510 303481336      481039        syn-C2H3C(O)NH2, v=0
  505635.4035  0.0326 -4.4202 3  925.3504183  71510 30391 586      91 487        syn-C2H3C(O)NH2, v=0
  505635.4035  0.0326 -4.4202 3  925.3504183  71510 30391 686      91 587        syn-C2H3C(O)NH2, v=0
  505645.9719  0.0051 -3.3042 3  672.0455149  71510 30374 965      731064        syn-C2H3C(O)NH2, v=0
  505645.9720  0.0051 -5.3513 3  672.0455149  71510 303741065      731064        syn-C2H3C(O)NH2, v=0
  505645.9721  0.0051 -5.3513 3  672.0455149  71510 30374 965      73 964        syn-C2H3C(O)NH2, v=0
  505645.9721  0.0051 -3.3042 3  672.0455149  71510 303741065      73 964        syn-C2H3C(O)NH2, v=0
  505689.8784  0.1630 -6.0043 3 1995.6363247  71510 303C322A1      C321A2        syn-C2H3C(O)NH2, v=0
  505689.8843  0.1630 -6.0043 3 1995.6363247  71510 303C323A1      C322A2        syn-C2H3C(O)NH2, v=0
  505736.5546  0.0109 -4.1812 3 1019.7566153  71510 303763739      763640        syn-C2H3C(O)NH2, v=0
  505736.5546  0.0109 -4.1812 3 1019.7566153  71510 303763740      763641        syn-C2H3C(O)NH2, v=0
  505742.9910  0.0012 -2.9885 3  258.4068 85  71510 303421527      411428        syn-C2H3C(O)NH2, v=0
  505775.4500  0.0341 -4.5337 3 1077.3253193  71510 30396 888      96 789        syn-C2H3C(O)NH2, v=0
  505775.4500  0.0341 -4.5337 3 1077.3253193  71510 30396 988      96 889        syn-C2H3C(O)NH2, v=0
  505796.0427  0.0063 -6.0180 3  912.0233139  71510 303693831      683830        syn-C2H3C(O)NH2, v=0
  505796.0427  0.0063 -6.0180 3  912.0233139  71510 303693832      683831        syn-C2H3C(O)NH2, v=0
  505869.5282  0.0025 -4.6513 3  291.4185 91  71510 303451531      451234        syn-C2H3C(O)NH2, v=0
  505881.3492  0.0048 -3.3289 3  666.6235147  71510 303731063      721162        syn-C2H3C(O)NH2, v=0
  505881.3519  0.0048 -5.3474 3  666.6235147  71510 303731163      721162        syn-C2H3C(O)NH2, v=0
  505881.3542  0.0048 -5.3474 3  666.6235147  71510 303731063      721062        syn-C2H3C(O)NH2, v=0
  505881.3568  0.0048 -3.3289 3  666.6235147  71510 303731163      721062        syn-C2H3C(O)NH2, v=0
  505958.6624  0.0278 -4.9428 3 1462.5841193  71510 303963858      963759        syn-C2H3C(O)NH2, v=0
  505958.6624  0.0278 -4.9428 3 1462.5841193  71510 303963859      963760        syn-C2H3C(O)NH2, v=0
  506159.7897  0.0060 -5.9713 3  894.5490139  71510 303693732      683731        syn-C2H3C(O)NH2, v=0
  506159.7897  0.0060 -5.9713 3  894.5490139  71510 303693733      683732        syn-C2H3C(O)NH2, v=0
  506239.0922  0.0044 -3.3566 3  660.5748145  71510 303721161      711260        syn-C2H3C(O)NH2, v=0
  506239.1667  0.0044 -5.3420 3  660.5748145  71510 303721261      711260        syn-C2H3C(O)NH2, v=0
  506239.2288  0.0044 -5.3420 3  660.5748145  71510 303721161      711160        syn-C2H3C(O)NH2, v=0
  506239.3032  0.0044 -3.3566 3  660.5748145  71510 303721261      711160        syn-C2H3C(O)NH2, v=0
  506255.1118  0.0106 -4.1516 3 1001.1020151  71510 303753738      753639        syn-C2H3C(O)NH2, v=0
  506255.1118  0.0106 -4.1516 3 1001.1020151  71510 303753739      753640        syn-C2H3C(O)NH2, v=0
  506342.0319  0.0065 -5.2102 3   75.9452 51  71510 30325 718      24 421        syn-C2H3C(O)NH2, v=0
  506365.5893  0.0532 -5.5868 3 1810.9960219  71510 303A93970      A93871        syn-C2H3C(O)NH2, v=0
  506365.5900  0.0532 -5.5868 3 1810.9960219  71510 303A93971      A93872        syn-C2H3C(O)NH2, v=0
  506528.7981  0.0035 -5.5014 3  706.6060137  71510 303682544      672543        syn-C2H3C(O)NH2, v=0
  506528.8195  0.0035 -5.5014 3  706.6060137  71510 303682543      672542        syn-C2H3C(O)NH2, v=0
  506548.8545  0.0520 -4.9194 3 1364.1387211  71510 303A51392      A51293        syn-C2H3C(O)NH2, v=0
  506548.8545  0.0520 -4.9194 3 1364.1387211  71510 303A51492      A51393        syn-C2H3C(O)NH2, v=0
  506550.2692  0.0057 -5.9260 3  877.5587139  71510 303693633      683632        syn-C2H3C(O)NH2, v=0
  506550.2692  0.0057 -5.9260 3  877.5587139  71510 303693634      683633        syn-C2H3C(O)NH2, v=0
  506668.5393  0.0041 -4.8004 3  258.1826 89  71510 303441134      44 837        syn-C2H3C(O)NH2, v=0
  506753.5566  0.0102 -4.1227 3  982.6993149  71510 303743737      743638        syn-C2H3C(O)NH2, v=0
  506753.5566  0.0102 -4.1227 3  982.6993149  71510 303743738      743639        syn-C2H3C(O)NH2, v=0
  506759.5418  0.0023 -5.0903 3   68.6592 45  71510 303221013      21 714        syn-C2H3C(O)NH2, v=0
  506765.7881  0.0355 -4.4501 3  834.6594177  71510 30388 385      88 286        syn-C2H3C(O)NH2, v=0
  506765.7881  0.0355 -4.4501 3  834.6594177  71510 30388 485      88 386        syn-C2H3C(O)NH2, v=0
  506781.7653  0.0041 -3.3887 3  653.8607143  71510 303711259      701358        syn-C2H3C(O)NH2, v=0
  506783.4895  0.0041 -5.3348 3  653.8607143  71510 303711359      701358        syn-C2H3C(O)NH2, v=0
  506784.8284  0.0041 -5.3348 3  653.8606143  71510 303711259      701258        syn-C2H3C(O)NH2, v=0
  506786.5527  0.0041 -3.3887 3  653.8606143  71510 303711359      701258        syn-C2H3C(O)NH2, v=0
  506790.5896  0.1433 -5.8671 3 1920.6453243  71510 303C121A0      C120A1        syn-C2H3C(O)NH2, v=0
  506790.5913  0.1433 -5.8671 3 1920.6453243  71510 303C122A0      C121A1        syn-C2H3C(O)NH2, v=0
  506829.7162  0.0019 -3.2370 3  280.0339 91  71510 303451332      441233        syn-C2H3C(O)NH2, v=0
  506932.0092  0.0023 -5.1361 3  158.6912 65  71510 303321418      321121        syn-C2H3C(O)NH2, v=0
  506958.1365  0.0040 -3.4513 3  447.7525115  71510 303571543      561442        syn-C2H3C(O)NH2, v=0
  506961.7407  0.0266 -4.8990 3 1438.8583191  71510 303953857      953758        syn-C2H3C(O)NH2, v=0
  506961.7407  0.0266 -4.8990 3 1438.8583191  71510 303953858      953759        syn-C2H3C(O)NH2, v=0
  506971.0492  0.0055 -5.8821 3  861.0544139  71510 303693534      683533        syn-C2H3C(O)NH2, v=0
  506971.0492  0.0055 -5.8821 3  861.0544139  71510 303693535      683534        syn-C2H3C(O)NH2, v=0
  507179.5618  0.0059 -5.6793 3  136.6862 69  71510 30334 529      34 232        syn-C2H3C(O)NH2, v=0
  507232.5265  0.0099 -4.0947 3  964.5483147  71510 303733736      733637        syn-C2H3C(O)NH2, v=0
  507232.5265  0.0099 -4.0947 3  964.5483147  71510 303733737      733638        syn-C2H3C(O)NH2, v=0
  507268.0048  0.0059 -5.6792 3  136.6862 69  71510 30334 629      34 332        syn-C2H3C(O)NH2, v=0
  507318.2244  0.0405 -4.7420 3  746.9356171  71510 30385 184      85 085        syn-C2H3C(O)NH2, v=0
  507318.2244  0.0405 -4.7420 3  746.9356171  71510 30385 284      85 185        syn-C2H3C(O)NH2, v=0
  507352.0745  0.0586 -5.0218 3 1429.4214215  71510 303A71493      A71394        syn-C2H3C(O)NH2, v=0
  507352.0745  0.0586 -5.0218 3 1429.4214215  71510 303A71593      A71494        syn-C2H3C(O)NH2, v=0
  507426.3226  0.0052 -5.8396 3  845.0382139  71510 303693435      683434        syn-C2H3C(O)NH2, v=0
  507426.3226  0.0052 -5.8396 3  845.0382139  71510 303693436      683435        syn-C2H3C(O)NH2, v=0
  507450.5052  0.0023 -5.1353 3  158.6739 65  71510 303321419      321122        syn-C2H3C(O)NH2, v=0
  507504.5414  0.0368 -4.6040 3 1136.9503197  71510 30398 989      98 890        syn-C2H3C(O)NH2, v=0
  507504.5414  0.0368 -4.6040 3 1136.9503197  71510 303981089      98 990        syn-C2H3C(O)NH2, v=0
  507562.1204  0.0017 -2.6194 3  192.0908 49  71510 3032424 0      2323 1        syn-C2H3C(O)NH2, v=0
  507562.1204  0.0017 -2.6194 3  192.0908 49  71510 3032424 1      2323 0        syn-C2H3C(O)NH2, v=0
  507588.2660  0.0037 -3.4277 3  646.4255141  71510 303701357      691456        syn-C2H3C(O)NH2, v=0
  507589.1417  0.0048 -5.0475 3  205.8238 81  71510 30340 832      40 535        syn-C2H3C(O)NH2, v=0
  507591.3490  0.0032 -4.5993 3   99.6353 55  71510 303271018      26 719        syn-C2H3C(O)NH2, v=0
  507608.3818  0.1259 -5.7338 3 1846.8450239  71510 303B92099      B919A0        syn-C2H3C(O)NH2, v=0
  507608.3822  0.1259 -5.7338 3 1846.8450239  71510 303B92199      B920A0        syn-C2H3C(O)NH2, v=0
  507620.3357  0.0037 -5.3256 3  646.4255141  71510 303701457      691456        syn-C2H3C(O)NH2, v=0
  507643.1656  0.0037 -5.3255 3  646.4237141  71510 303701357      691356        syn-C2H3C(O)NH2, v=0
  507674.3348  0.0044 -5.0214 3   84.8815 59  71510 30329 227      28 128        syn-C2H3C(O)NH2, v=0
  507674.6107  0.0044 -5.0214 3   84.8815 59  71510 30329 327      28 028        syn-C2H3C(O)NH2, v=0
  507675.2353  0.0037 -3.4276 3  646.4237141  71510 303701457      691356        syn-C2H3C(O)NH2, v=0
  507692.6382  0.0096 -4.0674 3  946.6486145  71510 303723735      723636        syn-C2H3C(O)NH2, v=0
  507692.6382  0.0096 -4.0674 3  946.6486145  71510 303723736      723637        syn-C2H3C(O)NH2, v=0
  507812.7046  0.0508 -5.5343 3 1783.9297217  71510 303A83969      A83870        syn-C2H3C(O)NH2, v=0
  507812.7049  0.0508 -5.5343 3 1783.9297217  71510 303A83970      A83871        syn-C2H3C(O)NH2, v=0
  507847.1713  0.0034 -5.4711 3  695.6993137  71510 303682445      672444        syn-C2H3C(O)NH2, v=0
  507847.4224  0.0034 -5.4711 3  695.6993137  71510 303682444      672443        syn-C2H3C(O)NH2, v=0
  507852.2798  0.0333 -4.4553 3  981.7566187  71510 30393 687      93 588        syn-C2H3C(O)NH2, v=0
  507852.2798  0.0333 -4.4553 3  981.7566187  71510 30393 787      93 688        syn-C2H3C(O)NH2, v=0
  507867.9667  0.0030 -5.3465 3  641.1404135  71510 303672048      662047        syn-C2H3C(O)NH2, v=0
  507921.0548  0.0050 -5.7984 3  829.5129139  71510 303693336      683335        syn-C2H3C(O)NH2, v=0
  507921.0548  0.0050 -5.7984 3  829.5129139  71510 303693337      683336        syn-C2H3C(O)NH2, v=0
  507925.5255  0.0011 -2.9138 3  244.6495 81  71510 303401625      391524        syn-C2H3C(O)NH2, v=0
  507929.7047  0.0254 -4.8559 3 1415.3903189  71510 303943856      943757        syn-C2H3C(O)NH2, v=0
  507929.7047  0.0254 -4.8559 3 1415.3903189  71510 303943857      943758        syn-C2H3C(O)NH2, v=0
  507929.8122  0.0011 -2.9138 3  244.6494 81  71510 303401624      391525        syn-C2H3C(O)NH2, v=0
  507953.0381  0.0664 -5.1292 3 1495.9392219  71510 303A91594      A91495        syn-C2H3C(O)NH2, v=0
  507953.0381  0.0664 -5.1292 3 1495.9392219  71510 303A91694      A91595        syn-C2H3C(O)NH2, v=0
  507991.8478  0.0032 -4.5722 3  351.7920101  71510 303501536      501239        syn-C2H3C(O)NH2, v=0
  507997.3301  0.0015 -2.6435 3  193.4018 53  71510 3032623 3      2522 4        syn-C2H3C(O)NH2, v=0
  507997.3301  0.0015 -2.6435 3  193.4018 53  71510 3032623 4      2522 3        syn-C2H3C(O)NH2, v=0
  508031.4905  0.0072 -5.8960 3  125.5785 63  71510 30331 922      31 427        syn-C2H3C(O)NH2, v=0
  508134.4896  0.0094 -4.0410 3  929.0001143  71510 303713734      713635        syn-C2H3C(O)NH2, v=0
  508134.4896  0.0094 -4.0410 3  929.0001143  71510 303713735      713636        syn-C2H3C(O)NH2, v=0
  508143.6777  0.0029 -5.2738 3  611.8731135  71510 303671552      661551        syn-C2H3C(O)NH2, v=0
  508159.2652  0.1107 -5.6045 3 1774.2424235  71510 303B71998      B71899        syn-C2H3C(O)NH2, v=0
  508159.2654  0.1107 -5.6045 3 1774.2424235  71510 303B72098      B71999        syn-C2H3C(O)NH2, v=0
  508343.6951  0.0753 -5.2414 3 1563.6863223  71510 303B11695      B11596        syn-C2H3C(O)NH2, v=0
  508343.6951  0.0753 -5.2414 3 1563.6863223  71510 303B11795      B11696        syn-C2H3C(O)NH2, v=0
  508406.0828  0.0034 -3.4795 3  638.1903139  71510 303691455      681554        syn-C2H3C(O)NH2, v=0
  508416.8640  0.0014 -2.6694 3  196.1815 57  71510 3032822 6      2721 7        syn-C2H3C(O)NH2, v=0
  508416.8640  0.0014 -2.6694 3  196.1815 57  71510 3032822 7      2721 6        syn-C2H3C(O)NH2, v=0
  508457.3442  0.0972 -5.4792 3 1702.8441231  71510 303B51897      B51798        syn-C2H3C(O)NH2, v=0
  508457.3442  0.0972 -5.4792 3 1702.8441231  71510 303B51997      B51898        syn-C2H3C(O)NH2, v=0
  508461.1773  0.0048 -5.7586 3  814.4815139  71510 303693237      683236        syn-C2H3C(O)NH2, v=0
  508461.1773  0.0048 -5.7586 3  814.4815139  71510 303693238      683237        syn-C2H3C(O)NH2, v=0
  508515.1130  0.0855 -5.3581 3 1632.6567227  71510 303B31796      B31697        syn-C2H3C(O)NH2, v=0
  508515.1130  0.0855 -5.3581 3 1632.6567227  71510 303B31896      B31797        syn-C2H3C(O)NH2, v=0
  508533.4506  0.0015 -3.8415 3  154.0582 69  71510 303341025      33 726        syn-C2H3C(O)NH2, v=0
  508558.6604  0.0091 -4.0155 3  911.6025141  71510 303703733      703634        syn-C2H3C(O)NH2, v=0
  508558.6604  0.0091 -4.0155 3  911.6025141  71510 303703734      703635        syn-C2H3C(O)NH2, v=0
  508582.2091  0.0030 -5.3453 3  641.1757135  71510 303672047      662046        syn-C2H3C(O)NH2, v=0
  508801.9772  0.0012 -2.6979 3  200.4399 61  71510 3033021 9      292010        syn-C2H3C(O)NH2, v=0
  508801.9772  0.0012 -2.6979 3  200.4399 61  71510 303302110      2920 9        syn-C2H3C(O)NH2, v=0
  508863.7567  0.0243 -4.8135 3 1392.1797187  71510 303933855      933756        syn-C2H3C(O)NH2, v=0
  508863.7567  0.0243 -4.8135 3 1392.1797187  71510 303933856      933757        syn-C2H3C(O)NH2, v=0
  508873.8514  0.0034 -5.3138 3  638.1903139  71510 303691555      681554        syn-C2H3C(O)NH2, v=0
  508948.6282  0.0011 -2.8553 3  232.6312 77  71510 303381722      371621        syn-C2H3C(O)NH2, v=0
  508948.6781  0.0011 -2.8553 3  232.6312 77  71510 303381721      371622        syn-C2H3C(O)NH2, v=0
  508965.7127  0.0089 -3.9908 3  894.4554139  71510 303693732      693633        syn-C2H3C(O)NH2, v=0
  508965.7127  0.0089 -3.9908 3  894.4554139  71510 303693733      693634        syn-C2H3C(O)NH2, v=0
  509053.8462  0.0047 -5.7201 3  799.9475139  71510 303693138      683137        syn-C2H3C(O)NH2, v=0
  509053.8462  0.0047 -5.7201 3  799.9475139  71510 303693139      683138        syn-C2H3C(O)NH2, v=0
  509064.1787  0.0403 -4.6827 3 1197.8384201  71510 303A01090      A0 991        syn-C2H3C(O)NH2, v=0
  509064.1787  0.0403 -4.6827 3 1197.8384201  71510 303A01190      A01091        syn-C2H3C(O)NH2, v=0
  509100.0992  0.0042 -4.9097 3  231.3856 85  71510 303421033      42 736        syn-C2H3C(O)NH2, v=0
  509121.2880  0.0011 -2.7297 3  206.1905 65  71510 303322012      311913        syn-C2H3C(O)NH2, v=0
  509121.2880  0.0011 -2.7297 3  206.1905 65  71510 303322013      311912        syn-C2H3C(O)NH2, v=0
  509170.6873  0.0034 -5.3132 3  638.1648139  71510 303691455      681454        syn-C2H3C(O)NH2, v=0
  509189.8134  0.0025 -4.6808 3  280.0339 89  71510 303441530      441233        syn-C2H3C(O)NH2, v=0
  509209.5542  0.0485 -5.4826 3 1757.1259215  71510 303A73968      A73869        syn-C2H3C(O)NH2, v=0
  509209.5544  0.0485 -5.4826 3 1757.1259215  71510 303A73969      A73870        syn-C2H3C(O)NH2, v=0
  509284.1128  0.0351 -4.4349 3  889.0947181  71510 30390 486      90 387        syn-C2H3C(O)NH2, v=0
  509284.1128  0.0351 -4.4349 3  889.0947181  71510 30390 586      90 487        syn-C2H3C(O)NH2, v=0
  509316.6718  0.0011 -2.8068 3  222.2527 73  71510 303361819      351718        syn-C2H3C(O)NH2, v=0
  509316.6721  0.0011 -2.8068 3  222.2527 73  71510 303361818      351719        syn-C2H3C(O)NH2, v=0
  509322.4139  0.0011 -2.7656 3  213.4524 69  71510 303341915      331816        syn-C2H3C(O)NH2, v=0
  509322.4139  0.0011 -2.7656 3  213.4524 69  71510 303341916      331815        syn-C2H3C(O)NH2, v=0
  509356.1922  0.0087 -3.9670 3  877.5587137  71510 303683731      683632        syn-C2H3C(O)NH2, v=0
  509356.1922  0.0087 -3.9670 3  877.5587137  71510 303683732      683633        syn-C2H3C(O)NH2, v=0
  509390.8750  0.0040 -3.8473 3  145.6064 69  71510 30334 727      33 628        syn-C2H3C(O)NH2, v=0
  509405.9244  0.0034 -5.4419 3  685.3628137  71510 303682346      672345        syn-C2H3C(O)NH2, v=0
  509408.5256  0.0034 -5.4419 3  685.3629137  71510 303682345      672344        syn-C2H3C(O)NH2, v=0
  509578.2905  0.0024 -4.9898 3   74.2485 47  71510 303231014      22 715        syn-C2H3C(O)NH2, v=0
  509613.2722  0.0029 -5.2881 3  619.2370135  71510 303671751      661750        syn-C2H3C(O)NH2, v=0
  509638.4559  0.0034 -3.4773 3  638.1648139  71510 303691555      681454        syn-C2H3C(O)NH2, v=0
  509707.7946  0.0045 -5.6828 3  785.9151139  71510 303693039      683038        syn-C2H3C(O)NH2, v=0
  509707.7946  0.0045 -5.6828 3  785.9151139  71510 303693040      683039        syn-C2H3C(O)NH2, v=0
  509730.6287  0.0085 -3.9441 3  860.9121135  71510 303673730      673631        syn-C2H3C(O)NH2, v=0
  509730.6287  0.0085 -3.9441 3  860.9121135  71510 303673731      673632        syn-C2H3C(O)NH2, v=0
  509765.0442  0.0232 -4.7717 3 1369.2260185  71510 303923854      923755        syn-C2H3C(O)NH2, v=0
  509765.0442  0.0232 -4.7717 3 1369.2260185  71510 303923855      923756        syn-C2H3C(O)NH2, v=0
  509868.4026  0.0054 -5.4133 3  158.4613 73  71510 30336 630      36 333        syn-C2H3C(O)NH2, v=0
  509913.9066  0.0347 -4.5055 3 1039.4417191  71510 30395 788      95 689        syn-C2H3C(O)NH2, v=0
  509913.9066  0.0347 -4.5055 3 1039.4417191  71510 30395 888      95 789        syn-C2H3C(O)NH2, v=0
  509964.8742  0.0030 -4.7022 3   92.8349 53  71510 303261017      25 718        syn-C2H3C(O)NH2, v=0
  510089.5370  0.0083 -3.9221 3  844.5154133  71510 303663729      663630        syn-C2H3C(O)NH2, v=0
  510089.5370  0.0083 -3.9221 3  844.5154133  71510 303663730      663631        syn-C2H3C(O)NH2, v=0
  510119.9575  0.0392 -4.5463 3  799.3802175  71510 30387 285      87 186        syn-C2H3C(O)NH2, v=0
  510119.9575  0.0392 -4.5463 3  799.3802175  71510 30387 385      87 286        syn-C2H3C(O)NH2, v=0
  510153.8102  0.0023 -5.2025 3  150.6817 63  71510 303311417      311120        syn-C2H3C(O)NH2, v=0
  510205.8480  0.0054 -5.4128 3  158.4613 73  71510 30336 730      36 433        syn-C2H3C(O)NH2, v=0
  510228.8873  0.0021 -5.0882 3   68.5435 45  71510 303221012      21 715        syn-C2H3C(O)NH2, v=0
  510245.0388  0.0031 -5.2999 3  629.0820137  71510 303681653      671652        syn-C2H3C(O)NH2, v=0
  510284.2655  0.0050 -5.2088 3  181.5114 77  71510 30338 731      38 434        syn-C2H3C(O)NH2, v=0
  510317.9676  0.0107 -4.7511 3  814.3638153  71510 303762155      761858        syn-C2H3C(O)NH2, v=0
  510363.3514  0.0013 -3.1171 3  285.1624 91  71510 303451431      441332        syn-C2H3C(O)NH2, v=0
  510409.0114  0.0078 -4.6758 3  675.9330139  71510 303692049      691752        syn-C2H3C(O)NH2, v=0
  510423.1266  0.0023 -5.2021 3  150.6727 63  71510 303311418      311121        syn-C2H3C(O)NH2, v=0
  510433.4174  0.0082 -3.9011 3  828.3683131  71510 303653728      653629        syn-C2H3C(O)NH2, v=0
  510433.4174  0.0082 -3.9011 3  828.3683131  71510 303653729      653630        syn-C2H3C(O)NH2, v=0
  510433.8229  0.0044 -5.6469 3  772.3895139  71510 303692940      682939        syn-C2H3C(O)NH2, v=0
  510433.8229  0.0044 -5.6469 3  772.3895139  71510 303692941      682940        syn-C2H3C(O)NH2, v=0
  510448.2632  0.0030 -5.3217 3  633.3110135  71510 303671949      661948        syn-C2H3C(O)NH2, v=0
  510449.5333  0.0445 -4.7685 3 1259.9843205  71510 303A21191      A21092        syn-C2H3C(O)NH2, v=0
  510449.5333  0.0445 -4.7685 3 1259.9843205  71510 303A21291      A21192        syn-C2H3C(O)NH2, v=0
  510507.4011  0.0039 -4.6006 3  345.8381101  71510 303501437      501140        syn-C2H3C(O)NH2, v=0
  510558.1099  0.0463 -5.4316 3 1730.5839213  71510 303A63967      A63868        syn-C2H3C(O)NH2, v=0
  510558.1100  0.0463 -5.4316 3 1730.5839213  71510 303A63968      A63869        syn-C2H3C(O)NH2, v=0
  510634.6638  0.0222 -4.7307 3 1346.5289183  71510 303913853      913754        syn-C2H3C(O)NH2, v=0
  510634.6638  0.0222 -4.7307 3 1346.5289183  71510 303913854      913755        syn-C2H3C(O)NH2, v=0
  510762.7563  0.0080 -3.8811 3  812.4707129  71510 303643727      643628        syn-C2H3C(O)NH2, v=0
  510762.7563  0.0080 -3.8811 3  812.4707129  71510 303643728      643629        syn-C2H3C(O)NH2, v=0
  510936.8680  0.0045 -5.0432 3  205.8239 81  71510 30340 932      40 635        syn-C2H3C(O)NH2, v=0
  510973.7001  0.0030 -5.7893 3   54.8454 43  71510 30321 814      20 317        syn-C2H3C(O)NH2, v=0
  511078.0270  0.0079 -3.8621 3  796.8222127  71510 303633726      633627        syn-C2H3C(O)NH2, v=0
  511078.0270  0.0079 -3.8621 3  796.8222127  71510 303633727      633628        syn-C2H3C(O)NH2, v=0
  511116.6032  0.0026 -4.8937 3   80.1377 49  71510 303241015      23 716        syn-C2H3C(O)NH2, v=0
  511231.0911  0.0028 -4.7991 3   86.3332 51  71510 303251016      24 717        syn-C2H3C(O)NH2, v=0
  511245.5015  0.0042 -5.6121 3  759.3768139  71510 303692841      682840        syn-C2H3C(O)NH2, v=0
  511245.5015  0.0042 -5.6121 3  759.3768139  71510 303692842      682841        syn-C2H3C(O)NH2, v=0
  511284.6965  0.0034 -5.4137 3  675.6228137  71510 303682247      672246        syn-C2H3C(O)NH2, v=0
  511308.1678  0.0034 -5.4137 3  675.6237137  71510 303682246      672245        syn-C2H3C(O)NH2, v=0
  511334.6173  0.0072 -5.3713 3  707.4030161  71510 30380 476      79 475        syn-C2H3C(O)NH2, v=0
  511334.6173  0.0072 -3.2216 3  707.4030161  71510 30380 476      79 575        syn-C2H3C(O)NH2, v=0
  511334.6173  0.0072 -3.2216 3  707.4030161  71510 30380 576      79 475        syn-C2H3C(O)NH2, v=0
  511334.6173  0.0072 -5.3713 3  707.4030161  71510 30380 576      79 575        syn-C2H3C(O)NH2, v=0
  511336.7305  0.0077 -5.3682 3  709.4805163  71510 30381 378      80 377        syn-C2H3C(O)NH2, v=0
  511336.7305  0.0077 -3.2036 3  709.4805163  71510 30381 378      80 477        syn-C2H3C(O)NH2, v=0
  511336.7305  0.0077 -3.2036 3  709.4805163  71510 30381 478      80 377        syn-C2H3C(O)NH2, v=0
  511336.7305  0.0077 -5.3682 3  709.4805163  71510 30381 478      80 477        syn-C2H3C(O)NH2, v=0
  511343.8035  0.0068 -5.3734 3  704.7989159  71510 30379 574      78 573        syn-C2H3C(O)NH2, v=0
  511343.8035  0.0068 -3.2399 3  704.7989159  71510 30379 574      78 673        syn-C2H3C(O)NH2, v=0
  511343.8035  0.0068 -3.2399 3  704.7989159  71510 30379 674      78 573        syn-C2H3C(O)NH2, v=0
  511343.8035  0.0068 -5.3734 3  704.7989159  71510 30379 674      78 673        syn-C2H3C(O)NH2, v=0
  511345.4126  0.0086 -5.3641 3  711.0385165  71510 30382 280      81 279        syn-C2H3C(O)NH2, v=0
  511345.4126  0.0086 -3.1857 3  711.0385165  71510 30382 280      81 379        syn-C2H3C(O)NH2, v=0
  511345.4126  0.0086 -3.1857 3  711.0385165  71510 30382 380      81 279        syn-C2H3C(O)NH2, v=0
  511345.4126  0.0086 -5.3641 3  711.0385165  71510 30382 380      81 379        syn-C2H3C(O)NH2, v=0
  511357.0539  0.0100 -5.3589 3  712.0832167  71510 30383 182      82 181        syn-C2H3C(O)NH2, v=0
  511357.0539  0.0100 -3.1678 3  712.0832167  71510 30383 182      82 281        syn-C2H3C(O)NH2, v=0
  511357.0539  0.0100 -3.1678 3  712.0832167  71510 30383 282      82 181        syn-C2H3C(O)NH2, v=0
  511357.0539  0.0100 -5.3589 3  712.0832167  71510 30383 282      82 281        syn-C2H3C(O)NH2, v=0
  511368.8667  0.0121 -5.3528 3  712.6195169  71510 30384 084      83 083        syn-C2H3C(O)NH2, v=0
  511368.8667  0.0121 -3.1499 3  712.6195169  71510 30384 084      83 183        syn-C2H3C(O)NH2, v=0
  511368.8667  0.0121 -3.1499 3  712.6195169  71510 30384 184      83 083        syn-C2H3C(O)NH2, v=0
  511368.8667  0.0121 -5.3528 3  712.6195169  71510 30384 184      83 183        syn-C2H3C(O)NH2, v=0
  511370.5738  0.0066 -5.3744 3  701.6596157  71510 30378 672      77 671        syn-C2H3C(O)NH2, v=0
  511370.5738  0.0066 -3.2586 3  701.6596157  71510 30378 672      77 771        syn-C2H3C(O)NH2, v=0
  511370.5738  0.0066 -3.2586 3  701.6596157  71510 30378 772      77 671        syn-C2H3C(O)NH2, v=0
  511370.5738  0.0066 -5.3744 3  701.6596157  71510 30378 772      77 771        syn-C2H3C(O)NH2, v=0
  511379.6898  0.0078 -3.8442 3  781.4227125  71510 303623725      623626        syn-C2H3C(O)NH2, v=0
  511379.6898  0.0078 -3.8442 3  781.4227125  71510 303623726      623627        syn-C2H3C(O)NH2, v=0
  511413.7940  0.0049 -5.2072 3  181.5114 77  71510 30338 831      38 534        syn-C2H3C(O)NH2, v=0
  511423.4172  0.0063 -5.3742 3  697.9745155  71510 30377 770      76 769        syn-C2H3C(O)NH2, v=0
  511423.4172  0.0063 -3.2780 3  697.9745155  71510 30377 770      76 869        syn-C2H3C(O)NH2, v=0
  511423.4172  0.0063 -3.2780 3  697.9745155  71510 30377 870      76 769        syn-C2H3C(O)NH2, v=0
  511423.4172  0.0063 -5.3742 3  697.9745155  71510 30377 870      76 869        syn-C2H3C(O)NH2, v=0
  511473.6645  0.0213 -4.6903 3 1324.0880181  71510 303903852      903753        syn-C2H3C(O)NH2, v=0
  511473.6645  0.0213 -4.6903 3 1324.0880181  71510 303903853      903754        syn-C2H3C(O)NH2, v=0
  511514.0313  0.0060 -5.3729 3  693.7308153  71510 30376 868      75 867        syn-C2H3C(O)NH2, v=0
  511514.0313  0.0060 -3.2985 3  693.7308153  71510 30376 868      75 967        syn-C2H3C(O)NH2, v=0
  511514.0313  0.0060 -3.2985 3  693.7308153  71510 30376 968      75 867        syn-C2H3C(O)NH2, v=0
  511514.0313  0.0060 -5.3729 3  693.7308153  71510 30376 968      75 967        syn-C2H3C(O)NH2, v=0
  511623.7232  0.0091 -4.7413 3  794.7433151  71510 303752154      751857        syn-C2H3C(O)NH2, v=0
  511633.4592  0.0029 -5.3013 3  626.1040135  71510 303671850      661849        syn-C2H3C(O)NH2, v=0
  511655.3297  0.0495 -4.8608 3 1323.3826209  71510 303A41292      A41193        syn-C2H3C(O)NH2, v=0
  511655.3297  0.0495 -4.8608 3 1323.3826209  71510 303A41392      A41293        syn-C2H3C(O)NH2, v=0
  511655.3552  0.0352 -4.4507 3  944.8192185  71510 30392 587      92 488        syn-C2H3C(O)NH2, v=0
  511655.3552  0.0352 -4.4507 3  944.8192185  71510 30392 687      92 588        syn-C2H3C(O)NH2, v=0
  511658.9402  0.0057 -3.3203 3  688.9121151  71510 30375 966      741065        syn-C2H3C(O)NH2, v=0
  511658.9403  0.0057 -5.3703 3  688.9121151  71510 30375 966      74 965        syn-C2H3C(O)NH2, v=0
  511658.9403  0.0057 -5.3703 3  688.9121151  71510 303751066      741065        syn-C2H3C(O)NH2, v=0
  511658.9404  0.0057 -3.3203 3  688.9121151  71510 303751066      74 965        syn-C2H3C(O)NH2, v=0
  511668.1930  0.0077 -3.8274 3  766.2719123  71510 303613724      613625        syn-C2H3C(O)NH2, v=0
  511668.1930  0.0077 -3.8274 3  766.2719123  71510 303613725      613626        syn-C2H3C(O)NH2, v=0
  511795.6454  0.0025 -5.2179 3  583.3314131  71510 303651649      641648        syn-C2H3C(O)NH2, v=0
  511816.6541  0.0368 -4.5674 3 1098.4006195  71510 30397 889      97 790        syn-C2H3C(O)NH2, v=0
  511816.6541  0.0368 -4.5674 3 1098.4006195  71510 30397 989      97 890        syn-C2H3C(O)NH2, v=0
  511817.7087  0.0012 -3.0047 3  268.9411 87  71510 303431529      421428        syn-C2H3C(O)NH2, v=0
  511860.2294  0.0442 -5.3812 3 1704.3033211  71510 303A53966      A53867        syn-C2H3C(O)NH2, v=0
  511860.2294  0.0442 -5.3812 3 1704.3033211  71510 303A53967      A53868        syn-C2H3C(O)NH2, v=0
  511882.2323  0.0053 -3.3441 3  683.4979149  71510 303741064      731163        syn-C2H3C(O)NH2, v=0
  511882.2337  0.0053 -5.3663 3  683.4979149  71510 303741164      731163        syn-C2H3C(O)NH2, v=0
  511882.2349  0.0053 -5.3663 3  683.4979149  71510 303741064      731063        syn-C2H3C(O)NH2, v=0
  511882.2363  0.0053 -3.3441 3  683.4979149  71510 303741164      731063        syn-C2H3C(O)NH2, v=0
  511925.7088  0.0049 -4.8398 3  268.8155 91  71510 303451035      45 738        syn-C2H3C(O)NH2, v=0
  511943.9731  0.0077 -3.8117 3  751.3697121  71510 303603723      603624        syn-C2H3C(O)NH2, v=0
  511943.9731  0.0077 -3.8117 3  751.3697121  71510 303603724      603625        syn-C2H3C(O)NH2, v=0
  512126.0441  0.0039 -3.4993 3  237.9060 85  71510 303421131      411032        syn-C2H3C(O)NH2, v=0
  512160.2070  0.0041 -5.5786 3  746.8847139  71510 303692743      682742        syn-C2H3C(O)NH2, v=0
  512160.2072  0.0041 -5.5786 3  746.8847139  71510 303692742      682741        syn-C2H3C(O)NH2, v=0
  512163.3366  0.0042 -4.5676 3   96.4904 61  71510 30330 327      29 228        syn-C2H3C(O)NH2, v=0
  512164.3566  0.0028 -4.7977 3  247.7196 83  71510 303411526      411229        syn-C2H3C(O)NH2, v=0
  512167.0845  0.0042 -4.5676 3   96.4904 61  71510 30330 427      29 128        syn-C2H3C(O)NH2, v=0
  512179.0528  0.0056 -5.6024 3  145.6011 67  71510 303331023      33 528        syn-C2H3C(O)NH2, v=0
  512207.4551  0.0076 -3.7972 3  736.7158119  71510 303593722      593623        syn-C2H3C(O)NH2, v=0
  512207.4551  0.0076 -3.7972 3  736.7158119  71510 303593723      593624        syn-C2H3C(O)NH2, v=0
  512213.3300  0.0012 -3.0042 3  268.9301 87  71510 303431528      421429        syn-C2H3C(O)NH2, v=0
  512220.4598  0.0050 -3.3707 3  677.4611147  71510 303731162      721261        syn-C2H3C(O)NH2, v=0
  512220.5002  0.0050 -5.3609 3  677.4611147  71510 303731262      721261        syn-C2H3C(O)NH2, v=0
  512220.5343  0.0050 -5.3609 3  677.4611147  71510 303731162      721161        syn-C2H3C(O)NH2, v=0
  512220.5747  0.0050 -3.3707 3  677.4611147  71510 303731262      721161        syn-C2H3C(O)NH2, v=0
  512283.0511  0.0204 -4.6507 3 1301.9029179  71510 303893851      893752        syn-C2H3C(O)NH2, v=0
  512283.0511  0.0204 -4.6507 3 1301.9029179  71510 303893852      893753        syn-C2H3C(O)NH2, v=0
  512459.0532  0.0076 -3.7840 3  722.3100117  71510 303583721      583622        syn-C2H3C(O)NH2, v=0
  512459.0532  0.0076 -3.7840 3  722.3100117  71510 303583722      583623        syn-C2H3C(O)NH2, v=0
  512497.9148  0.0027 -5.2278 3  587.7264131  71510 303651748      641747        syn-C2H3C(O)NH2, v=0
  512658.3962  0.0757 -5.9842 3 2024.3568233  71510 303B64076      B63977        syn-C2H3C(O)NH2, v=0
  512658.4026  0.0757 -5.9842 3 2024.3568233  71510 303B64077      B63978        syn-C2H3C(O)NH2, v=0
  512675.7906  0.0555 -4.9590 3 1388.0276213  71510 303A61393      A61294        syn-C2H3C(O)NH2, v=0
  512675.7906  0.0555 -4.9590 3 1388.0276213  71510 303A61493      A61394        syn-C2H3C(O)NH2, v=0
  512699.1710  0.0076 -3.7722 3  708.1521115  71510 303573720      573621        syn-C2H3C(O)NH2, v=0
  512699.1710  0.0076 -3.7722 3  708.1521115  71510 303573721      573622        syn-C2H3C(O)NH2, v=0
  512731.3027  0.0046 -3.4013 3  670.7652145  71510 303721260      711359        syn-C2H3C(O)NH2, v=0
  512732.2682  0.0046 -5.3538 3  670.7652145  71510 303721360      711359        syn-C2H3C(O)NH2, v=0
  512733.0269  0.0046 -5.3538 3  670.7651145  71510 303721260      711259        syn-C2H3C(O)NH2, v=0
  512733.9924  0.0046 -3.4013 3  670.7651145  71510 303721360      711259        syn-C2H3C(O)NH2, v=0
  512754.6802  0.0031 -3.3826 3  264.0289 89  71510 303441232      431133        syn-C2H3C(O)NH2, v=0
  512781.5190  0.0383 -4.4785 3  853.1239179  71510 30389 386      89 287        syn-C2H3C(O)NH2, v=0
  512781.5190  0.0383 -4.4785 3  853.1239179  71510 30389 486      89 387        syn-C2H3C(O)NH2, v=0
  512890.2209  0.0036 -3.5613 3  646.1020139  71510 303691554      681653        syn-C2H3C(O)NH2, v=0
  512928.2018  0.0076 -3.7618 3  694.2419113  71510 303563719      563620        syn-C2H3C(O)NH2, v=0
  512928.2018  0.0076 -3.7618 3  694.2419113  71510 303563720      563621        syn-C2H3C(O)NH2, v=0
  512932.8752  0.0032 -5.2946 3  628.8230137  71510 303681553      671552        syn-C2H3C(O)NH2, v=0
  512969.0423  0.0023 -5.2735 3  142.9413 61  71510 303301416      301119        syn-C2H3C(O)NH2, v=0
  513063.7866  0.0195 -4.6118 3 1279.9733177  71510 303883850      883751        syn-C2H3C(O)NH2, v=0
  513063.7866  0.0195 -4.6118 3 1279.9733177  71510 303883851      883752        syn-C2H3C(O)NH2, v=0
  513104.4812  0.0023 -5.2733 3  142.9368 61  71510 303301417      301120        syn-C2H3C(O)NH2, v=0
  513117.6658  0.0422 -5.3316 3 1678.2836209  71510 303A43965      A43866        syn-C2H3C(O)NH2, v=0
  513117.6658  0.0422 -5.3316 3 1678.2836209  71510 303A43966      A43867        syn-C2H3C(O)NH2, v=0
  513146.5293  0.0076 -3.7529 3  680.5793111  71510 303553718      553619        syn-C2H3C(O)NH2, v=0
  513146.5293  0.0076 -3.7529 3  680.5793111  71510 303553719      553620        syn-C2H3C(O)NH2, v=0
  513164.3547  0.0024 -4.7135 3  268.8962 87  71510 303431529      431232        syn-C2H3C(O)NH2, v=0
  513200.7126  0.0040 -5.5463 3  734.9224139  71510 303692644      682643        syn-C2H3C(O)NH2, v=0
  513200.7160  0.0040 -5.5463 3  734.9224139  71510 303692643      682642        syn-C2H3C(O)NH2, v=0
  513246.6066  0.1498 -5.9164 3 1949.3749245  71510 303C221A1      C220A2        syn-C2H3C(O)NH2, v=0
  513246.6075  0.1498 -5.9164 3 1949.3749245  71510 303C222A1      C221A2        syn-C2H3C(O)NH2, v=0
  513269.8029  0.0069 -6.0291 3  928.8948141  71510 303703832      693831        syn-C2H3C(O)NH2, v=0
  513269.8029  0.0069 -6.0291 3  928.8948141  71510 303703833      693832        syn-C2H3C(O)NH2, v=0
  513276.3386  0.1927 -5.5244 3 1436.6518203  71510 303A12774      A02873        syn-C2H3C(O)NH2, v=0
  513283.4307  0.2137 -5.6952 3 1525.2487209  71510 303A42876      A32975        syn-C2H3C(O)NH2, v=0
  513311.3755  0.0038 -5.4236 3  158.4131 69  71510 303341123      34 628        syn-C2H3C(O)NH2, v=0
  513336.8658  0.0434 -4.7683 3  764.3954173  71510 30386 185      86 086        syn-C2H3C(O)NH2, v=0
  513336.8658  0.0434 -4.7683 3  764.3954173  71510 30386 285      86 186        syn-C2H3C(O)NH2, v=0
  513354.5273  0.0077 -3.7456 3  667.1641109  71510 303543717      543618        syn-C2H3C(O)NH2, v=0
  513354.5273  0.0077 -3.7456 3  667.1641109  71510 303543718      543619        syn-C2H3C(O)NH2, v=0
  513394.4060  0.0031 -5.2709 3  610.0045133  71510 303661848      651847        syn-C2H3C(O)NH2, v=0
  513496.0891  0.0042 -3.4383 3  663.3579143  71510 303711358      701457        syn-C2H3C(O)NH2, v=0
  513504.5740  0.0624 -5.0626 3 1453.9137217  71510 303A81494      A81395        syn-C2H3C(O)NH2, v=0
  513504.5740  0.0624 -5.0626 3 1453.9137217  71510 303A81594      A81495        syn-C2H3C(O)NH2, v=0
  513514.6976  0.0042 -5.3446 3  663.3579143  71510 303711458      701457        syn-C2H3C(O)NH2, v=0
  513528.1588  0.0042 -5.3446 3  663.3569143  71510 303711358      701357        syn-C2H3C(O)NH2, v=0
  513546.7674  0.0042 -3.4382 3  663.3569143  71510 303711458      701357        syn-C2H3C(O)NH2, v=0
  513552.5606  0.0077 -3.7401 3  653.9959107  71510 303533716      533617        syn-C2H3C(O)NH2, v=0
  513552.5606  0.0077 -3.7401 3  653.9959107  71510 303533717      533618        syn-C2H3C(O)NH2, v=0
  513556.5837  0.0397 -4.6391 3 1158.6281199  71510 30399 990      99 891        syn-C2H3C(O)NH2, v=0
  513556.5837  0.0397 -4.6391 3 1158.6281199  71510 303991090      99 991        syn-C2H3C(O)NH2, v=0
  513575.4348  0.0034 -5.3864 3  666.5147137  71510 303682148      672147        syn-C2H3C(O)NH2, v=0
  513648.7634  0.0065 -5.9828 3  911.4327141  71510 303703733      693732        syn-C2H3C(O)NH2, v=0
  513648.7634  0.0065 -5.9828 3  911.4327141  71510 303703734      693733        syn-C2H3C(O)NH2, v=0
  513660.1492  0.0034 -4.5737 3  364.5115103  71510 303511537      511240        syn-C2H3C(O)NH2, v=0
  513740.9846  0.0078 -3.7366 3  641.0748105  71510 303523715      523616        syn-C2H3C(O)NH2, v=0
  513740.9846  0.0078 -3.7366 3  641.0748105  71510 303523716      523617        syn-C2H3C(O)NH2, v=0
  513756.1672  0.0034 -5.3861 3  666.5228137  71510 303682147      672146        syn-C2H3C(O)NH2, v=0
  513816.7955  0.0187 -4.5735 3 1258.2988175  71510 303873849      873750        syn-C2H3C(O)NH2, v=0
  513816.7955  0.0187 -4.5735 3 1258.2988175  71510 303873850      873751        syn-C2H3C(O)NH2, v=0
  513876.5047  0.0360 -4.4871 3 1001.8278189  71510 30394 688      94 589        syn-C2H3C(O)NH2, v=0
  513876.5047  0.0360 -4.4871 3 1001.8278189  71510 30394 788      94 689        syn-C2H3C(O)NH2, v=0
  513920.1463  0.0078 -3.7351 3  628.4005103  71510 303513714      513615        syn-C2H3C(O)NH2, v=0
  513920.1463  0.0078 -3.7351 3  628.4005103  71510 303513715      513616        syn-C2H3C(O)NH2, v=0
  514004.0533  0.1319 -5.7819 3 1874.9674241  71510 303C020A0      C019A1        syn-C2H3C(O)NH2, v=0
  514004.0535  0.1319 -5.7819 3 1874.9674241  71510 303C021A0      C020A1        syn-C2H3C(O)NH2, v=0
  514055.8157  0.0063 -5.9379 3  894.4554141  71510 303703634      693633        syn-C2H3C(O)NH2, v=0
  514055.8157  0.0063 -5.9379 3  894.4554141  71510 303703635      693634        syn-C2H3C(O)NH2, v=0
  514090.3840  0.0079 -3.7360 3  615.9728101  71510 303503713      503614        syn-C2H3C(O)NH2, v=0
  514090.3840  0.0079 -3.7360 3  615.9728101  71510 303503714      503615        syn-C2H3C(O)NH2, v=0
  514134.6997  0.0704 -5.1712 3 1521.0353221  71510 303B01595      B01496        syn-C2H3C(O)NH2, v=0
  514134.6997  0.0704 -5.1712 3 1521.0353221  71510 303B01695      B01596        syn-C2H3C(O)NH2, v=0
  514135.4830  0.0048 -4.6533 3  404.2819107  71510 303531736      531439        syn-C2H3C(O)NH2, v=0
  514176.7048  0.0033 -5.3158 3  633.5320135  71510 303671948      661947        syn-C2H3C(O)NH2, v=0
  514252.0277  0.0080 -3.7395 3  603.7915 99  71510 303493712      493613        syn-C2H3C(O)NH2, v=0
  514252.0277  0.0080 -3.7395 3  603.7915 99  71510 303493713      493614        syn-C2H3C(O)NH2, v=0
  514332.0765  0.0404 -5.2826 3 1652.5242207  71510 303A33964      A33865        syn-C2H3C(O)NH2, v=0
  514332.0765  0.0404 -5.2826 3 1652.5242207  71510 303A33965      A33866        syn-C2H3C(O)NH2, v=0
  514334.8838  0.0722 -5.9273 3 1995.4989231  71510 303B54075      B53976        syn-C2H3C(O)NH2, v=0
  514334.8871  0.0722 -5.9273 3 1995.4989231  71510 303B54076      B53977        syn-C2H3C(O)NH2, v=0
  514397.7346  0.0039 -5.5151 3  723.5020139  71510 303692545      682544        syn-C2H3C(O)NH2, v=0
  514397.7777  0.0039 -5.5151 3  723.5020139  71510 303692544      682543        syn-C2H3C(O)NH2, v=0
  514405.3992  0.0081 -3.7460 3  591.8566 97  71510 303483711      483612        syn-C2H3C(O)NH2, v=0
  514405.3992  0.0081 -3.7460 3  591.8566 97  71510 303483712      483613        syn-C2H3C(O)NH2, v=0
  514416.7618  0.0039 -3.4862 3  655.1645141  71510 303701456      691555        syn-C2H3C(O)NH2, v=0
  514494.7256  0.0060 -5.8943 3  877.9651141  71510 303703535      693534        syn-C2H3C(O)NH2, v=0
  514494.7256  0.0060 -5.8943 3  877.9651141  71510 303703536      693535        syn-C2H3C(O)NH2, v=0
  514501.3408  0.1162 -5.6513 3 1801.7583237  71510 303B81999      B818A0        syn-C2H3C(O)NH2, v=0
  514501.3409  0.1162 -5.6513 3 1801.7583237  71510 303B82099      B819A0        syn-C2H3C(O)NH2, v=0
  514542.9653  0.0180 -4.5360 3 1236.8791173  71510 303863848      863749        syn-C2H3C(O)NH2, v=0
  514542.9653  0.0180 -4.5360 3 1236.8791173  71510 303863849      863750        syn-C2H3C(O)NH2, v=0
  514550.8125  0.0083 -3.7559 3  580.1677 95  71510 303473710      473611        syn-C2H3C(O)NH2, v=0
  514550.8125  0.0083 -3.7559 3  580.1677 95  71510 303473711      473612        syn-C2H3C(O)NH2, v=0
  514558.4622  0.0796 -5.2846 3 1589.3866225  71510 303B21696      B21597        syn-C2H3C(O)NH2, v=0
  514558.4622  0.0796 -5.2846 3 1589.3866225  71510 303B21796      B21697        syn-C2H3C(O)NH2, v=0
  514679.5169  0.1700 -5.3551 3 1350.6978197  71510 303982672      972771        syn-C2H3C(O)NH2, v=0
  514688.5736  0.0084 -3.7698 3  568.7249 93  71510 3034637 9      463610        syn-C2H3C(O)NH2, v=0
  514688.5736  0.0084 -3.7698 3  568.7249 93  71510 303463710      463611        syn-C2H3C(O)NH2, v=0
  514700.3038  0.0039 -5.3330 3  655.1645141  71510 303701556      691555        syn-C2H3C(O)NH2, v=0
  514704.6405  0.0011 -2.9252 3  254.5951 83  71510 303411626      401525        syn-C2H3C(O)NH2, v=0
  514712.5068  0.0141 -4.0121 3  758.0880149  71510 303741856      731955        syn-C2H3C(O)NH2, v=0
  514713.7320  0.0011 -2.9251 3  254.5948 83  71510 303411625      401526        syn-C2H3C(O)NH2, v=0
  514751.8143  0.1024 -5.5248 3 1729.7542233  71510 303B61898      B61799        syn-C2H3C(O)NH2, v=0
  514751.8144  0.1024 -5.5248 3 1729.7542233  71510 303B61998      B61899        syn-C2H3C(O)NH2, v=0
  514767.3281  0.0902 -5.4025 3 1658.9616229  71510 303B41797      B41698        syn-C2H3C(O)NH2, v=0
  514767.3281  0.0902 -5.4025 3 1658.9616229  71510 303B41897      B41798        syn-C2H3C(O)NH2, v=0
  514771.1926  0.2338 -5.8683 3 1616.4876215  71510 303A72978      A63077        syn-C2H3C(O)NH2, v=0
  514818.9812  0.0085 -3.7884 3  557.5278 91  71510 3034537 8      4536 9        syn-C2H3C(O)NH2, v=0
  514818.9812  0.0085 -3.7884 3  557.5278 91  71510 3034537 9      453610        syn-C2H3C(O)NH2, v=0
  514840.7276  0.0016 -2.6208 3  197.9309 51  71510 3032524 1      2423 2        syn-C2H3C(O)NH2, v=0
  514840.7276  0.0016 -2.6208 3  197.9309 51  71510 3032524 2      2423 1        syn-C2H3C(O)NH2, v=0
  514884.5304  0.0039 -5.3327 3  655.1489141  71510 303701456      691455        syn-C2H3C(O)NH2, v=0
  514942.3263  0.0087 -3.8128 3  546.5764 89  71510 3034437 7      4436 8        syn-C2H3C(O)NH2, v=0
  514942.3263  0.0087 -3.8128 3  546.5764 89  71510 3034437 8      4436 9        syn-C2H3C(O)NH2, v=0
  514969.9248  0.0057 -5.8521 3  861.9642141  71510 303703436      693435        syn-C2H3C(O)NH2, v=0
  514969.9248  0.0057 -5.8521 3  861.9642141  71510 303703437      693436        syn-C2H3C(O)NH2, v=0
  515058.8926  0.0088 -3.8444 3  535.8706 87  71510 3034337 6      4336 7        syn-C2H3C(O)NH2, v=0
  515058.8926  0.0088 -3.8444 3  535.8706 87  71510 3034337 7      4336 8        syn-C2H3C(O)NH2, v=0
  515129.4144  0.0433 -4.7190 3 1220.1187203  71510 303A11091      A1 992        syn-C2H3C(O)NH2, v=0
  515129.4144  0.0433 -4.7190 3 1220.1187203  71510 303A11191      A11092        syn-C2H3C(O)NH2, v=0
  515130.5245  0.0026 -4.6124 3   95.2521 55  71510 30327 918      26 621        syn-C2H3C(O)NH2, v=0
  515168.0724  0.0039 -3.4848 3  655.1489141  71510 303701556      691455        syn-C2H3C(O)NH2, v=0
  515168.9566  0.0090 -3.8853 3  525.4101 85  71510 3034237 5      4236 6        syn-C2H3C(O)NH2, v=0
  515168.9566  0.0090 -3.8853 3  525.4101 85  71510 3034237 6      4236 7        syn-C2H3C(O)NH2, v=0
  515243.1498  0.0173 -4.4992 3 1215.7139171  71510 303853847      853748        syn-C2H3C(O)NH2, v=0
  515243.1498  0.0173 -4.4992 3 1215.7139171  71510 303853848      853749        syn-C2H3C(O)NH2, v=0
  515272.5717  0.0015 -2.6451 3  199.7353 55  71510 3032723 4      2622 5        syn-C2H3C(O)NH2, v=0
  515272.5717  0.0015 -2.6451 3  199.7353 55  71510 3032723 5      2622 4        syn-C2H3C(O)NH2, v=0
  515272.7879  0.0092 -3.9388 3  515.1948 83  71510 3034137 4      4136 5        syn-C2H3C(O)NH2, v=0
  515272.7879  0.0092 -3.9388 3  515.1948 83  71510 3034137 5      4136 6        syn-C2H3C(O)NH2, v=0
  515278.3387  0.0033 -3.5397 3  595.0743133  71510 303661651      651550        syn-C2H3C(O)NH2, v=0
  515288.3055  0.0040 -3.4294 3  433.0015113  71510 303561542      551441        syn-C2H3C(O)NH2, v=0
  515300.3848  0.0379 -4.4647 3  908.1619183  71510 30391 487      91 388        syn-C2H3C(O)NH2, v=0
  515300.3848  0.0379 -4.4647 3  908.1619183  71510 30391 587      91 488        syn-C2H3C(O)NH2, v=0
  515370.6489  0.0093 -4.0103 3  505.2246 81  71510 3034037 3      4036 4        syn-C2H3C(O)NH2, v=0
  515370.6489  0.0093 -4.0103 3  505.2246 81  71510 3034037 4      4036 5        syn-C2H3C(O)NH2, v=0
  515419.0207  0.0039 -4.2918 3  108.3860 63  71510 30331 427      30 328        syn-C2H3C(O)NH2, v=0
  515443.6396  0.0023 -5.3493 3  135.4671 59  71510 303291415      291118        syn-C2H3C(O)NH2, v=0
  515456.0332  0.0039 -4.2917 3  108.3860 63  71510 30331 527      30 228        syn-C2H3C(O)NH2, v=0
  515462.7951  0.0095 -4.1102 3  495.4994 79  71510 3033937 2      3936 3        syn-C2H3C(O)NH2, v=0
  515462.7951  0.0095 -4.1102 3  495.4994 79  71510 3033937 3      3936 4        syn-C2H3C(O)NH2, v=0
  515486.6705  0.0055 -5.8113 3  846.4554141  71510 303703337      693336        syn-C2H3C(O)NH2, v=0
  515486.6705  0.0055 -5.8113 3  846.4554141  71510 303703338      693337        syn-C2H3C(O)NH2, v=0
  515505.0302  0.0386 -5.2343 3 1627.0247205  71510 303A23963      A23864        syn-C2H3C(O)NH2, v=0
  515505.0302  0.0386 -5.2343 3 1627.0247205  71510 303A23964      A23865        syn-C2H3C(O)NH2, v=0
  515509.5146  0.0023 -5.3492 3  135.4649 59  71510 303291416      291119        syn-C2H3C(O)NH2, v=0
  515549.4754  0.0097 -4.2615 3  486.0190 77  71510 3033837 1      3836 2        syn-C2H3C(O)NH2, v=0
  515549.4754  0.0097 -4.2615 3  486.0190 77  71510 3033837 2      3836 3        syn-C2H3C(O)NH2, v=0
  515630.9319  0.0099 -4.5380 3  476.7832 75  71510 3033737 0      3736 1        syn-C2H3C(O)NH2, v=0
  515630.9319  0.0099 -4.5380 3  476.7832 75  71510 3033737 1      3736 2        syn-C2H3C(O)NH2, v=0
  515634.3714  0.0021 -4.9875 3   74.0467 47  71510 303231013      22 716        syn-C2H3C(O)NH2, v=0
  515655.6753  0.0158 -4.7797 3  834.1156155  71510 303772156      771859        syn-C2H3C(O)NH2, v=0
  515684.1347  0.0013 -2.6716 3  203.0112 59  71510 3032922 7      2821 8        syn-C2H3C(O)NH2, v=0
  515684.1347  0.0013 -2.6716 3  203.0112 59  71510 3032922 8      2821 7        syn-C2H3C(O)NH2, v=0
  515722.4475  0.0044 -3.6076 3  213.0145 81  71510 303401030      39 931        syn-C2H3C(O)NH2, v=0
  515794.1568  0.0039 -5.4851 3  712.6392139  71510 303692446      682445        syn-C2H3C(O)NH2, v=0
  515794.6422  0.0039 -5.4851 3  712.6392139  71510 303692445      682444        syn-C2H3C(O)NH2, v=0
  515909.8254  0.0032 -3.5407 3  611.8731135  71510 303671652      661551        syn-C2H3C(O)NH2, v=0
  515918.1701  0.0166 -4.4631 3 1194.8028169  71510 303843846      843747        syn-C2H3C(O)NH2, v=0
  515918.1701  0.0166 -4.4631 3 1194.8028169  71510 303843847      843748        syn-C2H3C(O)NH2, v=0
  515927.7096  0.0037 -3.9535 3  132.9663 67  71510 30333 627      32 528        syn-C2H3C(O)NH2, v=0
  515938.4537  0.0011 -2.8638 3  242.0268 79  71510 303391723      381622        syn-C2H3C(O)NH2, v=0
  515938.5734  0.0011 -2.8638 3  242.0268 79  71510 303391722      381623        syn-C2H3C(O)NH2, v=0
  515944.3087  0.0375 -4.5385 3 1060.1153193  71510 30396 789      96 690        syn-C2H3C(O)NH2, v=0
  515944.3087  0.0375 -4.5385 3 1060.1153193  71510 30396 889      96 790        syn-C2H3C(O)NH2, v=0
  515953.2659  0.0689 -5.8711 3 1966.9055229  71510 303B44074      B43975        syn-C2H3C(O)NH2, v=0
  515953.2676  0.0689 -5.8711 3 1966.9055229  71510 303B44075      B43976        syn-C2H3C(O)NH2, v=0
  516051.2550  0.0053 -5.7717 3  831.4419141  71510 303703238      693237        syn-C2H3C(O)NH2, v=0
  516051.2550  0.0053 -5.7717 3  831.4419141  71510 303703239      693238        syn-C2H3C(O)NH2, v=0
  516054.0801  0.0012 -2.7008 3  207.7693 63  71510 303312110      302011        syn-C2H3C(O)NH2, v=0
  516054.0801  0.0012 -2.7008 3  207.7693 63  71510 303312111      302010        syn-C2H3C(O)NH2, v=0
  516135.8960  0.0421 -4.5740 3  817.4430177  71510 30388 286      88 187        syn-C2H3C(O)NH2, v=0
  516135.8960  0.0421 -4.5740 3  817.4430177  71510 30388 386      88 287        syn-C2H3C(O)NH2, v=0
  516159.7177  0.0035 -5.3190 3  646.1020139  71510 303691654      681653        syn-C2H3C(O)NH2, v=0
  516238.8915  0.0033 -5.3057 3  636.2359137  71510 303681752      671751        syn-C2H3C(O)NH2, v=0
  516247.9340  0.0034 -5.3601 3  658.0811137  71510 303682049      672048        syn-C2H3C(O)NH2, v=0
  516347.0393  0.0012 -2.7335 3  214.0244 67  71510 303332013      321914        syn-C2H3C(O)NH2, v=0
  516347.0393  0.0012 -2.7335 3  214.0244 67  71510 303332014      321913        syn-C2H3C(O)NH2, v=0
  516426.4127  0.0011 -2.8134 3  231.1167 75  71510 303371820      361719        syn-C2H3C(O)NH2, v=0
  516426.4136  0.0011 -2.8134 3  231.1167 75  71510 303371819      361720        syn-C2H3C(O)NH2, v=0
  516448.2769  0.0035 -3.5392 3  578.4194131  71510 303651650      641549        syn-C2H3C(O)NH2, v=0
  516504.2749  0.0011 -2.7706 3  221.7970 71  71510 303351916      341817        syn-C2H3C(O)NH2, v=0
  516504.2749  0.0011 -2.7706 3  221.7970 71  71510 303351917      341816        syn-C2H3C(O)NH2, v=0
  516530.4846  0.0477 -4.8061 3 1282.8672207  71510 303A31192      A31093        syn-C2H3C(O)NH2, v=0
  516530.4846  0.0477 -4.8061 3 1282.8672207  71510 303A31292      A31193        syn-C2H3C(O)NH2, v=0
  516568.8172  0.0160 -4.4277 3 1174.1455167  71510 303833845      833746        syn-C2H3C(O)NH2, v=0
  516568.8172  0.0160 -4.4277 3 1174.1455167  71510 303833846      833747        syn-C2H3C(O)NH2, v=0
  516638.0145  0.0369 -5.1867 3 1601.7847203  71510 303A13962      A13863        syn-C2H3C(O)NH2, v=0
  516638.0145  0.0369 -5.1867 3 1601.7847203  71510 303A13963      A13864        syn-C2H3C(O)NH2, v=0
  516671.2879  0.0052 -5.7335 3  816.9277141  71510 303703139      693138        syn-C2H3C(O)NH2, v=0
  516671.2879  0.0052 -5.7335 3  816.9277141  71510 303703140      693139        syn-C2H3C(O)NH2, v=0
  516866.0169  0.0049 -3.6814 3  670.8896141  71510 303701654      691753        syn-C2H3C(O)NH2, v=0
  517017.3613  0.0037 -4.0976 3  120.5514 65  71510 30332 527      31 428        syn-C2H3C(O)NH2, v=0
  517026.6015  0.0032 -3.8405 3  145.6011 69  71510 30334 827      33 528        syn-C2H3C(O)NH2, v=0
  517194.7098  0.0028 -5.2387 3  600.4030133  71510 303661650      651649        syn-C2H3C(O)NH2, v=0
  517195.8536  0.0154 -4.3931 3 1153.7417165  71510 303823844      823745        syn-C2H3C(O)NH2, v=0
  517195.8536  0.0154 -4.3931 3 1153.7417165  71510 303823845      823746        syn-C2H3C(O)NH2, v=0
  517207.1287  0.0016 -3.7848 3  162.5978 71  71510 303351026      34 727        syn-C2H3C(O)NH2, v=0
  517219.3578  0.1455 -5.1860 3 1267.3868191  71510 303952570      942669        syn-C2H3C(O)NH2, v=0
  517254.9899  0.0042 -3.7653 3  166.8627 73  71510 30336 828      35 729        syn-C2H3C(O)NH2, v=0
  517297.5176  0.0037 -4.0972 3  120.5513 65  71510 30332 627      31 328        syn-C2H3C(O)NH2, v=0
  517356.0817  0.0050 -5.6965 3  802.9171141  71510 303703040      693039        syn-C2H3C(O)NH2, v=0
  517356.0817  0.0050 -5.6965 3  802.9171141  71510 303703041      693040        syn-C2H3C(O)NH2, v=0
  517365.4418  0.0080 -5.3914 3  724.4593163  71510 30381 477      80 476        syn-C2H3C(O)NH2, v=0
  517365.4418  0.0080 -3.2408 3  724.4593163  71510 30381 477      80 576        syn-C2H3C(O)NH2, v=0
  517365.4418  0.0080 -3.2408 3  724.4593163  71510 30381 577      80 476        syn-C2H3C(O)NH2, v=0
  517365.4418  0.0080 -5.3914 3  724.4593163  71510 30381 577      80 576        syn-C2H3C(O)NH2, v=0
  517368.1786  0.0086 -5.3883 3  726.5368165  71510 30382 379      81 378        syn-C2H3C(O)NH2, v=0
  517368.1786  0.0086 -3.2231 3  726.5368165  71510 30382 379      81 478        syn-C2H3C(O)NH2, v=0
  517368.1786  0.0086 -3.2231 3  726.5368165  71510 30382 479      81 378        syn-C2H3C(O)NH2, v=0
  517368.1786  0.0086 -5.3883 3  726.5368165  71510 30382 479      81 478        syn-C2H3C(O)NH2, v=0
  517373.5368  0.0076 -5.3933 3  721.8555161  71510 30380 575      79 574        syn-C2H3C(O)NH2, v=0
  517373.5368  0.0076 -3.2587 3  721.8555161  71510 30380 575      79 674        syn-C2H3C(O)NH2, v=0
  517373.5368  0.0076 -3.2587 3  721.8555161  71510 30380 675      79 574        syn-C2H3C(O)NH2, v=0
  517373.5368  0.0076 -5.3933 3  721.8555161  71510 30380 675      79 674        syn-C2H3C(O)NH2, v=0
  517377.1835  0.0095 -5.3843 3  728.0952167  71510 30383 281      82 280        syn-C2H3C(O)NH2, v=0
  517377.1835  0.0095 -3.2055 3  728.0952167  71510 30383 281      82 380        syn-C2H3C(O)NH2, v=0
  517377.1835  0.0095 -3.2055 3  728.0952167  71510 30383 381      82 280        syn-C2H3C(O)NH2, v=0
  517377.1835  0.0095 -5.3843 3  728.0952167  71510 30383 381      82 380        syn-C2H3C(O)NH2, v=0
  517388.9594  0.0110 -5.3792 3  729.1402169  71510 30384 183      83 182        syn-C2H3C(O)NH2, v=0
  517388.9594  0.0110 -3.1879 3  729.1402169  71510 30384 183      83 282        syn-C2H3C(O)NH2, v=0
  517388.9594  0.0110 -3.1879 3  729.1402169  71510 30384 283      83 182        syn-C2H3C(O)NH2, v=0
  517388.9594  0.0110 -5.3792 3  729.1402169  71510 30384 283      83 282        syn-C2H3C(O)NH2, v=0
  517392.4325  0.0035 -5.3583 3  658.1402137  71510 303682048      672047        syn-C2H3C(O)NH2, v=0
  517398.5004  0.0073 -5.3942 3  718.7171159  71510 30379 673      78 672        syn-C2H3C(O)NH2, v=0
  517398.5004  0.0073 -3.2771 3  718.7171159  71510 30379 673      78 772        syn-C2H3C(O)NH2, v=0
  517398.5004  0.0073 -3.2771 3  718.7171159  71510 30379 773      78 672        syn-C2H3C(O)NH2, v=0
  517398.5004  0.0073 -5.3942 3  718.7171159  71510 30379 773      78 772        syn-C2H3C(O)NH2, v=0
  517400.7953  0.0132 -5.3732 3  729.6769171  71510 30385 085      84 084        syn-C2H3C(O)NH2, v=0
  517400.7953  0.0132 -3.1702 3  729.6769171  71510 30385 085      84 184        syn-C2H3C(O)NH2, v=0
  517400.7953  0.0132 -3.1702 3  729.6769171  71510 30385 185      84 084        syn-C2H3C(O)NH2, v=0
  517400.7953  0.0132 -5.3732 3  729.6769171  71510 30385 185      84 184        syn-C2H3C(O)NH2, v=0
  517448.4457  0.0070 -5.3940 3  715.0338157  71510 30378 771      77 770        syn-C2H3C(O)NH2, v=0
  517448.4457  0.0070 -3.2960 3  715.0338157  71510 30378 771      77 870        syn-C2H3C(O)NH2, v=0
  517448.4457  0.0070 -3.2960 3  715.0338157  71510 30378 871      77 770        syn-C2H3C(O)NH2, v=0
  517448.4457  0.0070 -5.3940 3  715.0338157  71510 30378 871      77 870        syn-C2H3C(O)NH2, v=0
  517451.7345  0.0038 -5.4560 3  702.3548139  71510 303692347      682346        syn-C2H3C(O)NH2, v=0
  517456.5517  0.0038 -5.4560 3  702.3550139  71510 303692346      682345        syn-C2H3C(O)NH2, v=0
  517515.9668  0.0658 -5.8157 3 1938.5761227  71510 303B34073      B33974        syn-C2H3C(O)NH2, v=0
  517515.9677  0.0658 -5.8157 3 1938.5761227  71510 303B34074      B33975        syn-C2H3C(O)NH2, v=0
  517534.4894  0.0067 -5.3926 3  710.7930155  71510 30377 869      76 868        syn-C2H3C(O)NH2, v=0
  517534.4894  0.0067 -3.3159 3  710.7930155  71510 30377 869      76 968        syn-C2H3C(O)NH2, v=0
  517534.4894  0.0067 -3.3159 3  710.7930155  71510 30377 969      76 868        syn-C2H3C(O)NH2, v=0
  517534.4894  0.0067 -5.3926 3  710.7930155  71510 30377 969      76 968        syn-C2H3C(O)NH2, v=0
  517551.8940  0.0024 -4.7490 3  258.0118 85  71510 303421528      421231        syn-C2H3C(O)NH2, v=0
  517588.7042  0.0035 -3.9515 3  132.9656 67  71510 30333 727      32 428        syn-C2H3C(O)NH2, v=0
  517626.4191  0.0024 -5.4304 3  128.2565 57  71510 303281414      281117        syn-C2H3C(O)NH2, v=0
  517657.3616  0.0024 -5.4304 3  128.2554 57  71510 303281415      281118        syn-C2H3C(O)NH2, v=0
  517672.2299  0.0063 -5.3899 3  705.9792153  71510 30376 967      75 966        syn-C2H3C(O)NH2, v=0
  517672.2299  0.0063 -3.3371 3  705.9792153  71510 30376 967      751066        syn-C2H3C(O)NH2, v=0
  517672.2299  0.0063 -3.3371 3  705.9792153  71510 303761067      75 966        syn-C2H3C(O)NH2, v=0
  517672.2299  0.0063 -5.3899 3  705.9792153  71510 303761067      751066        syn-C2H3C(O)NH2, v=0
  517673.8390  0.0381 -4.4817 3  964.4888187  71510 30393 588      93 489        syn-C2H3C(O)NH2, v=0
  517673.8390  0.0381 -4.4817 3  964.4888187  71510 30393 688      93 589        syn-C2H3C(O)NH2, v=0
  517732.4413  0.0353 -5.1397 3 1576.8036201  71510 303A03961      A03862        syn-C2H3C(O)NH2, v=0
  517732.4413  0.0353 -5.1397 3 1576.8036201  71510 303A03962      A03863        syn-C2H3C(O)NH2, v=0
  517754.7077  0.0529 -4.8997 3 1346.8682211  71510 303A51293      A51194        syn-C2H3C(O)NH2, v=0
  517754.7077  0.0529 -4.8997 3 1346.8682211  71510 303A51393      A51294        syn-C2H3C(O)NH2, v=0
  517800.0147  0.0149 -4.3592 3 1133.5911163  71510 303813843      813744        syn-C2H3C(O)NH2, v=0
  517800.0147  0.0149 -4.3592 3 1133.5911163  71510 303813844      813745        syn-C2H3C(O)NH2, v=0
  517855.2477  0.0397 -4.6018 3 1119.6765197  71510 30398 890      98 791        syn-C2H3C(O)NH2, v=0
  517855.2477  0.0397 -4.6018 3 1119.6765197  71510 30398 990      98 891        syn-C2H3C(O)NH2, v=0
  517884.2211  0.0059 -3.3600 3  700.5724151  71510 303751065      741164        syn-C2H3C(O)NH2, v=0
  517884.2218  0.0059 -5.3859 3  700.5724151  71510 303751165      741164        syn-C2H3C(O)NH2, v=0
  517884.2225  0.0059 -5.3859 3  700.5724151  71510 303751065      741064        syn-C2H3C(O)NH2, v=0
  517884.2232  0.0059 -3.3600 3  700.5724151  71510 303751165      741064        syn-C2H3C(O)NH2, v=0
  517900.8236  0.0013 -3.0224 3  279.7434 89  71510 303441530      431429        syn-C2H3C(O)NH2, v=0
  517968.5323  0.0036 -5.3155 3  645.9326139  71510 303691554      681553        syn-C2H3C(O)NH2, v=0
  518011.1865  0.0034 -3.5429 3  628.8230137  71510 303681653      671552        syn-C2H3C(O)NH2, v=0
  518117.1935  0.0048 -5.6607 3  789.4158141  71510 303702941      692940        syn-C2H3C(O)NH2, v=0
  518117.1935  0.0048 -5.6607 3  789.4158141  71510 303702942      692941        syn-C2H3C(O)NH2, v=0
  518204.3500  0.0055 -3.3856 3  694.5470149  71510 303741163      731262        syn-C2H3C(O)NH2, v=0
  518204.3719  0.0055 -5.3805 3  694.5470149  71510 303741263      731262        syn-C2H3C(O)NH2, v=0
  518204.3905  0.0055 -5.3805 3  694.5470149  71510 303741163      731162        syn-C2H3C(O)NH2, v=0
  518204.4123  0.0055 -3.3856 3  694.5470149  71510 303741263      731162        syn-C2H3C(O)NH2, v=0
  518221.5270  0.0014 -3.1445 3  296.5528 93  71510 303461432      451333        syn-C2H3C(O)NH2, v=0
  518382.0104  0.0143 -4.3260 3 1113.6934161  71510 303803842      803743        syn-C2H3C(O)NH2, v=0
  518382.0104  0.0143 -4.3260 3 1113.6934161  71510 303803843      803744        syn-C2H3C(O)NH2, v=0
  518446.0956  0.0027 -3.7639 3  158.4131 71  71510 30335 927      34 628        syn-C2H3C(O)NH2, v=0
  518629.8427  0.0013 -3.0214 3  279.7231 89  71510 303441529      431430        syn-C2H3C(O)NH2, v=0
  518678.6122  0.0034 -5.3361 3  650.3377137  71510 303681950      671949        syn-C2H3C(O)NH2, v=0
  518685.7268  0.0051 -3.4149 3  687.8681147  71510 303731261      721360        syn-C2H3C(O)NH2, v=0
  518686.2647  0.0051 -5.3733 3  687.8681147  71510 303731361      721360        syn-C2H3C(O)NH2, v=0
  518686.6923  0.0051 -5.3733 3  687.8680147  71510 303731261      721260        syn-C2H3C(O)NH2, v=0
  518687.2302  0.0051 -3.4149 3  687.8680147  71510 303731361      721260        syn-C2H3C(O)NH2, v=0
  518789.6531  0.0338 -5.0935 3 1552.0812199  71510 303993960      993861        syn-C2H3C(O)NH2, v=0
  518789.6531  0.0338 -5.0935 3 1552.0812199  71510 303993961      993862        syn-C2H3C(O)NH2, v=0
  518796.1272  0.0045 -3.6931 3  189.3346 77  71510 30338 929      37 830        syn-C2H3C(O)NH2, v=0
  518796.2435  0.0412 -4.5074 3  871.7895181  71510 30390 387      90 288        syn-C2H3C(O)NH2, v=0
  518796.2435  0.0412 -4.5074 3  871.7895181  71510 30390 487      90 388        syn-C2H3C(O)NH2, v=0
  518796.5216  0.0591 -4.9991 3 1412.1162215  71510 303A71394      A71295        syn-C2H3C(O)NH2, v=0
  518796.5216  0.0591 -4.9991 3 1412.1162215  71510 303A71494      A71395        syn-C2H3C(O)NH2, v=0
  518942.5267  0.0139 -4.2936 3 1094.0484159  71510 303793841      793742        syn-C2H3C(O)NH2, v=0
  518942.5267  0.0139 -4.2936 3 1094.0484159  71510 303793842      793743        syn-C2H3C(O)NH2, v=0
  518969.2044  0.0047 -5.6262 3  776.4302141  71510 303702842      692841        syn-C2H3C(O)NH2, v=0
  518969.2044  0.0047 -5.6262 3  776.4302141  71510 303702843      692842        syn-C2H3C(O)NH2, v=0
  519025.2574  0.0629 -5.7609 3 1910.5100225  71510 303B24072      B23973        syn-C2H3C(O)NH2, v=0
  519025.2578  0.0629 -5.7609 3 1910.5100225  71510 303B24073      B23974        syn-C2H3C(O)NH2, v=0
  519108.1950  0.0099 -4.7478 3  775.2569149  71510 303742153      741856        syn-C2H3C(O)NH2, v=0
  519200.7019  0.0034 -5.3171 3  643.1703137  71510 303681851      671850        syn-C2H3C(O)NH2, v=0
  519354.7713  0.0465 -4.7952 3  782.0563175  71510 30387 186      87 087        syn-C2H3C(O)NH2, v=0
  519354.7713  0.0465 -4.7952 3  782.0563175  71510 30387 286      87 187        syn-C2H3C(O)NH2, v=0
  519392.7632  0.0036 -4.7046 3  320.9904 95  71510 303471631      471334        syn-C2H3C(O)NH2, v=0
  519407.8422  0.0047 -3.4499 3  680.4869145  71510 303721359      711458        syn-C2H3C(O)NH2, v=0
  519418.5718  0.0047 -5.3643 3  680.4869145  71510 303721459      711458        syn-C2H3C(O)NH2, v=0
  519426.4508  0.0047 -5.3643 3  680.4863145  71510 303721359      711358        syn-C2H3C(O)NH2, v=0
  519437.1803  0.0047 -3.4499 3  680.4863145  71510 303721459      711358        syn-C2H3C(O)NH2, v=0
  519456.9558  0.0038 -5.4279 3  692.6774139  71510 303692248      682247        syn-C2H3C(O)NH2, v=0
  519482.2267  0.0134 -4.2619 3 1074.6557157  71510 303783840      783741        syn-C2H3C(O)NH2, v=0
  519482.2267  0.0134 -4.2619 3 1074.6557157  71510 303783841      783742        syn-C2H3C(O)NH2, v=0
  519498.4458  0.0038 -5.4279 3  692.6791139  71510 303692247      682246        syn-C2H3C(O)NH2, v=0
  519554.7119  0.0024 -5.5174 3  121.3074 55  71510 303271413      271116        syn-C2H3C(O)NH2, v=0
  519568.7218  0.0024 -5.5174 3  121.3069 55  71510 303271414      271117        syn-C2H3C(O)NH2, v=0
  519605.5072  0.0427 -4.6747 3 1180.5063201  71510 303A0 991      A0 892        syn-C2H3C(O)NH2, v=0
  519605.5072  0.0427 -4.6747 3 1180.5063201  71510 303A01091      A0 992        syn-C2H3C(O)NH2, v=0
  519648.5658  0.0038 -3.5380 3  561.9055129  71510 303641649      631548        syn-C2H3C(O)NH2, v=0
  519649.8302  0.0663 -5.1039 3 1478.6056219  71510 303A91495      A91396        syn-C2H3C(O)NH2, v=0
  519649.8302  0.0663 -5.1039 3 1478.6056219  71510 303A91595      A91496        syn-C2H3C(O)NH2, v=0
  519682.4816  0.1566 -5.9661 3 1978.3016247  71510 303C321A2      C320A3        syn-C2H3C(O)NH2, v=0
  519682.4821  0.1566 -5.9661 3 1978.3016247  71510 303C322A2      C321A3        syn-C2H3C(O)NH2, v=0
  519810.9276  0.0323 -5.0479 3 1527.6169197  71510 303983959      983860        syn-C2H3C(O)NH2, v=0
  519810.9276  0.0323 -5.0479 3 1527.6169197  71510 303983960      983861        syn-C2H3C(O)NH2, v=0
  519898.9548  0.0389 -4.5194 3 1022.0997191  71510 30395 689      95 590        syn-C2H3C(O)NH2, v=0
  519898.9548  0.0389 -4.5194 3 1022.0997191  71510 30395 789      95 690        syn-C2H3C(O)NH2, v=0
  519930.8832  0.0046 -5.5929 3  763.9685141  71510 303702744      692743        syn-C2H3C(O)NH2, v=0
  519930.8837  0.0046 -5.5929 3  763.9685141  71510 303702743      692742        syn-C2H3C(O)NH2, v=0
  519941.2952  0.0040 -3.5607 3  663.3192141  71510 303701555      691654        syn-C2H3C(O)NH2, v=0
  520001.7518  0.0130 -4.2310 3 1055.5151155  71510 303773839      773740        syn-C2H3C(O)NH2, v=0
  520001.7518  0.0130 -4.2310 3 1055.5151155  71510 303773840      773741        syn-C2H3C(O)NH2, v=0
  520141.7219  0.0171 -4.7324 3  724.2444145  71510 303721953      721656        syn-C2H3C(O)NH2, v=0
  520200.5641  0.0058 -4.6512 3  481.9447117  71510 303581840      581543        syn-C2H3C(O)NH2, v=0
  520307.9345  0.0746 -5.2138 3 1546.3307223  71510 303B11596      B11497        syn-C2H3C(O)NH2, v=0
  520307.9345  0.0746 -5.2138 3 1546.3307223  71510 303B11696      B11597        syn-C2H3C(O)NH2, v=0
  520363.1413  0.0043 -3.4945 3  672.3330143  71510 303711457      701556        syn-C2H3C(O)NH2, v=0
  520382.2821  0.1382 -5.8305 3 1903.2872243  71510 303C120A1      C119A2        syn-C2H3C(O)NH2, v=0
  520382.2822  0.1382 -5.8305 3 1903.2872243  71510 303C121A1      C120A2        syn-C2H3C(O)NH2, v=0
  520411.0024  0.1200 -5.0162 3 1186.7183185  71510 303922468      912567        syn-C2H3C(O)NH2, v=0
  520483.2686  0.0601 -5.7068 3 1882.7068223  71510 303B14071      B13972        syn-C2H3C(O)NH2, v=0
  520483.2688  0.0601 -5.7068 3 1882.7068223  71510 303B14072      B13973        syn-C2H3C(O)NH2, v=0
  520501.7230  0.0126 -4.2009 3 1036.6262153  71510 303763838      763739        syn-C2H3C(O)NH2, v=0
  520501.7230  0.0126 -4.2009 3 1036.6262153  71510 303763839      763740        syn-C2H3C(O)NH2, v=0
  520533.5512  0.0043 -5.3528 3  672.3330143  71510 303711557      701556        syn-C2H3C(O)NH2, v=0
  520543.2451  0.0026 -4.8348 3  237.2316 81  71510 303401525      401228        syn-C2H3C(O)NH2, v=0
  520646.6833  0.0043 -5.3526 3  672.3236143  71510 303711457      701456        syn-C2H3C(O)NH2, v=0
  520763.4526  0.0842 -5.3284 3 1615.2859227  71510 303B31697      B31598        syn-C2H3C(O)NH2, v=0
  520763.4526  0.0842 -5.3284 3 1615.2859227  71510 303B31797      B31698        syn-C2H3C(O)NH2, v=0
  520797.4824  0.0310 -5.0031 3 1503.4103195  71510 303973958      973859        syn-C2H3C(O)NH2, v=0
  520797.4824  0.0310 -5.0031 3 1503.4103195  71510 303973959      973860        syn-C2H3C(O)NH2, v=0
  520802.4183  0.0053 -4.7825 3  308.9018 97  71510 303481137      48 840        syn-C2H3C(O)NH2, v=0
  520817.0932  0.0043 -3.4937 3  672.3236143  71510 303711557      701456        syn-C2H3C(O)NH2, v=0
  520828.3071  0.1220 -5.6988 3 1829.4721239  71510 303B919A0      B918A1        syn-C2H3C(O)NH2, v=0
  520828.3071  0.1220 -5.6988 3 1829.4721239  71510 303B920A0      B919A1        syn-C2H3C(O)NH2, v=0
  520982.7419  0.0122 -4.1716 3 1017.9889151  71510 303753837      753738        syn-C2H3C(O)NH2, v=0
  520982.7419  0.0122 -4.1716 3 1017.9889151  71510 303753838      753739        syn-C2H3C(O)NH2, v=0
  521000.3054  0.0135 -4.7090 3  663.2101139  71510 303691851      691554        syn-C2H3C(O)NH2, v=0
  521008.2247  0.0952 -5.4476 3 1685.4652231  71510 303B51798      B51699        syn-C2H3C(O)NH2, v=0
  521008.2247  0.0952 -5.4476 3 1685.4652231  71510 303B51898      B51799        syn-C2H3C(O)NH2, v=0
  521026.9889  0.0045 -5.5608 3  752.0409141  71510 303702645      692644        syn-C2H3C(O)NH2, v=0
  521026.9959  0.0045 -5.5608 3  752.0409141  71510 303702644      692643        syn-C2H3C(O)NH2, v=0
  521033.2010  0.1077 -5.5711 3 1756.8626235  71510 303B71899      B717A0        syn-C2H3C(O)NH2, v=0
  521033.2010  0.1077 -5.5711 3 1756.8626235  71510 303B71999      B718A0        syn-C2H3C(O)NH2, v=0
  521041.0540  0.0023 -3.2826 3  291.4185 93  71510 303461333      451234        syn-C2H3C(O)NH2, v=0
  521124.3482  0.0021 -4.8931 3   79.8045 49  71510 303241014      23 717        syn-C2H3C(O)NH2, v=0
  521144.6683  0.0071 -5.9953 3  928.5661143  71510 303713734      703733        syn-C2H3C(O)NH2, v=0
  521144.6683  0.0071 -5.9953 3  928.5661143  71510 303713735      703734        syn-C2H3C(O)NH2, v=0
  521156.8697  0.0082 -3.8283 3  713.8788145  71510 303721755      711854        syn-C2H3C(O)NH2, v=0
  521190.9465  0.0465 -4.7559 3 1242.5993205  71510 303A21092      A2 993        syn-C2H3C(O)NH2, v=0
  521190.9465  0.0465 -4.7559 3 1242.5993205  71510 303A21192      A21093        syn-C2H3C(O)NH2, v=0
  521238.0290  0.0036 -3.5464 3  645.9326139  71510 303691654      681553        syn-C2H3C(O)NH2, v=0
  521258.1503  0.0025 -5.6111 3  114.6181 53  71510 303261412      261115        syn-C2H3C(O)NH2, v=0
  521264.2507  0.0025 -5.6110 3  114.6179 53  71510 303261413      261116        syn-C2H3C(O)NH2, v=0
  521315.4485  0.0408 -4.4949 3  927.4300185  71510 30392 488      92 389        syn-C2H3C(O)NH2, v=0
  521315.4485  0.0408 -4.4949 3  927.4300185  71510 30392 588      92 489        syn-C2H3C(O)NH2, v=0
  521367.9956  0.0037 -4.5812 3  377.4346105  71510 303521538      521241        syn-C2H3C(O)NH2, v=0
  521417.3257  0.0012 -2.9376 3  264.8036 85  71510 303421627      411526        syn-C2H3C(O)NH2, v=0
  521436.1360  0.0012 -2.9376 3  264.8030 85  71510 303421626      411527        syn-C2H3C(O)NH2, v=0
  521445.3915  0.0119 -4.1431 3  999.6028149  71510 303743836      743737        syn-C2H3C(O)NH2, v=0
  521445.3915  0.0119 -4.1431 3  999.6028149  71510 303743837      743738        syn-C2H3C(O)NH2, v=0
  521568.8391  0.0068 -5.9507 3  911.6025143  71510 303713635      703634        syn-C2H3C(O)NH2, v=0
  521568.8391  0.0068 -5.9507 3  911.6025143  71510 303713636      703635        syn-C2H3C(O)NH2, v=0
  521655.6313  0.0030 -5.2403 3  604.8214133  71510 303661749      651748        syn-C2H3C(O)NH2, v=0
  521750.4797  0.0297 -4.9589 3 1479.4610193  71510 303963957      963858        syn-C2H3C(O)NH2, v=0
  521750.4797  0.0297 -4.9589 3 1479.4610193  71510 303963958      963859        syn-C2H3C(O)NH2, v=0
  521752.7634  0.0041 -4.6691 3  327.2975 99  71510 303491337      491040        syn-C2H3C(O)NH2, v=0
  521779.5171  0.0229 -4.1678 3  822.9481155  71510 303771958      762057        syn-C2H3C(O)NH2, v=0
  521883.5113  0.0031 -5.2613 3  617.6548135  71510 303671651      661650        syn-C2H3C(O)NH2, v=0
  521890.2373  0.0116 -4.1154 3  981.4677147  71510 303733835      733736        syn-C2H3C(O)NH2, v=0
  521890.2373  0.0116 -4.1154 3  981.4677147  71510 303733836      733737        syn-C2H3C(O)NH2, v=0
  521892.0044  0.0575 -5.6534 3 1855.1658221  71510 303B04070      B03971        syn-C2H3C(O)NH2, v=0
  521892.0045  0.0575 -5.6534 3 1855.1658221  71510 303B04071      B03972        syn-C2H3C(O)NH2, v=0
  521892.7914  0.0039 -5.4008 3  683.6457139  71510 303692149      682148        syn-C2H3C(O)NH2, v=0
  521972.5733  0.0405 -4.5721 3 1080.9895195  71510 30397 790      97 691        syn-C2H3C(O)NH2, v=0
  521972.5733  0.0405 -4.5721 3 1080.9895195  71510 30397 890      97 791        syn-C2H3C(O)NH2, v=0
  522017.9282  0.0040 -5.3388 3  663.3192141  71510 303701655      691654        syn-C2H3C(O)NH2, v=0
  522026.4920  0.0066 -5.9075 3  895.1268143  71510 303713536      703535        syn-C2H3C(O)NH2, v=0
  522026.4920  0.0066 -5.9075 3  895.1268143  71510 303713537      703536        syn-C2H3C(O)NH2, v=0
  522050.7495  0.0209 -4.7704 3  787.8476151  71510 303752055      751758        syn-C2H3C(O)NH2, v=0
  522118.0491  0.0016 -2.6225 3  204.0162 53  71510 3032624 2      2523 3        syn-C2H3C(O)NH2, v=0
  522118.0491  0.0016 -2.6225 3  204.0162 53  71510 3032624 3      2523 2        syn-C2H3C(O)NH2, v=0
  522140.7389  0.0023 -4.7871 3  247.3863 83  71510 303411527      411230        syn-C2H3C(O)NH2, v=0
  522150.9822  0.0451 -4.6022 3  835.7069179  71510 30389 287      89 188        syn-C2H3C(O)NH2, v=0
  522150.9822  0.0451 -4.6022 3  835.7069179  71510 30389 387      89 288        syn-C2H3C(O)NH2, v=0
  522195.8821  0.0039 -5.4003 3  683.6599139  71510 303692148      682147        syn-C2H3C(O)NH2, v=0
  522291.1888  0.0044 -5.5298 3  740.6605141  71510 303702546      692545        syn-C2H3C(O)NH2, v=0
  522291.2744  0.0044 -5.5298 3  740.6605141  71510 303702545      692544        syn-C2H3C(O)NH2, v=0
  522317.8279  0.0113 -4.0885 3  963.5834145  71510 303723834      723735        syn-C2H3C(O)NH2, v=0
  522317.8279  0.0113 -4.0885 3  963.5834145  71510 303723835      723736        syn-C2H3C(O)NH2, v=0
  522504.4904  0.0051 -4.8441 3   91.6646 55  71510 30327 819      26 522        syn-C2H3C(O)NH2, v=0
  522522.3114  0.0063 -5.8656 3  879.1417143  71510 303713437      703436        syn-C2H3C(O)NH2, v=0
  522522.3114  0.0063 -5.8656 3  879.1417143  71510 303713438      703437        syn-C2H3C(O)NH2, v=0
  522545.3324  0.0015 -2.6472 3  206.3148 57  71510 3032823 5      2722 6        syn-C2H3C(O)NH2, v=0
  522545.3324  0.0015 -2.6472 3  206.3148 57  71510 3032823 6      2722 5        syn-C2H3C(O)NH2, v=0
  522607.0619  0.0511 -4.8442 3 1305.9503209  71510 303A41193      A41094        syn-C2H3C(O)NH2, v=0
  522607.0619  0.0511 -4.8442 3 1305.9503209  71510 303A41293      A41194        syn-C2H3C(O)NH2, v=0
  522653.5581  0.0037 -5.3245 3  653.4558139  71510 303691753      681752        syn-C2H3C(O)NH2, v=0
  522671.0292  0.0284 -4.9153 3 1455.7688191  71510 303953956      953857        syn-C2H3C(O)NH2, v=0
  522671.0292  0.0284 -4.9153 3 1455.7688191  71510 303953957      953858        syn-C2H3C(O)NH2, v=0
  522728.6959  0.0110 -4.0625 3  945.9497143  71510 303713833      713734        syn-C2H3C(O)NH2, v=0
  522728.6959  0.0110 -4.0625 3  945.9497143  71510 303713834      713735        syn-C2H3C(O)NH2, v=0
  522761.1303  0.0025 -5.7121 3  108.1871 51  71510 303251411      251114        syn-C2H3C(O)NH2, v=0
  522763.6779  0.0025 -5.7121 3  108.1870 51  71510 303251412      251115        syn-C2H3C(O)NH2, v=0
  522890.2583  0.0011 -2.8733 3  251.6801 81  71510 303401724      391623        syn-C2H3C(O)NH2, v=0
  522890.5370  0.0011 -2.8733 3  251.6801 81  71510 303401723      391624        syn-C2H3C(O)NH2, v=0
  522921.0173  0.0045 -4.9408 3  241.4039 87  71510 30343 934      43 637        syn-C2H3C(O)NH2, v=0
  522947.1854  0.0013 -2.6743 3  210.0878 61  71510 3033022 8      2921 9        syn-C2H3C(O)NH2, v=0
  522947.1854  0.0013 -2.6743 3  210.0878 61  71510 3033022 9      2921 8        syn-C2H3C(O)NH2, v=0
  523036.4863  0.0041 -4.7380 3  297.4524 95  71510 303471236      47 939        syn-C2H3C(O)NH2, v=0
  523061.8634  0.0061 -5.8250 3  863.6501143  71510 303713338      703337        syn-C2H3C(O)NH2, v=0
  523061.8634  0.0061 -5.8250 3  863.6501143  71510 303713339      703338        syn-C2H3C(O)NH2, v=0
  523123.3588  0.0108 -4.0373 3  928.5661141  71510 303703832      703733        syn-C2H3C(O)NH2, v=0
  523123.3588  0.0108 -4.0373 3  928.5661141  71510 303703833      703734        syn-C2H3C(O)NH2, v=0
  523210.7920  0.0040 -5.3366 3  663.2101141  71510 303701555      691554        syn-C2H3C(O)NH2, v=0
  523253.3519  0.0550 -5.6007 3 1827.8865219  71510 303A94069      A93970        syn-C2H3C(O)NH2, v=0
  523253.3519  0.0550 -5.6007 3 1827.8865219  71510 303A94070      A93971        syn-C2H3C(O)NH2, v=0
  523299.4502  0.0012 -2.7043 3  215.3469 65  71510 303322111      312012        syn-C2H3C(O)NH2, v=0
  523299.4502  0.0012 -2.7043 3  215.3469 65  71510 303322112      312011        syn-C2H3C(O)NH2, v=0
  523395.6040  0.0088 -5.4120 3  741.7168165  71510 30382 478      81 477        syn-C2H3C(O)NH2, v=0
  523395.6040  0.0088 -3.2607 3  741.7168165  71510 30382 478      81 577        syn-C2H3C(O)NH2, v=0
  523395.6040  0.0088 -3.2607 3  741.7168165  71510 30382 578      81 477        syn-C2H3C(O)NH2, v=0
  523395.6040  0.0088 -5.4120 3  741.7168165  71510 30382 578      81 577        syn-C2H3C(O)NH2, v=0
  523398.9424  0.0095 -5.4091 3  743.7944167  71510 30383 380      82 379        syn-C2H3C(O)NH2, v=0
  523398.9424  0.0095 -3.2433 3  743.7944167  71510 30383 380      82 479        syn-C2H3C(O)NH2, v=0
  523398.9424  0.0095 -3.2433 3  743.7944167  71510 30383 480      82 379        syn-C2H3C(O)NH2, v=0
  523398.9424  0.0095 -5.4091 3  743.7944167  71510 30383 480      82 479        syn-C2H3C(O)NH2, v=0
  523402.6506  0.0084 -5.4139 3  739.1133163  71510 30381 576      80 575        syn-C2H3C(O)NH2, v=0
  523402.6506  0.0084 -3.2782 3  739.1133163  71510 30381 576      80 675        syn-C2H3C(O)NH2, v=0
  523402.6506  0.0084 -3.2782 3  739.1133163  71510 30381 676      80 575        syn-C2H3C(O)NH2, v=0
  523402.6506  0.0084 -5.4139 3  739.1133163  71510 30381 676      80 675        syn-C2H3C(O)NH2, v=0
  523408.2595  0.0105 -5.4051 3  745.3530169  71510 30384 282      83 281        syn-C2H3C(O)NH2, v=0
  523408.2595  0.0105 -3.2260 3  745.3530169  71510 30384 282      83 381        syn-C2H3C(O)NH2, v=0
  523408.2595  0.0105 -3.2260 3  745.3530169  71510 30384 382      83 281        syn-C2H3C(O)NH2, v=0
  523408.2595  0.0105 -5.4051 3  745.3530169  71510 30384 382      83 381        syn-C2H3C(O)NH2, v=0
  523420.1658  0.0121 -5.4001 3  746.3985171  71510 30385 184      84 183        syn-C2H3C(O)NH2, v=0
  523420.1658  0.0121 -3.2086 3  746.3985171  71510 30385 184      84 283        syn-C2H3C(O)NH2, v=0
  523420.1658  0.0121 -3.2086 3  746.3985171  71510 30385 284      84 183        syn-C2H3C(O)NH2, v=0
  523420.1658  0.0121 -5.4001 3  746.3985171  71510 30385 284      84 283        syn-C2H3C(O)NH2, v=0
  523425.8850  0.0080 -5.4147 3  735.9757161  71510 30380 674      79 673        syn-C2H3C(O)NH2, v=0
  523425.8850  0.0080 -3.2962 3  735.9757161  71510 30380 674      79 773        syn-C2H3C(O)NH2, v=0
  523425.8850  0.0080 -3.2962 3  735.9757161  71510 30380 774      79 673        syn-C2H3C(O)NH2, v=0
  523425.8850  0.0080 -5.4147 3  735.9757161  71510 30380 774      79 773        syn-C2H3C(O)NH2, v=0
  523432.0235  0.0144 -5.3942 3  746.9356173  71510 30386 086      85 085        syn-C2H3C(O)NH2, v=0
  523432.0235  0.0144 -3.1911 3  746.9356173  71510 30386 086      85 185        syn-C2H3C(O)NH2, v=0
  523432.0235  0.0144 -3.1911 3  746.9356173  71510 30386 186      85 085        syn-C2H3C(O)NH2, v=0
  523432.0235  0.0144 -5.3942 3  746.9356173  71510 30386 186      85 185        syn-C2H3C(O)NH2, v=0
  523473.0686  0.0077 -5.4144 3  732.2940159  71510 30379 772      78 771        syn-C2H3C(O)NH2, v=0
  523473.0686  0.0077 -3.3147 3  732.2940159  71510 30379 772      78 871        syn-C2H3C(O)NH2, v=0
  523473.0686  0.0077 -3.3147 3  732.2940159  71510 30379 872      78 771        syn-C2H3C(O)NH2, v=0
  523473.0686  0.0077 -5.4144 3  732.2940159  71510 30379 872      78 871        syn-C2H3C(O)NH2, v=0
  523479.9235  0.0038 -3.3986 3  418.5013111  71510 303551541      541440        syn-C2H3C(O)NH2, v=0
  523502.3193  0.0105 -4.0130 3  911.4327139  71510 303693831      693732        syn-C2H3C(O)NH2, v=0
  523502.3193  0.0105 -4.0130 3  911.4327139  71510 303693832      693733        syn-C2H3C(O)NH2, v=0
  523512.0021  0.0011 -2.8209 3  240.2348 77  71510 303381821      371720        syn-C2H3C(O)NH2, v=0
  523512.0044  0.0011 -2.8209 3  240.2348 77  71510 303381820      371721        syn-C2H3C(O)NH2, v=0
  523530.4812  0.0109 -4.6967 3  604.7589133  71510 303661749      661452        syn-C2H3C(O)NH2, v=0
  523554.7779  0.0074 -5.4129 3  728.0561157  71510 30378 870      77 869        syn-C2H3C(O)NH2, v=0
  523554.7779  0.0074 -3.3340 3  728.0561157  71510 30378 870      77 969        syn-C2H3C(O)NH2, v=0
  523554.7779  0.0074 -3.3340 3  728.0561157  71510 30378 970      77 869        syn-C2H3C(O)NH2, v=0
  523554.7779  0.0074 -5.4129 3  728.0561157  71510 30378 970      77 969        syn-C2H3C(O)NH2, v=0
  523560.1923  0.0273 -4.8725 3 1432.3331189  71510 303943955      943856        syn-C2H3C(O)NH2, v=0
  523560.1923  0.0273 -4.8725 3 1432.3331189  71510 303943956      943857        syn-C2H3C(O)NH2, v=0
  523562.4061  0.0012 -2.7381 3  222.1079 69  71510 303342014      331915        syn-C2H3C(O)NH2, v=0
  523562.4061  0.0012 -2.7381 3  222.1079 69  71510 303342015      331914        syn-C2H3C(O)NH2, v=0
  523600.7634  0.0949 -4.8451 3 1108.6912179  71510 303892366      882465        syn-C2H3C(O)NH2, v=0
  523651.8249  0.0059 -5.7858 3  848.6555143  71510 303713239      703238        syn-C2H3C(O)NH2, v=0
  523651.8249  0.0059 -5.7858 3  848.6555143  71510 303713240      703239        syn-C2H3C(O)NH2, v=0
  523670.3371  0.0011 -2.7765 3  230.3932 73  71510 303361917      351818        syn-C2H3C(O)NH2, v=0
  523670.3371  0.0011 -2.7765 3  230.3932 73  71510 303361918      351817        syn-C2H3C(O)NH2, v=0
  523685.7581  0.0070 -5.4102 3  723.2469155  71510 30377 968      76 967        syn-C2H3C(O)NH2, v=0
  523685.7581  0.0070 -3.3545 3  723.2469155  71510 30377 968      761067        syn-C2H3C(O)NH2, v=0
  523685.7581  0.0070 -3.3545 3  723.2469155  71510 303771068      76 967        syn-C2H3C(O)NH2, v=0
  523685.7581  0.0070 -5.4102 3  723.2469155  71510 303771068      761067        syn-C2H3C(O)NH2, v=0
  523690.8666  0.0411 -4.5133 3  984.3593189  71510 30394 589      94 490        syn-C2H3C(O)NH2, v=0
  523690.8666  0.0411 -4.5133 3  984.3593189  71510 30394 689      94 590        syn-C2H3C(O)NH2, v=0
  523709.4257  0.0013 -3.0422 3  290.8234 91  71510 303451531      441430        syn-C2H3C(O)NH2, v=0
  523770.9057  0.0044 -5.4999 3  729.8442141  71510 303702447      692446        syn-C2H3C(O)NH2, v=0
  523771.8312  0.0044 -5.4999 3  729.8443141  71510 303702446      692445        syn-C2H3C(O)NH2, v=0
  523835.6795  0.0041 -4.6204 3  358.3369103  71510 303511438      511141        syn-C2H3C(O)NH2, v=0
  523848.9463  0.0565 -4.9390 3 1370.5538213  71510 303A61294      A61195        syn-C2H3C(O)NH2, v=0
  523848.9463  0.0565 -4.9390 3 1370.5538213  71510 303A61394      A61295        syn-C2H3C(O)NH2, v=0
  523866.0663  0.0104 -3.9897 3  894.5490137  71510 303683830      683731        syn-C2H3C(O)NH2, v=0
  523866.0663  0.0104 -3.9897 3  894.5490137  71510 303683831      683732        syn-C2H3C(O)NH2, v=0
  523887.1635  0.0066 -3.3768 3  717.8472153  71510 303761066      751165        syn-C2H3C(O)NH2, v=0
  523887.1639  0.0066 -5.4061 3  717.8472153  71510 303761166      751165        syn-C2H3C(O)NH2, v=0
  523887.1643  0.0066 -5.4061 3  717.8472153  71510 303761066      751065        syn-C2H3C(O)NH2, v=0
  523887.1646  0.0066 -3.3768 3  717.8472153  71510 303761166      751065        syn-C2H3C(O)NH2, v=0
  523891.2803  0.0428 -4.6366 3 1141.1529199  71510 30399 891      99 792        syn-C2H3C(O)NH2, v=0
  523891.2803  0.0428 -4.6366 3 1141.1529199  71510 30399 991      99 892        syn-C2H3C(O)NH2, v=0
  523978.2121  0.0067 -4.6683 3  566.4701127  71510 303631944      631647        syn-C2H3C(O)NH2, v=0
  523982.4206  0.0036 -5.2810 3  627.1295135  71510 303671849      661848        syn-C2H3C(O)NH2, v=0
  524084.3846  0.0026 -5.8218 3  102.0130 49  71510 303241410      241113        syn-C2H3C(O)NH2, v=0
  524085.4016  0.0026 -5.8218 3  102.0129 49  71510 303241411      241114        syn-C2H3C(O)NH2, v=0
  524111.7377  0.0039 -5.3275 3  650.6830137  71510 303681949      671948        syn-C2H3C(O)NH2, v=0
  524190.4758  0.0061 -3.4014 3  711.8324151  71510 303751164      741263        syn-C2H3C(O)NH2, v=0
  524190.4876  0.0061 -5.4006 3  711.8324151  71510 303751264      741263        syn-C2H3C(O)NH2, v=0
  524190.4977  0.0061 -5.4006 3  711.8324151  71510 303751164      741163        syn-C2H3C(O)NH2, v=0
  524190.5095  0.0061 -3.4014 3  711.8324151  71510 303751264      741163        syn-C2H3C(O)NH2, v=0
  524215.0754  0.0102 -3.9672 3  877.9149135  71510 303673829      673730        syn-C2H3C(O)NH2, v=0
  524215.0754  0.0102 -3.9672 3  877.9149135  71510 303673830      673731        syn-C2H3C(O)NH2, v=0
  524300.2899  0.0057 -5.7478 3  834.1620143  71510 303713140      703139        syn-C2H3C(O)NH2, v=0
  524300.2899  0.0057 -5.7478 3  834.1620143  71510 303713141      703140        syn-C2H3C(O)NH2, v=0
  524418.9852  0.0262 -4.8304 3 1409.1536187  71510 303933954      933855        syn-C2H3C(O)NH2, v=0
  524418.9852  0.0262 -4.8304 3 1409.1536187  71510 303933955      933856        syn-C2H3C(O)NH2, v=0
  524549.8090  0.0100 -3.9458 3  861.5302133  71510 303663828      663729        syn-C2H3C(O)NH2, v=0
  524549.8090  0.0100 -3.9458 3  861.5302133  71510 303663829      663730        syn-C2H3C(O)NH2, v=0
  524569.0916  0.0526 -5.5487 3 1800.8685217  71510 303A84068      A83969        syn-C2H3C(O)NH2, v=0
  524569.0916  0.0526 -5.5487 3 1800.8685217  71510 303A84069      A83970        syn-C2H3C(O)NH2, v=0
  524635.2995  0.0039 -5.3748 3  675.3013139  71510 303692050      682049        syn-C2H3C(O)NH2, v=0
  524644.6096  0.0057 -3.4294 3  705.1696149  71510 303741262      731361        syn-C2H3C(O)NH2, v=0
  524644.9079  0.0057 -5.3935 3  705.1696149  71510 303741362      731361        syn-C2H3C(O)NH2, v=0
  524645.1476  0.0057 -5.3935 3  705.1696149  71510 303741262      731261        syn-C2H3C(O)NH2, v=0
  524645.4459  0.0057 -3.4294 3  705.1696149  71510 303741362      731261        syn-C2H3C(O)NH2, v=0
  524809.9604  0.0443 -4.5369 3  890.6561183  71510 30391 388      91 289        syn-C2H3C(O)NH2, v=0
  524809.9604  0.0443 -4.5369 3  890.6561183  71510 30391 488      91 389        syn-C2H3C(O)NH2, v=0
  524870.7177  0.0099 -3.9253 3  845.3946131  71510 303653827      653728        syn-C2H3C(O)NH2, v=0
  524870.7177  0.0099 -3.9253 3  845.3946131  71510 303653828      653729        syn-C2H3C(O)NH2, v=0
  524905.7653  0.0042 -3.5344 3  545.5380127  71510 303631648      621547        syn-C2H3C(O)NH2, v=0
  524911.2413  0.0629 -5.0397 3 1436.4046217  71510 303A81395      A81296        syn-C2H3C(O)NH2, v=0
  524911.2413  0.0629 -5.0397 3 1436.4046217  71510 303A81495      A81396        syn-C2H3C(O)NH2, v=0
  525017.1941  0.0055 -5.7110 3  820.1743143  71510 303713041      703040        syn-C2H3C(O)NH2, v=0
  525017.1941  0.0055 -5.7110 3  820.1743143  71510 303713042      703041        syn-C2H3C(O)NH2, v=0
  525021.7001  0.0013 -3.0403 3  290.7873 91  71510 303451530      441431        syn-C2H3C(O)NH2, v=0
  525118.7961  0.0025 -5.8814 3   48.3743 35  71510 3031711 7      16 8 8        syn-C2H3C(O)NH2, v=0
  525123.3467  0.0025 -5.8814 3   48.3742 35  71510 3031711 6      16 8 9        syn-C2H3C(O)NH2, v=0
  525178.2399  0.0098 -3.9058 3  829.5079129  71510 303643826      643727        syn-C2H3C(O)NH2, v=0
  525178.2399  0.0098 -3.9058 3  829.5079129  71510 303643827      643728        syn-C2H3C(O)NH2, v=0
  525245.9812  0.0027 -5.9413 3   96.0944 47  71510 3032314 9      231112        syn-C2H3C(O)NH2, v=0
  525246.3676  0.0027 -5.9413 3   96.0944 47  71510 303231410      231113        syn-C2H3C(O)NH2, v=0
  525248.3817  0.0251 -4.7889 3 1386.2300185  71510 303923953      923854        syn-C2H3C(O)NH2, v=0
  525248.3817  0.0251 -4.7889 3 1386.2300185  71510 303923954      923855        syn-C2H3C(O)NH2, v=0
  525287.4249  0.0040 -3.5513 3  663.2101141  71510 303701655      691554        syn-C2H3C(O)NH2, v=0
  525325.0672  0.0053 -3.4626 3  697.8129147  71510 303731360      721459        syn-C2H3C(O)NH2, v=0
  525331.2168  0.0053 -5.3845 3  697.8129147  71510 303731460      721459        syn-C2H3C(O)NH2, v=0
  525335.7968  0.0053 -5.3845 3  697.8125147  71510 303731360      721359        syn-C2H3C(O)NH2, v=0
  525341.9463  0.0053 -3.4626 3  697.8125147  71510 303731460      721359        syn-C2H3C(O)NH2, v=0
  525371.9338  0.0497 -4.8227 3  799.9185177  71510 30388 187      88 088        syn-C2H3C(O)NH2, v=0
  525371.9338  0.0497 -4.8227 3  799.9185177  71510 30388 287      88 188        syn-C2H3C(O)NH2, v=0
  525472.5939  0.0050 -5.9074 3   56.5188 45  71510 30322 716      21 219        syn-C2H3C(O)NH2, v=0
  525472.8027  0.0097 -3.8874 3  813.8699127  71510 303633825      633726        syn-C2H3C(O)NH2, v=0
  525472.8027  0.0097 -3.8874 3  813.8699127  71510 303633826      633727        syn-C2H3C(O)NH2, v=0
  525534.5749  0.0044 -5.4710 3  719.6151141  71510 303702348      692347        syn-C2H3C(O)NH2, v=0
  525543.3677  0.0044 -5.4710 3  719.6155141  71510 303702347      692346        syn-C2H3C(O)NH2, v=0
  525651.3798  0.0459 -4.7108 3 1202.5849203  71510 303A1 992      A1 893        syn-C2H3C(O)NH2, v=0
  525651.3798  0.0459 -4.7108 3 1202.5849203  71510 303A11092      A1 993        syn-C2H3C(O)NH2, v=0
  525749.5805  0.0353 -4.3319 3  890.4350161  71510 303802060      792159        syn-C2H3C(O)NH2, v=0
  525754.8226  0.0096 -3.8701 3  798.4805125  71510 303623824      623725        syn-C2H3C(O)NH2, v=0
  525754.8226  0.0096 -3.8701 3  798.4805125  71510 303623825      623726        syn-C2H3C(O)NH2, v=0
  525788.0827  0.0704 -5.1458 3 1503.4969221  71510 303B01496      B01397        syn-C2H3C(O)NH2, v=0
  525788.0827  0.0704 -5.1458 3 1503.4969221  71510 303B01596      B01497        syn-C2H3C(O)NH2, v=0
  525797.3042  0.0043 -5.4240 3  166.8433 71  71510 303351124      35 629        syn-C2H3C(O)NH2, v=0
  525814.9120  0.0054 -5.6755 3  806.6983143  71510 303712942      702941        syn-C2H3C(O)NH2, v=0
  525814.9120  0.0054 -5.6755 3  806.6983143  71510 303712943      702942        syn-C2H3C(O)NH2, v=0
  525840.9060  0.0504 -5.4973 3 1774.1113215  71510 303A74067      A73968        syn-C2H3C(O)NH2, v=0
  525840.9060  0.0504 -5.4973 3 1774.1113215  71510 303A74068      A73969        syn-C2H3C(O)NH2, v=0
  525841.5575  0.0040 -4.8260 3  268.8163 91  71510 303451135      45 838        syn-C2H3C(O)NH2, v=0
  525841.7625  0.0058 -5.6971 3  144.2660 71  71510 30335 530      35 233        syn-C2H3C(O)NH2, v=0
  525871.4490  0.0045 -5.0189 3   90.8448 61  71510 30330 228      29 129        syn-C2H3C(O)NH2, v=0
  525871.5863  0.0045 -5.0189 3   90.8448 61  71510 30330 328      29 029        syn-C2H3C(O)NH2, v=0
  525890.8443  0.0058 -5.6970 3  144.2660 71  71510 30335 630      35 333        syn-C2H3C(O)NH2, v=0
  525919.6512  0.0420 -4.5522 3 1042.5725193  71510 30396 690      96 591        syn-C2H3C(O)NH2, v=0
  525919.6512  0.0420 -4.5522 3 1042.5725193  71510 30396 790      96 691        syn-C2H3C(O)NH2, v=0
  526008.1371  0.0034 -5.7094 3   59.8241 45  71510 30322 815      21 318        syn-C2H3C(O)NH2, v=0
  526024.7050  0.0095 -3.8539 3  783.3393123  71510 303613823      613724        syn-C2H3C(O)NH2, v=0
  526024.7050  0.0095 -3.8539 3  783.3393123  71510 303613824      613725        syn-C2H3C(O)NH2, v=0
  526043.3897  0.0718 -4.6731 3 1033.3034173  71510 303862264      852363        syn-C2H3C(O)NH2, v=0
  526049.3157  0.0241 -4.7482 3 1363.5619183  71510 303913952      913853        syn-C2H3C(O)NH2, v=0
  526049.3157  0.0241 -4.7482 3 1363.5619183  71510 303913953      913854        syn-C2H3C(O)NH2, v=0
  526144.4750  0.0035 -5.2851 3  635.0629137  71510 303681652      671651        syn-C2H3C(O)NH2, v=0
  526274.8104  0.0048 -3.5043 3  689.6962145  71510 303721458      711557        syn-C2H3C(O)NH2, v=0
  526282.8456  0.0095 -3.8390 3  768.4463121  71510 303603822      603723        syn-C2H3C(O)NH2, v=0
  526282.8456  0.0095 -3.8390 3  768.4463121  71510 303603823      603724        syn-C2H3C(O)NH2, v=0
  526376.4163  0.0048 -5.3732 3  689.6962145  71510 303721558      711557        syn-C2H3C(O)NH2, v=0
  526430.4499  0.0041 -5.3720 3  675.3986139  71510 303692049      682048        syn-C2H3C(O)NH2, v=0
  526445.2203  0.0048 -5.3731 3  689.6905145  71510 303721458      711457        syn-C2H3C(O)NH2, v=0
  526473.0365  0.0790 -5.2569 3 1571.8254225  71510 303B21597      B21498        syn-C2H3C(O)NH2, v=0
  526473.0365  0.0790 -5.2569 3 1571.8254225  71510 303B21697      B21598        syn-C2H3C(O)NH2, v=0
  526529.6300  0.0095 -3.8253 3  753.8012119  71510 303593821      593722        syn-C2H3C(O)NH2, v=0
  526529.6300  0.0095 -3.8253 3  753.8012119  71510 303593822      593723        syn-C2H3C(O)NH2, v=0
  526530.6664  0.0038 -5.3343 3  660.4890139  71510 303691852      681851        syn-C2H3C(O)NH2, v=0
  526538.5008  0.0045 -3.5636 3  680.7318143  71510 303711556      701655        syn-C2H3C(O)NH2, v=0
  526546.8261  0.0048 -3.5038 3  689.6905145  71510 303721558      711457        syn-C2H3C(O)NH2, v=0
  526643.9482  0.0094 -4.6924 3  548.9032127  71510 303631647      631350        syn-C2H3C(O)NH2, v=0
  526709.1260  0.0053 -5.6412 3  793.7411143  71510 303712844      702843        syn-C2H3C(O)NH2, v=0
  526709.1261  0.0053 -5.6412 3  793.7411143  71510 303712843      702842        syn-C2H3C(O)NH2, v=0
  526743.8386  0.1447 -5.8797 3 1931.8046245  71510 303C220A2      C219A3        syn-C2H3C(O)NH2, v=0
  526743.8386  0.1447 -5.8797 3 1931.8046245  71510 303C221A2      C220A3        syn-C2H3C(O)NH2, v=0
  526756.1285  0.0023 -4.8276 3  237.0241 81  71510 303401526      401229        syn-C2H3C(O)NH2, v=0
  526765.4343  0.0094 -3.8130 3  739.4038117  71510 303583820      583721        syn-C2H3C(O)NH2, v=0
  526765.4343  0.0094 -3.8130 3  739.4038117  71510 303583821      583722        syn-C2H3C(O)NH2, v=0
  526796.4511  0.0039 -5.3516 3  667.6390139  71510 303691951      681950        syn-C2H3C(O)NH2, v=0
  526821.2611  0.0060 -4.7432 3  351.6366103  71510 303511239      51 942        syn-C2H3C(O)NH2, v=0
  526822.6842  0.0232 -4.7081 3 1341.1489181  71510 303903951      903852        syn-C2H3C(O)NH2, v=0
  526822.6842  0.0232 -4.7081 3 1341.1489181  71510 303903952      903853        syn-C2H3C(O)NH2, v=0
  526868.0451  0.0020 -4.8051 3   85.8130 51  71510 303251015      24 718        syn-C2H3C(O)NH2, v=0
  526947.5479  0.0051 -3.6673 3  688.5314143  71510 303711655      701754        syn-C2H3C(O)NH2, v=0
  526959.0248  0.0890 -5.3727 3 1641.3841229  71510 303B41698      B41599        syn-C2H3C(O)NH2, v=0
  526959.0248  0.0890 -5.3727 3 1641.3841229  71510 303B41798      B41699        syn-C2H3C(O)NH2, v=0
  526987.2512  0.0516 -4.5014 3  960.5523167  71510 303832162      822261        syn-C2H3C(O)NH2, v=0
  526990.6255  0.0095 -3.8021 3  725.2539115  71510 303573819      573720        syn-C2H3C(O)NH2, v=0
  526990.6255  0.0095 -3.8021 3  725.2539115  71510 303573820      573721        syn-C2H3C(O)NH2, v=0
  527070.3872  0.0483 -5.4467 3 1747.6143213  71510 303A64066      A63967        syn-C2H3C(O)NH2, v=0
  527070.3872  0.0483 -5.4467 3 1747.6143213  71510 303A64067      A63968        syn-C2H3C(O)NH2, v=0
  527101.9097  0.0016 -3.1758 3  308.2071 95  71510 303471433      461334        syn-C2H3C(O)NH2, v=0
  527140.8015  0.1280 -5.7467 3 1857.3838241  71510 303C019A1      C018A2        syn-C2H3C(O)NH2, v=0
  527140.8015  0.1280 -5.7467 3 1857.3838241  71510 303C020A1      C019A2        syn-C2H3C(O)NH2, v=0
  527205.5616  0.0095 -3.7928 3  711.3514113  71510 303563818      563719        syn-C2H3C(O)NH2, v=0
  527205.5616  0.0095 -3.7928 3  711.3514113  71510 303563819      563720        syn-C2H3C(O)NH2, v=0
  527230.4305  0.0083 -4.7054 3  657.8120137  71510 303682048      681751        syn-C2H3C(O)NH2, v=0
  527238.2380  0.1003 -5.4931 3 1712.1674233  71510 303B61799      B616A0        syn-C2H3C(O)NH2, v=0
  527238.2380  0.1003 -5.4931 3 1712.1674233  71510 303B61899      B617A0        syn-C2H3C(O)NH2, v=0
  527248.8642  0.0498 -4.7933 3 1265.2801207  71510 303A31093      A3 994        syn-C2H3C(O)NH2, v=0
  527248.8642  0.0498 -4.7933 3 1265.2801207  71510 303A31193      A31094        syn-C2H3C(O)NH2, v=0
  527302.0313  0.1133 -5.6178 3 1784.1694237  71510 303B818A0      B817A1        syn-C2H3C(O)NH2, v=0
  527302.0314  0.1133 -5.6178 3 1784.1694237  71510 303B819A0      B818A1        syn-C2H3C(O)NH2, v=0
  527329.3076  0.0439 -4.5257 3  946.8990187  71510 30393 489      93 390        syn-C2H3C(O)NH2, v=0
  527329.3076  0.0439 -4.5257 3  946.8990187  71510 30393 589      93 490        syn-C2H3C(O)NH2, v=0
  527410.5920  0.0095 -3.7850 3  697.6961111  71510 303553817      553718        syn-C2H3C(O)NH2, v=0
  527410.5920  0.0095 -3.7850 3  697.6961111  71510 303553818      553719        syn-C2H3C(O)NH2, v=0
  527521.3229  0.0024 -4.8751 3  227.0533 79  71510 303391524      391227        syn-C2H3C(O)NH2, v=0
  527569.3489  0.0223 -4.6687 3 1318.9908179  71510 303893950      893851        syn-C2H3C(O)NH2, v=0
  527569.3489  0.0223 -4.6687 3 1318.9908179  71510 303893951      893852        syn-C2H3C(O)NH2, v=0
  527606.0576  0.0096 -3.7791 3  684.2877109  71510 303543816      543717        syn-C2H3C(O)NH2, v=0
  527606.0576  0.0096 -3.7791 3  684.2877109  71510 303543817      543718        syn-C2H3C(O)NH2, v=0
  527674.2476  0.0044 -5.4430 3  710.0046141  71510 303702249      692248        syn-C2H3C(O)NH2, v=0
  527720.1343  0.0052 -5.6081 3  781.3115143  71510 303712745      702744        syn-C2H3C(O)NH2, v=0
  527720.1354  0.0052 -5.6081 3  781.3115143  71510 303712744      702743        syn-C2H3C(O)NH2, v=0
  527746.4801  0.0044 -5.4429 3  710.0077141  71510 303702248      692247        syn-C2H3C(O)NH2, v=0
  527752.8128  0.0236 -4.8265 3  854.0034157  71510 303782157      781860        syn-C2H3C(O)NH2, v=0
  527792.2911  0.0096 -3.7750 3  671.1262107  71510 303533815      533716        syn-C2H3C(O)NH2, v=0
  527792.2911  0.0096 -3.7750 3  671.1262107  71510 303533816      533717        syn-C2H3C(O)NH2, v=0
  527841.7453  0.0045 -5.3593 3  680.7318143  71510 303711656      701655        syn-C2H3C(O)NH2, v=0
  527969.6173  0.0097 -3.7731 3  658.2114105  71510 303523814      523715        syn-C2H3C(O)NH2, v=0
  527969.6173  0.0097 -3.7731 3  658.2114105  71510 303523815      523716        syn-C2H3C(O)NH2, v=0
  527998.7331  0.0436 -4.6062 3 1102.0644197  71510 30398 791      98 692        syn-C2H3C(O)NH2, v=0
  527998.7331  0.0436 -4.6062 3 1102.0644197  71510 30398 891      98 792        syn-C2H3C(O)NH2, v=0
  528053.7372  0.0012 -2.9514 3  275.2766 87  71510 303431628      421527        syn-C2H3C(O)NH2, v=0
  528091.7354  0.0012 -2.9513 3  275.2755 87  71510 303431627      421528        syn-C2H3C(O)NH2, v=0
  528138.3533  0.0098 -3.7735 3  645.5430103  71510 303513813      513714        syn-C2H3C(O)NH2, v=0
  528138.3533  0.0098 -3.7735 3  645.5430103  71510 303513814      513715        syn-C2H3C(O)NH2, v=0
  528165.2111  0.0484 -4.6309 3  854.1718181  71510 30390 288      90 189        syn-C2H3C(O)NH2, v=0
  528165.2111  0.0484 -4.6309 3  854.1718181  71510 30390 388      90 289        syn-C2H3C(O)NH2, v=0
  528259.0440  0.0462 -5.3967 3 1721.3771211  71510 303A54065      A53966        syn-C2H3C(O)NH2, v=0
  528259.0440  0.0462 -5.3967 3 1721.3771211  71510 303A54066      A53967        syn-C2H3C(O)NH2, v=0
  528287.9827  0.0019 -3.7456 3  171.3100 73  71510 303361027      35 728        syn-C2H3C(O)NH2, v=0
  528290.1391  0.0214 -4.6300 3 1297.0873177  71510 303883949      883850        syn-C2H3C(O)NH2, v=0
  528290.1391  0.0214 -4.6300 3 1297.0873177  71510 303883950      883851        syn-C2H3C(O)NH2, v=0
  528298.8083  0.0099 -3.7766 3  633.1210101  71510 303503812      503713        syn-C2H3C(O)NH2, v=0
  528298.8083  0.0099 -3.7766 3  633.1210101  71510 303503813      503714        syn-C2H3C(O)NH2, v=0
  528331.9424  0.0046 -5.0685 3  215.2299 83  71510 30341 833      41 536        syn-C2H3C(O)NH2, v=0
  528451.2845  0.0100 -3.7826 3  620.9451 99  71510 303493811      493712        syn-C2H3C(O)NH2, v=0
  528451.2845  0.0100 -3.7826 3  620.9451 99  71510 303493812      493713        syn-C2H3C(O)NH2, v=0
  528596.0765  0.0102 -3.7921 3  609.0153 97  71510 303483810      483711        syn-C2H3C(O)NH2, v=0
  528596.0765  0.0102 -3.7921 3  609.0153 97  71510 303483811      483712        syn-C2H3C(O)NH2, v=0
  528615.1337  0.0045 -5.3579 3  680.6626143  71510 303711556      701555        syn-C2H3C(O)NH2, v=0
  528641.9667  0.0041 -4.9341 3  241.4041 87  71510 303431034      43 737        syn-C2H3C(O)NH2, v=0
  528679.3806  0.0546 -4.8829 3 1329.2334211  71510 303A51194      A51095        syn-C2H3C(O)NH2, v=0
  528679.3806  0.0546 -4.8829 3 1329.2334211  71510 303A51294      A51195        syn-C2H3C(O)NH2, v=0
  528733.4721  0.0103 -3.8056 3  597.3313 95  71510 3034738 9      473710        syn-C2H3C(O)NH2, v=0
  528733.4721  0.0103 -3.8056 3  597.3313 95  71510 303473810      473711        syn-C2H3C(O)NH2, v=0
  528863.7517  0.0104 -3.8237 3  585.8930 93  71510 3034638 8      4637 9        syn-C2H3C(O)NH2, v=0
  528863.7517  0.0104 -3.8237 3  585.8930 93  71510 3034638 9      463710        syn-C2H3C(O)NH2, v=0
  528874.9001  0.0051 -5.5762 3  769.4205143  71510 303712646      702645        syn-C2H3C(O)NH2, v=0
  528874.9144  0.0051 -5.5762 3  769.4205143  71510 303712645      702644        syn-C2H3C(O)NH2, v=0
  528886.5906  0.0041 -5.3442 3  670.8896141  71510 303701754      691753        syn-C2H3C(O)NH2, v=0
  528907.4671  0.0053 -5.4325 3  166.6484 75  71510 30337 631      37 334        syn-C2H3C(O)NH2, v=0
  528957.7683  0.0018 -2.6014 3  209.0213 51  71510 3032525 0      2424 1        syn-C2H3C(O)NH2, v=0
  528957.7683  0.0018 -2.6014 3  209.0213 51  71510 3032525 1      2424 0        syn-C2H3C(O)NH2, v=0
  528985.8528  0.0206 -4.5921 3 1275.4379175  71510 303873948      873849        syn-C2H3C(O)NH2, v=0
  528985.8528  0.0206 -4.5921 3 1275.4379175  71510 303873949      873850        syn-C2H3C(O)NH2, v=0
  528987.1894  0.0106 -3.8477 3  574.7003 91  71510 3034538 7      4537 8        syn-C2H3C(O)NH2, v=0
  528987.1894  0.0106 -3.8477 3  574.7003 91  71510 3034538 8      4537 9        syn-C2H3C(O)NH2, v=0
  529089.4931  0.0075 -5.9646 3  929.0001145  71510 303723636      713635        syn-C2H3C(O)NH2, v=0
  529089.4931  0.0075 -5.9646 3  929.0001145  71510 303723637      713636        syn-C2H3C(O)NH2, v=0
  529101.4085  0.0053 -5.4323 3  166.6484 75  71510 30337 731      37 434        syn-C2H3C(O)NH2, v=0
  529104.0522  0.0108 -3.8789 3  563.7531 89  71510 3034438 6      4437 7        syn-C2H3C(O)NH2, v=0
  529104.0522  0.0108 -3.8789 3  563.7531 89  71510 3034438 7      4437 8        syn-C2H3C(O)NH2, v=0
  529134.8436  0.0014 -3.0642 3  302.1863 93  71510 303461532      451431        syn-C2H3C(O)NH2, v=0
  529214.6006  0.0109 -3.9193 3  553.0511 87  71510 3034338 5      4337 6        syn-C2H3C(O)NH2, v=0
  529214.6006  0.0109 -3.9193 3  553.0511 87  71510 3034338 6      4337 7        syn-C2H3C(O)NH2, v=0
  529319.0886  0.0111 -3.9724 3  542.5943 85  71510 3034238 4      4237 5        syn-C2H3C(O)NH2, v=0
  529319.0886  0.0111 -3.9724 3  542.5943 85  71510 3034238 5      4237 6        syn-C2H3C(O)NH2, v=0
  529327.2227  0.0086 -4.6943 3  495.6538121  71510 303601545      601248        syn-C2H3C(O)NH2, v=0
  529393.7482  0.0016 -2.6247 3  210.3468 55  71510 3032724 3      2623 4        syn-C2H3C(O)NH2, v=0
  529393.7482  0.0016 -2.6247 3  210.3468 55  71510 3032724 4      2623 3        syn-C2H3C(O)NH2, v=0
  529408.3084  0.0443 -5.3473 3 1695.3993209  71510 303A44064      A43965        syn-C2H3C(O)NH2, v=0
  529408.3084  0.0443 -5.3473 3 1695.3993209  71510 303A44065      A43966        syn-C2H3C(O)NH2, v=0
  529417.7638  0.0113 -4.0435 3  532.3824 83  71510 3034138 3      4137 4        syn-C2H3C(O)NH2, v=0
  529417.7638  0.0113 -4.0435 3  532.3824 83  71510 3034138 4      4137 5        syn-C2H3C(O)NH2, v=0
  529425.0939  0.0098 -5.4333 3  759.1754167  71510 30383 479      82 478        syn-C2H3C(O)NH2, v=0
  529425.0939  0.0098 -3.2811 3  759.1754167  71510 30383 479      82 578        syn-C2H3C(O)NH2, v=0
  529425.0939  0.0098 -3.2811 3  759.1754167  71510 30383 579      82 478        syn-C2H3C(O)NH2, v=0
  529425.0939  0.0098 -5.4333 3  759.1754167  71510 30383 579      82 578        syn-C2H3C(O)NH2, v=0
  529429.0128  0.0105 -5.4304 3  761.2531169  71510 30384 381      83 380        syn-C2H3C(O)NH2, v=0
  529429.0128  0.0105 -3.2641 3  761.2531169  71510 30384 381      83 480        syn-C2H3C(O)NH2, v=0
  529429.0128  0.0105 -3.2641 3  761.2531169  71510 30384 481      83 380        syn-C2H3C(O)NH2, v=0
  529429.0128  0.0105 -5.4304 3  761.2531169  71510 30384 481      83 480        syn-C2H3C(O)NH2, v=0
  529431.1322  0.0093 -5.4351 3  756.5721165  71510 30382 577      81 576        syn-C2H3C(O)NH2, v=0
  529431.1322  0.0093 -3.2984 3  756.5721165  71510 30382 577      81 676        syn-C2H3C(O)NH2, v=0
  529431.1322  0.0093 -3.2984 3  756.5721165  71510 30382 677      81 576        syn-C2H3C(O)NH2, v=0
  529431.1322  0.0093 -5.4351 3  756.5721165  71510 30382 677      81 676        syn-C2H3C(O)NH2, v=0
  529438.6324  0.0116 -5.4265 3  762.8121171  71510 30385 283      84 282        syn-C2H3C(O)NH2, v=0
  529438.6324  0.0116 -3.2470 3  762.8121171  71510 30385 283      84 382        syn-C2H3C(O)NH2, v=0
  529438.6324  0.0116 -3.2470 3  762.8121171  71510 30385 383      84 282        syn-C2H3C(O)NH2, v=0
  529438.6324  0.0116 -5.4265 3  762.8121171  71510 30385 383      84 382        syn-C2H3C(O)NH2, v=0
  529450.6650  0.0133 -5.4216 3  763.8579173  71510 30386 185      85 184        syn-C2H3C(O)NH2, v=0
  529450.6650  0.0133 -3.2299 3  763.8579173  71510 30386 185      85 284        syn-C2H3C(O)NH2, v=0
  529450.6650  0.0133 -3.2299 3  763.8579173  71510 30386 285      85 184        syn-C2H3C(O)NH2, v=0
  529450.6650  0.0133 -5.4216 3  763.8579173  71510 30386 285      85 284        syn-C2H3C(O)NH2, v=0
  529452.7101  0.0089 -5.4358 3  753.4353163  71510 30381 675      80 674        syn-C2H3C(O)NH2, v=0
  529452.7101  0.0089 -3.3159 3  753.4353163  71510 30381 675      80 774        syn-C2H3C(O)NH2, v=0
  529452.7101  0.0089 -3.3159 3  753.4353163  71510 30381 775      80 674        syn-C2H3C(O)NH2, v=0
  529452.7101  0.0089 -5.4358 3  753.4353163  71510 30381 775      80 774        syn-C2H3C(O)NH2, v=0
  529462.5431  0.0157 -5.4158 3  764.3954175  71510 30387 087      86 086        syn-C2H3C(O)NH2, v=0
  529462.5431  0.0157 -3.2127 3  764.3954175  71510 30387 087      86 186        syn-C2H3C(O)NH2, v=0
  529462.5431  0.0157 -3.2127 3  764.3954175  71510 30387 187      86 086        syn-C2H3C(O)NH2, v=0
  529462.5431  0.0157 -5.4158 3  764.3954175  71510 30387 187      86 186        syn-C2H3C(O)NH2, v=0
  529497.2592  0.0085 -5.4354 3  749.7552161  71510 30380 773      79 772        syn-C2H3C(O)NH2, v=0
  529497.2592  0.0085 -3.3340 3  749.7552161  71510 30380 773      79 872        syn-C2H3C(O)NH2, v=0
  529497.2592  0.0085 -3.3340 3  749.7552161  71510 30380 873      79 772        syn-C2H3C(O)NH2, v=0
  529497.2592  0.0085 -5.4354 3  749.7552161  71510 30380 873      79 872        syn-C2H3C(O)NH2, v=0
  529510.8674  0.0115 -4.1430 3  522.4155 81  71510 3034038 2      4037 3        syn-C2H3C(O)NH2, v=0
  529510.8674  0.0115 -4.1430 3  522.4155 81  71510 3034038 3      4037 4        syn-C2H3C(O)NH2, v=0
  529566.5221  0.0072 -5.9217 3  912.5397145  71510 303723537      713536        syn-C2H3C(O)NH2, v=0
  529566.5221  0.0072 -5.9217 3  912.5397145  71510 303723538      713537        syn-C2H3C(O)NH2, v=0
  529574.8532  0.0081 -5.4339 3  745.5200159  71510 30379 871      78 870        syn-C2H3C(O)NH2, v=0
  529574.8532  0.0081 -3.3528 3  745.5200159  71510 30379 871      78 970        syn-C2H3C(O)NH2, v=0
  529574.8532  0.0081 -3.3528 3  745.5200159  71510 30379 971      78 870        syn-C2H3C(O)NH2, v=0
  529574.8532  0.0081 -5.4339 3  745.5200159  71510 30379 971      78 970        syn-C2H3C(O)NH2, v=0
  529598.6346  0.0117 -4.2939 3  512.6934 79  71510 3033938 1      3937 2        syn-C2H3C(O)NH2, v=0
  529598.6346  0.0117 -4.2939 3  512.6934 79  71510 3033938 2      3937 3        syn-C2H3C(O)NH2, v=0
  529657.2592  0.0199 -4.5548 3 1254.0424173  71510 303863947      863848        syn-C2H3C(O)NH2, v=0
  529657.2592  0.0199 -4.5548 3 1254.0424173  71510 303863948      863849        syn-C2H3C(O)NH2, v=0
  529681.2940  0.0119 -4.5701 3  503.2158 77  71510 3033838 0      3837 1        syn-C2H3C(O)NH2, v=0
  529681.2940  0.0119 -4.5701 3  503.2158 77  71510 3033838 1      3837 2        syn-C2H3C(O)NH2, v=0
  529699.4492  0.0077 -5.4311 3  740.7152157  71510 30378 969      77 968        syn-C2H3C(O)NH2, v=0
  529699.4492  0.0077 -3.3727 3  740.7152157  71510 30378 969      771068        syn-C2H3C(O)NH2, v=0
  529699.4492  0.0077 -3.3727 3  740.7152157  71510 303781069      77 968        syn-C2H3C(O)NH2, v=0
  529699.4492  0.0077 -5.4311 3  740.7152157  71510 303781069      771068        syn-C2H3C(O)NH2, v=0
  529706.4485  0.0442 -4.5453 3 1004.4306191  71510 30395 590      95 491        syn-C2H3C(O)NH2, v=0
  529706.4485  0.0442 -4.5453 3 1004.4306191  71510 30395 690      95 591        syn-C2H3C(O)NH2, v=0
  529800.1728  0.0012 -2.8839 3  261.5921 83  71510 303411725      401624        syn-C2H3C(O)NH2, v=0
  529800.8047  0.0012 -2.8839 3  261.5921 83  71510 303411724      401625        syn-C2H3C(O)NH2, v=0
  529815.1603  0.0015 -2.6499 3  213.1405 59  71510 3032923 6      2822 7        syn-C2H3C(O)NH2, v=0
  529815.1603  0.0015 -2.6499 3  213.1405 59  71510 3032923 7      2822 6        syn-C2H3C(O)NH2, v=0
  529882.0772  0.0034 -5.2559 3  622.2220135  71510 303671750      661749        syn-C2H3C(O)NH2, v=0
  529888.0529  0.0031 -4.5976 3  101.8325 57  71510 30328 919      27 622        syn-C2H3C(O)NH2, v=0
  529890.9219  0.0073 -3.3942 3  735.3222155  71510 303771067      761166        syn-C2H3C(O)NH2, v=0
  529890.9221  0.0073 -5.4270 3  735.3222155  71510 303771167      761166        syn-C2H3C(O)NH2, v=0
  529890.9223  0.0073 -5.4270 3  735.3222155  71510 303771067      761066        syn-C2H3C(O)NH2, v=0
  529890.9225  0.0073 -3.3942 3  735.3222155  71510 303771167      761066        syn-C2H3C(O)NH2, v=0
  529918.3783  0.0045 -3.5577 3  680.6626143  71510 303711656      701555        syn-C2H3C(O)NH2, v=0
  529924.7988  0.0461 -4.6720 3 1162.8299201  71510 303A0 892      A0 793        syn-C2H3C(O)NH2, v=0
  529924.7988  0.0461 -4.6720 3 1162.8299201  71510 303A0 992      A0 893        syn-C2H3C(O)NH2, v=0
  529938.1917  0.0603 -4.9790 3 1394.4394215  71510 303A71295      A71196        syn-C2H3C(O)NH2, v=0
  529938.1917  0.0603 -4.9790 3 1394.4394215  71510 303A71395      A71296        syn-C2H3C(O)NH2, v=0
  529946.3630  0.0049 -5.2292 3  190.3071 79  71510 30339 732      39 435        syn-C2H3C(O)NH2, v=0
  530027.4440  0.0069 -4.7177 3  397.0121109  71510 303541341      541044        syn-C2H3C(O)NH2, v=0
  530083.6799  0.0069 -5.8801 3  896.5712145  71510 303723438      713437        syn-C2H3C(O)NH2, v=0
  530083.6799  0.0069 -5.8801 3  896.5712145  71510 303723439      713438        syn-C2H3C(O)NH2, v=0
  530143.0405  0.0772 -5.9979 3 2041.4573233  71510 303B64175      B64076        syn-C2H3C(O)NH2, v=0
  530143.0411  0.0772 -5.9979 3 2041.4573233  71510 303B64176      B64077        syn-C2H3C(O)NH2, v=0
  530176.7953  0.0080 -5.7961 3   66.6335 49  71510 30324 618      23 321        syn-C2H3C(O)NH2, v=0
  530178.5786  0.0068 -3.4179 3  729.3175153  71510 303761165      751264        syn-C2H3C(O)NH2, v=0
  530178.5849  0.0068 -5.4214 3  729.3175153  71510 303761265      751264        syn-C2H3C(O)NH2, v=0
  530178.5903  0.0068 -5.4214 3  729.3175153  71510 303761165      751164        syn-C2H3C(O)NH2, v=0
  530178.5967  0.0068 -3.4179 3  729.3175153  71510 303761265      751164        syn-C2H3C(O)NH2, v=0
  530205.4132  0.0013 -2.6776 3  217.4117 63  71510 3033122 9      302110        syn-C2H3C(O)NH2, v=0
  530205.4132  0.0013 -2.6776 3  217.4117 63  71510 303312210      3021 9        syn-C2H3C(O)NH2, v=0
  530210.4025  0.0050 -5.5453 3  758.0822143  71510 303712547      702546        syn-C2H3C(O)NH2, v=0
  530210.5701  0.0050 -5.5453 3  758.0823143  71510 303712546      702545        syn-C2H3C(O)NH2, v=0
  530251.3405  0.0044 -5.4160 3  701.0542141  71510 303702150      692149        syn-C2H3C(O)NH2, v=0
  530274.0109  0.0038 -5.3092 3  652.6132139  71510 303691653      681652        syn-C2H3C(O)NH2, v=0
  530305.0997  0.0192 -4.5183 3 1232.9005171  71510 303853946      853847        syn-C2H3C(O)NH2, v=0
  530305.0997  0.0192 -4.5183 3 1232.9005171  71510 303853947      853848        syn-C2H3C(O)NH2, v=0
  530411.4141  0.0044 -5.0659 3  215.2299 83  71510 30341 933      41 636        syn-C2H3C(O)NH2, v=0
  530441.2567  0.0042 -4.5660 3  102.8577 63  71510 30331 328      30 229        syn-C2H3C(O)NH2, v=0
  530443.1980  0.0042 -4.5660 3  102.8577 63  71510 30331 428      30 129        syn-C2H3C(O)NH2, v=0
  530519.5411  0.0424 -5.2987 3 1669.6805207  71510 303A34063      A33964        syn-C2H3C(O)NH2, v=0
  530519.5411  0.0424 -5.2987 3 1669.6805207  71510 303A34064      A33965        syn-C2H3C(O)NH2, v=0
  530537.2795  0.0012 -2.7085 3  223.1729 67  71510 303332112      322013        syn-C2H3C(O)NH2, v=0
  530537.2795  0.0012 -2.7085 3  223.1729 67  71510 303332113      322012        syn-C2H3C(O)NH2, v=0
  530571.1261  0.0011 -2.8292 3  249.6079 79  71510 303391822      381721        syn-C2H3C(O)NH2, v=0
  530571.1322  0.0011 -2.8292 3  249.6079 79  71510 303391821      381722        syn-C2H3C(O)NH2, v=0
  530607.5210  0.0063 -3.4448 3  722.6698151  71510 303751263      741362        syn-C2H3C(O)NH2, v=0
  530607.6857  0.0063 -5.4143 3  722.6698151  71510 303751363      741362        syn-C2H3C(O)NH2, v=0
  530607.8193  0.0063 -5.4143 3  722.6698151  71510 303751263      741262        syn-C2H3C(O)NH2, v=0
  530607.9840  0.0063 -3.4448 3  722.6698151  71510 303751363      741262        syn-C2H3C(O)NH2, v=0
  530619.9230  0.0048 -5.2283 3  190.3071 79  71510 30339 832      39 535        syn-C2H3C(O)NH2, v=0
  530646.8611  0.0067 -5.8398 3  881.0976145  71510 303723339      713338        syn-C2H3C(O)NH2, v=0
  530646.8611  0.0067 -5.8398 3  881.0976145  71510 303723340      713339        syn-C2H3C(O)NH2, v=0
  530693.7627  0.0078 -4.7023 3  445.0205115  71510 303571443      571146        syn-C2H3C(O)NH2, v=0
  530726.8600  0.0037 -3.8443 3  153.6068 71  71510 30335 728      34 629        syn-C2H3C(O)NH2, v=0
  530750.9320  0.0045 -5.4152 3  701.0785141  71510 303702149      692148        syn-C2H3C(O)NH2, v=0
  530766.2878  0.0012 -2.7434 3  230.4415 71  71510 303352015      341916        syn-C2H3C(O)NH2, v=0
  530766.2878  0.0012 -2.7434 3  230.4415 71  71510 303352016      341915        syn-C2H3C(O)NH2, v=0
  530819.0505  0.0011 -2.7831 3  239.2416 75  71510 303371918      361819        syn-C2H3C(O)NH2, v=0
  530819.0505  0.0011 -2.7831 3  239.2416 75  71510 303371919      361818        syn-C2H3C(O)NH2, v=0
  530822.6678  0.0475 -4.5670 3  909.7236185  71510 30392 389      92 290        syn-C2H3C(O)NH2, v=0
  530822.6678  0.0475 -4.5670 3  909.7236185  71510 30392 489      92 390        syn-C2H3C(O)NH2, v=0
  530840.6689  0.0035 -3.3600 3  404.2819109  71510 303541540      531439        syn-C2H3C(O)NH2, v=0
  530930.0900  0.0185 -4.4825 3 1212.0119169  71510 303843945      843846        syn-C2H3C(O)NH2, v=0
  530930.0900  0.0185 -4.4825 3 1212.0119169  71510 303843946      843847        syn-C2H3C(O)NH2, v=0
  531020.1322  0.0670 -5.0809 3 1460.8927219  71510 303A91396      A91297        syn-C2H3C(O)NH2, v=0
  531020.1322  0.0670 -5.0809 3 1460.8927219  71510 303A91496      A91397        syn-C2H3C(O)NH2, v=0
  531118.7937  0.0040 -4.5945 3  390.5585107  71510 303531539      531242        syn-C2H3C(O)NH2, v=0
  531248.3357  0.0059 -3.4764 3  715.3360149  71510 303741361      731460        syn-C2H3C(O)NH2, v=0
  531251.8403  0.0059 -5.4053 3  715.3360149  71510 303741461      731460        syn-C2H3C(O)NH2, v=0
  531254.4853  0.0059 -5.4053 3  715.3358149  71510 303741361      731360        syn-C2H3C(O)NH2, v=0
  531257.9899  0.0059 -3.4764 3  715.3358149  71510 303741461      731360        syn-C2H3C(O)NH2, v=0
  531263.1518  0.0065 -5.8008 3  866.1227145  71510 303723240      713239        syn-C2H3C(O)NH2, v=0
  531263.1518  0.0065 -5.8008 3  866.1227145  71510 303723241      713240        syn-C2H3C(O)NH2, v=0
  531263.3014  0.0023 -4.8706 3  226.9284 79  71510 303391525      391228        syn-C2H3C(O)NH2, v=0
  531388.3464  0.0532 -4.8506 3  817.9817179  71510 30389 188      89 089        syn-C2H3C(O)NH2, v=0
  531388.3464  0.0532 -4.8506 3  817.9817179  71510 30389 288      89 189        syn-C2H3C(O)NH2, v=0
  531441.9478  0.0014 -3.0611 3  302.1234 93  71510 303461531      451432        syn-C2H3C(O)NH2, v=0
  531532.9214  0.0179 -4.4474 3 1191.3764167  71510 303833944      833845        syn-C2H3C(O)NH2, v=0
  531532.9214  0.0179 -4.4474 3 1191.3764167  71510 303833945      833846        syn-C2H3C(O)NH2, v=0
  531594.0370  0.0407 -5.2507 3 1644.2201205  71510 303A24062      A23963        syn-C2H3C(O)NH2, v=0
  531594.0370  0.0407 -5.2507 3 1644.2201205  71510 303A24063      A23964        syn-C2H3C(O)NH2, v=0
  531617.3945  0.0024 -5.7293 3   52.5644 37  71510 3031811 8      17 8 9        syn-C2H3C(O)NH2, v=0
  531629.7523  0.0024 -5.7292 3   52.5640 37  71510 3031811 7      17 810        syn-C2H3C(O)NH2, v=0
  531661.9056  0.0739 -5.9415 3 2012.6552231  71510 303B54174      B54075        syn-C2H3C(O)NH2, v=0
  531661.9059  0.0739 -5.9415 3 2012.6552231  71510 303B54175      B54076        syn-C2H3C(O)NH2, v=0
  531694.2653  0.0493 -4.7475 3 1224.8639205  71510 303A2 993      A2 894        syn-C2H3C(O)NH2, v=0
  531694.2653  0.0493 -4.7475 3 1224.8639205  71510 303A21093      A2 994        syn-C2H3C(O)NH2, v=0
  531779.1633  0.0050 -5.5156 3  747.3154143  71510 303712448      702447        syn-C2H3C(O)NH2, v=0
  531780.9029  0.0050 -5.5156 3  747.3154143  71510 303712447      702446        syn-C2H3C(O)NH2, v=0
  531858.6136  0.0045 -4.6789 3  390.3700105  71510 303521735      521438        syn-C2H3C(O)NH2, v=0
  531919.5570  0.0747 -5.1882 3 1528.5878223  71510 303B11497      B11398        syn-C2H3C(O)NH2, v=0
  531919.5570  0.0747 -5.1882 3 1528.5878223  71510 303B11597      B11498        syn-C2H3C(O)NH2, v=0
  531938.6130  0.0452 -4.5856 3 1063.2459195  71510 30397 691      97 592        syn-C2H3C(O)NH2, v=0
  531938.6130  0.0452 -4.5856 3 1063.2459195  71510 30397 791      97 692        syn-C2H3C(O)NH2, v=0
  531941.1650  0.0063 -5.7630 3  851.6508145  71510 303723141      713140        syn-C2H3C(O)NH2, v=0
  531941.1650  0.0063 -5.7630 3  851.6508145  71510 303723142      713141        syn-C2H3C(O)NH2, v=0
  531981.3032  0.0112 -4.7664 3  755.9176147  71510 303732152      731855        syn-C2H3C(O)NH2, v=0
  531983.7691  0.0045 -3.5260 3  529.3317125  71510 303621647      611546        syn-C2H3C(O)NH2, v=0
  532114.2617  0.0173 -4.4130 3 1170.9935165  71510 303823943      823844        syn-C2H3C(O)NH2, v=0
  532114.2617  0.0173 -4.4130 3 1170.9935165  71510 303823944      823845        syn-C2H3C(O)NH2, v=0
  532150.1557  0.0152 -4.8702 3  901.9121161  71510 303802258      801961        syn-C2H3C(O)NH2, v=0
  532170.0649  0.0054 -3.5155 3  707.2542147  71510 303731459      721558        syn-C2H3C(O)NH2, v=0
  532230.1975  0.0054 -5.3942 3  707.2542147  71510 303731559      721558        syn-C2H3C(O)NH2, v=0
  532271.6707  0.0054 -5.3941 3  707.2508147  71510 303731459      721458        syn-C2H3C(O)NH2, v=0
  532331.8034  0.0054 -3.5152 3  707.2508147  71510 303731559      721458        syn-C2H3C(O)NH2, v=0
  532450.0670  0.0032 -4.7303 3  308.7985 93  71510 303461630      461333        syn-C2H3C(O)NH2, v=0
  532630.2820  0.0837 -5.3005 3 1597.5192227  71510 303B31598      B31499        syn-C2H3C(O)NH2, v=0
  532630.2820  0.0837 -5.3005 3 1597.5192227  71510 303B31698      B31599        syn-C2H3C(O)NH2, v=0
  532633.0295  0.0390 -5.2034 3 1619.0179203  71510 303A14061      A13962        syn-C2H3C(O)NH2, v=0
  532633.0295  0.0390 -5.2034 3 1619.0179203  71510 303A14062      A13963        syn-C2H3C(O)NH2, v=0
  532674.7570  0.0168 -4.3794 3 1150.8631163  71510 303813942      813843        syn-C2H3C(O)NH2, v=0
  532674.7570  0.0168 -4.3794 3 1150.8631163  71510 303813943      813844        syn-C2H3C(O)NH2, v=0
  532691.5066  0.0062 -5.7265 3  837.6870145  71510 303723042      713041        syn-C2H3C(O)NH2, v=0
  532691.5066  0.0062 -5.7265 3  837.6870145  71510 303723043      713042        syn-C2H3C(O)NH2, v=0
  532838.8993  0.0050 -3.5692 3  698.3388145  71510 303721557      711656        syn-C2H3C(O)NH2, v=0
  533006.8734  0.0045 -5.3904 3  692.8012141  71510 303702051      692050        syn-C2H3C(O)NH2, v=0
  533033.5982  0.0125 -4.8554 3  881.2580159  71510 303792257      791960        syn-C2H3C(O)NH2, v=0
  533075.0384  0.0020 -4.7241 3   92.0671 53  71510 303261016      25 719        syn-C2H3C(O)NH2, v=0
  533089.4398  0.1514 -5.9294 3 1960.5197247  71510 303C320A3      C319A4        syn-C2H3C(O)NH2, v=0
  533089.4398  0.1514 -5.9294 3 1960.5197247  71510 303C321A3      C320A4        syn-C2H3C(O)NH2, v=0
  533130.5345  0.0708 -5.8857 3 1984.1158229  71510 303B44173      B44074        syn-C2H3C(O)NH2, v=0
  533130.5346  0.0708 -5.8857 3 1984.1158229  71510 303B44174      B44075        syn-C2H3C(O)NH2, v=0
  533145.5153  0.0939 -5.4176 3 1667.6814231  71510 303B51699      B515A0        syn-C2H3C(O)NH2, v=0
  533145.5153  0.0939 -5.4176 3 1667.6814231  71510 303B51799      B516A0        syn-C2H3C(O)NH2, v=0
  533215.0324  0.0162 -4.3465 3 1130.9848161  71510 303803941      803842        syn-C2H3C(O)NH2, v=0
  533215.0324  0.0162 -4.3465 3 1130.9848161  71510 303803942      803843        syn-C2H3C(O)NH2, v=0
  533303.2521  0.0534 -4.8312 3 1288.1612209  71510 303A41094      A4 995        syn-C2H3C(O)NH2, v=0
  533303.2521  0.0534 -4.8312 3 1288.1612209  71510 303A41194      A41095        syn-C2H3C(O)NH2, v=0
  533341.9653  0.0472 -4.5570 3  966.5689189  71510 30394 490      94 391        syn-C2H3C(O)NH2, v=0
  533341.9653  0.0472 -4.5570 3  966.5689189  71510 30394 590      94 491        syn-C2H3C(O)NH2, v=0
  533381.7011  0.0023 -4.9188 3  217.1739 77  71510 303381523      381226        syn-C2H3C(O)NH2, v=0
  533439.4187  0.1342 -5.7953 3 1885.4936243  71510 303C119A2      C118A3        syn-C2H3C(O)NH2, v=0
  533439.4187  0.1342 -5.7953 3 1885.4936243  71510 303C120A2      C119A3        syn-C2H3C(O)NH2, v=0
  533457.7759  0.1057 -5.5392 3 1739.0684235  71510 303B717A0      B716A1        syn-C2H3C(O)NH2, v=0
  533457.7759  0.1057 -5.5392 3 1739.0684235  71510 303B718A0      B717A1        syn-C2H3C(O)NH2, v=0
  533488.9759  0.0063 -5.6648 3  153.6039 69  71510 303341024      34 529        syn-C2H3C(O)NH2, v=0
  533524.8564  0.0030 -4.6030 3  370.2386103  71510 303511636      511339        syn-C2H3C(O)NH2, v=0
  533527.4368  0.0060 -5.6912 3  824.2376145  71510 303722943      712942        syn-C2H3C(O)NH2, v=0
  533527.4368  0.0060 -5.6912 3  824.2376145  71510 303722944      712943        syn-C2H3C(O)NH2, v=0
  533558.7983  0.1190 -5.6652 3 1811.6745239  71510 303B918A1      B917A2        syn-C2H3C(O)NH2, v=0
  533558.7983  0.1190 -5.6652 3 1811.6745239  71510 303B919A1      B918A2        syn-C2H3C(O)NH2, v=0
  533611.7249  0.0043 -5.3528 3  678.0521141  71510 303701853      691852        syn-C2H3C(O)NH2, v=0
  533637.6952  0.0374 -5.1568 3 1594.0733201  71510 303A04060      A03961        syn-C2H3C(O)NH2, v=0
  533637.6952  0.0374 -5.1568 3 1594.0733201  71510 303A04061      A03962        syn-C2H3C(O)NH2, v=0
  533648.0018  0.0050 -5.3805 3  698.3388145  71510 303721657      711656        syn-C2H3C(O)NH2, v=0
  533654.2147  0.0031 -4.5923 3  383.3474105  71510 303521637      521340        syn-C2H3C(O)NH2, v=0
  533656.7141  0.0050 -5.4868 3  737.1451143  71510 303712349      702348        syn-C2H3C(O)NH2, v=0
  533672.5336  0.0050 -5.4868 3  737.1457143  71510 303712348      702347        syn-C2H3C(O)NH2, v=0
  533735.6933  0.0158 -4.3144 3 1111.3585159  71510 303793940      793841        syn-C2H3C(O)NH2, v=0
  533735.6933  0.0158 -4.3144 3 1111.3585159  71510 303793941      793842        syn-C2H3C(O)NH2, v=0
  533853.1209  0.0039 -4.2908 3  115.1582 65  71510 30332 428      31 329        syn-C2H3C(O)NH2, v=0
  533873.1322  0.0039 -4.2907 3  115.1582 65  71510 30332 528      31 229        syn-C2H3C(O)NH2, v=0
  534019.3838  0.0015 -3.0891 3  313.8388 95  71510 303471533      461432        syn-C2H3C(O)NH2, v=0
  534022.8182  0.0470 -4.6409 3 1123.3398199  71510 30399 792      99 693        syn-C2H3C(O)NH2, v=0
  534022.8182  0.0470 -4.6409 3 1123.3398199  71510 30399 892      99 793        syn-C2H3C(O)NH2, v=0
  534142.1438  0.0050 -5.3796 3  698.2953145  71510 303721557      711556        syn-C2H3C(O)NH2, v=0
  534178.5773  0.0518 -4.6602 3  872.8378183  71510 30391 289      91 190        syn-C2H3C(O)NH2, v=0
  534178.5773  0.0518 -4.6602 3  872.8378183  71510 30391 389      91 290        syn-C2H3C(O)NH2, v=0
  534237.3264  0.0153 -4.2830 3 1091.9838157  71510 303783939      783840        syn-C2H3C(O)NH2, v=0
  534237.3264  0.0153 -4.2830 3 1091.9838157  71510 303783940      783841        syn-C2H3C(O)NH2, v=0
  534391.6432  0.0042 -5.2925 3  644.6077137  71510 303681850      671849        syn-C2H3C(O)NH2, v=0
  534426.3996  0.0046 -5.3397 3  668.1655139  71510 303691950      681949        syn-C2H3C(O)NH2, v=0
  534437.5869  0.0138 -3.9669 3  776.9164151  71510 303751857      741956        syn-C2H3C(O)NH2, v=0
  534465.8398  0.0059 -5.6571 3  811.3102145  71510 303722845      712844        syn-C2H3C(O)NH2, v=0
  534465.8399  0.0059 -5.6571 3  811.3102145  71510 303722844      712843        syn-C2H3C(O)NH2, v=0
  534504.9693  0.0042 -5.3333 3  670.3013141  71510 303701654      691653        syn-C2H3C(O)NH2, v=0
  534550.8440  0.0678 -5.8307 3 1955.8385227  71510 303B34172      B34073        syn-C2H3C(O)NH2, v=0
  534550.8441  0.0678 -5.8307 3 1955.8385227  71510 303B34173      B34074        syn-C2H3C(O)NH2, v=0
  534600.8940  0.0013 -2.9664 3  286.0157 89  71510 303441629      431528        syn-C2H3C(O)NH2, v=0
  534609.1575  0.0359 -5.1108 3 1569.3861199  71510 303994059      993960        syn-C2H3C(O)NH2, v=0
  534609.1575  0.0359 -5.1108 3 1569.3861199  71510 303994060      993961        syn-C2H3C(O)NH2, v=0
  534675.8918  0.0013 -2.9663 3  286.0135 89  71510 303441628      431529        syn-C2H3C(O)NH2, v=0
  534720.5003  0.0149 -4.2525 3 1072.8604155  71510 303773938      773839        syn-C2H3C(O)NH2, v=0
  534720.5003  0.0149 -4.2525 3 1072.8604155  71510 303773939      773840        syn-C2H3C(O)NH2, v=0
  534747.5494  0.0583 -4.9221 3 1352.7166213  71510 303A61195      A61096        syn-C2H3C(O)NH2, v=0
  534747.5494  0.0583 -4.9221 3 1352.7166213  71510 303A61295      A61196        syn-C2H3C(O)NH2, v=0
  534761.9945  0.0044 -5.3683 3  685.2110141  71510 303701952      691951        syn-C2H3C(O)NH2, v=0
  534824.5924  0.0037 -3.4395 3  275.0832 91  71510 303451233      441134        syn-C2H3C(O)NH2, v=0
  534892.6317  0.0029 -4.6183 3  357.3541101  71510 303501635      501338        syn-C2H3C(O)NH2, v=0
  534951.2464  0.0050 -3.5656 3  698.2953145  71510 303721657      711556        syn-C2H3C(O)NH2, v=0
  534971.2781  0.0046 -5.3649 3  688.5314143  71510 303711755      701754        syn-C2H3C(O)NH2, v=0
  535185.7669  0.0145 -4.2227 3 1053.9883153  71510 303763937      763838        syn-C2H3C(O)NH2, v=0
  535185.7669  0.0145 -4.2227 3 1053.9883153  71510 303763938      763839        syn-C2H3C(O)NH2, v=0
  535335.5877  0.0081 -3.7994 3  732.1262147  71510 303731756      721855        syn-C2H3C(O)NH2, v=0
  535405.7156  0.0036 -3.9523 3  140.5539 69  71510 30334 628      33 529        syn-C2H3C(O)NH2, v=0
  535453.9013  0.0108 -5.4551 3  776.8351169  71510 30384 480      83 479        syn-C2H3C(O)NH2, v=0
  535453.9013  0.0108 -3.3022 3  776.8351169  71510 30384 480      83 579        syn-C2H3C(O)NH2, v=0
  535453.9013  0.0108 -3.3022 3  776.8351169  71510 30384 580      83 479        syn-C2H3C(O)NH2, v=0
  535453.9013  0.0108 -5.4551 3  776.8351169  71510 30384 580      83 579        syn-C2H3C(O)NH2, v=0
  535458.3810  0.0116 -5.4524 3  778.9130171  71510 30385 382      84 381        syn-C2H3C(O)NH2, v=0
  535458.3810  0.0116 -3.2855 3  778.9130171  71510 30385 382      84 481        syn-C2H3C(O)NH2, v=0
  535458.3810  0.0116 -3.2855 3  778.9130171  71510 30385 482      84 381        syn-C2H3C(O)NH2, v=0
  535458.3810  0.0116 -5.4524 3  778.9130171  71510 30385 482      84 481        syn-C2H3C(O)NH2, v=0
  535458.9691  0.0102 -5.4569 3  774.2320167  71510 30383 578      82 577        syn-C2H3C(O)NH2, v=0
  535458.9691  0.0102 -3.3191 3  774.2320167  71510 30383 578      82 677        syn-C2H3C(O)NH2, v=0
  535458.9691  0.0102 -3.3191 3  774.2320167  71510 30383 678      82 577        syn-C2H3C(O)NH2, v=0
  535458.9691  0.0102 -5.4569 3  774.2320167  71510 30383 678      82 677        syn-C2H3C(O)NH2, v=0
  535468.2935  0.0128 -5.4486 3  780.4722173  71510 30386 284      85 283        syn-C2H3C(O)NH2, v=0
  535468.2935  0.0128 -3.2687 3  780.4722173  71510 30386 284      85 383        syn-C2H3C(O)NH2, v=0
  535468.2935  0.0128 -3.2687 3  780.4722173  71510 30386 384      85 283        syn-C2H3C(O)NH2, v=0
  535468.2935  0.0128 -5.4486 3  780.4722173  71510 30386 384      85 383        syn-C2H3C(O)NH2, v=0
  535478.9587  0.0098 -5.4575 3  771.0959165  71510 30382 676      81 675        syn-C2H3C(O)NH2, v=0
  535478.9587  0.0098 -3.3363 3  771.0959165  71510 30382 676      81 775        syn-C2H3C(O)NH2, v=0
  535478.9587  0.0098 -3.3363 3  771.0959165  71510 30382 776      81 675        syn-C2H3C(O)NH2, v=0
  535478.9587  0.0098 -5.4575 3  771.0959165  71510 30382 776      81 775        syn-C2H3C(O)NH2, v=0
  535480.4486  0.0146 -5.4437 3  781.5185175  71510 30387 186      86 185        syn-C2H3C(O)NH2, v=0
  535480.4486  0.0146 -3.2518 3  781.5185175  71510 30387 186      86 285        syn-C2H3C(O)NH2, v=0
  535480.4486  0.0146 -3.2518 3  781.5185175  71510 30387 286      86 185        syn-C2H3C(O)NH2, v=0
  535480.4486  0.0146 -5.4437 3  781.5185175  71510 30387 286      86 285        syn-C2H3C(O)NH2, v=0
  535492.3458  0.0171 -5.4379 3  782.0563177  71510 30388 088      87 087        syn-C2H3C(O)NH2, v=0
  535492.3458  0.0171 -3.2348 3  782.0563177  71510 30388 088      87 187        syn-C2H3C(O)NH2, v=0
  535492.3458  0.0171 -3.2348 3  782.0563177  71510 30388 188      87 087        syn-C2H3C(O)NH2, v=0
  535492.3458  0.0171 -5.4379 3  782.0563177  71510 30388 188      87 187        syn-C2H3C(O)NH2, v=0
  535505.5776  0.0033 -4.5868 3  396.6737107  71510 303531638      531341        syn-C2H3C(O)NH2, v=0
  535520.9923  0.0093 -5.4570 3  767.4173163  71510 30381 774      80 773        syn-C2H3C(O)NH2, v=0
  535520.9923  0.0093 -3.3539 3  767.4173163  71510 30381 774      80 873        syn-C2H3C(O)NH2, v=0
  535520.9923  0.0093 -3.3539 3  767.4173163  71510 30381 874      80 773        syn-C2H3C(O)NH2, v=0
  535520.9923  0.0093 -5.4570 3  767.4173163  71510 30381 874      80 873        syn-C2H3C(O)NH2, v=0
  535528.6981  0.0058 -5.6242 3  798.9144145  71510 303722746      712745        syn-C2H3C(O)NH2, v=0
  535528.7004  0.0058 -5.6242 3  798.9144145  71510 303722745      712744        syn-C2H3C(O)NH2, v=0
  535548.4905  0.0345 -5.0655 3 1544.9559197  71510 303984058      983959        syn-C2H3C(O)NH2, v=0
  535548.4905  0.0345 -5.0655 3 1544.9559197  71510 303984059      983960        syn-C2H3C(O)NH2, v=0
  535566.4625  0.0022 -4.9161 3  217.1010 77  71510 303381524      381227        syn-C2H3C(O)NH2, v=0
  535594.3967  0.0028 -3.7577 3  166.8433 73  71510 30336 928      35 629        syn-C2H3C(O)NH2, v=0
  535594.6745  0.0089 -5.4554 3  763.1847161  71510 30380 872      79 871        syn-C2H3C(O)NH2, v=0
  535594.6745  0.0089 -3.3723 3  763.1847161  71510 30380 872      79 971        syn-C2H3C(O)NH2, v=0
  535594.6745  0.0089 -3.3723 3  763.1847161  71510 30380 972      79 871        syn-C2H3C(O)NH2, v=0
  535594.6745  0.0089 -5.4554 3  763.1847161  71510 30380 972      79 971        syn-C2H3C(O)NH2, v=0
  535633.5851  0.0032 -3.8394 3  153.6039 71  71510 30335 828      34 529        syn-C2H3C(O)NH2, v=0
  535633.6617  0.0141 -4.1937 3 1035.3670151  71510 303753936      753837        syn-C2H3C(O)NH2, v=0
  535633.6617  0.0141 -4.1937 3 1035.3670151  71510 303753937      753838        syn-C2H3C(O)NH2, v=0
  535679.0588  0.0055 -3.6602 3  706.3761145  71510 303721656      711755        syn-C2H3C(O)NH2, v=0
  535713.2333  0.0085 -5.4525 3  758.3840159  71510 30379 970      78 969        syn-C2H3C(O)NH2, v=0
  535713.2333  0.0085 -3.3916 3  758.3840159  71510 30379 970      781069        syn-C2H3C(O)NH2, v=0
  535713.2333  0.0085 -3.3916 3  758.3840159  71510 303791070      78 969        syn-C2H3C(O)NH2, v=0
  535713.2333  0.0085 -5.4525 3  758.3840159  71510 303791070      781069        syn-C2H3C(O)NH2, v=0
  535720.5942  0.0476 -4.5780 3 1024.7028193  71510 30396 591      96 492        syn-C2H3C(O)NH2, v=0
  535720.5942  0.0476 -4.5780 3 1024.7028193  71510 30396 691      96 592        syn-C2H3C(O)NH2, v=0
  535756.5294  0.0048 -5.3862 3  692.9584141  71510 303702050      692049        syn-C2H3C(O)NH2, v=0
  535762.7521  0.0037 -4.0969 3  127.7300 67  71510 30333 528      32 429        syn-C2H3C(O)NH2, v=0
  535895.3714  0.0080 -3.4124 3  752.9975157  71510 303781068      771167        syn-C2H3C(O)NH2, v=0
  535895.3715  0.0080 -5.4484 3  752.9975157  71510 303781168      771167        syn-C2H3C(O)NH2, v=0
  535895.3716  0.0080 -5.4484 3  752.9975157  71510 303781068      771067        syn-C2H3C(O)NH2, v=0
  535895.3717  0.0080 -3.4124 3  752.9975157  71510 303781168      771067        syn-C2H3C(O)NH2, v=0
  535921.5112  0.0037 -4.0967 3  127.7300 67  71510 30333 628      32 329        syn-C2H3C(O)NH2, v=0
  535924.6421  0.0650 -5.7763 3 1927.8228225  71510 303B24171      B24072        syn-C2H3C(O)NH2, v=0
  535924.6421  0.0650 -5.7763 3 1927.8228225  71510 303B24172      B24073        syn-C2H3C(O)NH2, v=0
  535937.8314  0.0050 -5.4590 3  727.6059143  71510 303712250      702249        syn-C2H3C(O)NH2, v=0
  535955.8468  0.0495 -4.7080 3 1184.7073203  71510 303A1 893      A1 794        syn-C2H3C(O)NH2, v=0
  535955.8468  0.0495 -4.7080 3 1184.7073203  71510 303A1 993      A1 894        syn-C2H3C(O)NH2, v=0
  536022.5817  0.0643 -5.0194 3 1418.5248217  71510 303A81296      A81197        syn-C2H3C(O)NH2, v=0
  536022.5817  0.0643 -5.0194 3 1418.5248217  71510 303A81396      A81297        syn-C2H3C(O)NH2, v=0
  536061.6622  0.0050 -5.4588 3  727.6115143  71510 303712249      702248        syn-C2H3C(O)NH2, v=0
  536061.8339  0.0046 -4.8622 3  279.6495 93  71510 303461036      46 739        syn-C2H3C(O)NH2, v=0
  536064.7048  0.0138 -4.1655 3 1016.9964149  71510 303743935      743836        syn-C2H3C(O)NH2, v=0
  536064.7048  0.0138 -4.1655 3 1016.9964149  71510 303743936      743837        syn-C2H3C(O)NH2, v=0
  536168.4254  0.0075 -3.4353 3  747.0024155  71510 303771166      761265        syn-C2H3C(O)NH2, v=0
  536168.4288  0.0075 -5.4428 3  747.0024155  71510 303771266      761265        syn-C2H3C(O)NH2, v=0
  536168.4318  0.0075 -5.4428 3  747.0024155  71510 303771166      761165        syn-C2H3C(O)NH2, v=0
  536168.4352  0.0075 -3.4353 3  747.0024155  71510 303771266      761165        syn-C2H3C(O)NH2, v=0
  536234.6540  0.0018 -2.6037 3  215.1042 53  71510 3032625 1      2524 2        syn-C2H3C(O)NH2, v=0
  536234.6540  0.0018 -2.6037 3  215.1042 53  71510 3032625 2      2524 1        syn-C2H3C(O)NH2, v=0
  536298.6748  0.0028 -5.5094 3  162.5978 69  71510 303341222      34 727        syn-C2H3C(O)NH2, v=0
  536399.7731  0.0035 -3.9512 3  140.5536 69  71510 30334 728      33 429        syn-C2H3C(O)NH2, v=0
  536456.7218  0.0331 -5.0209 3 1520.7822195  71510 303974057      973958        syn-C2H3C(O)NH2, v=0
  536456.7218  0.0331 -5.0209 3 1520.7822195  71510 303974058      973959        syn-C2H3C(O)NH2, v=0
  536479.4016  0.0135 -4.1382 3  998.8761147  71510 303733934      733835        syn-C2H3C(O)NH2, v=0
  536479.4016  0.0135 -4.1382 3  998.8761147  71510 303733935      733836        syn-C2H3C(O)NH2, v=0
  536574.0504  0.0070 -3.4610 3  740.3690153  71510 303761264      751363        syn-C2H3C(O)NH2, v=0
  536574.1409  0.0070 -5.4357 3  740.3690153  71510 303761364      751363        syn-C2H3C(O)NH2, v=0
  536574.2151  0.0070 -5.4357 3  740.3690153  71510 303761264      751263        syn-C2H3C(O)NH2, v=0
  536574.3056  0.0070 -3.4610 3  740.3690153  71510 303761364      751263        syn-C2H3C(O)NH2, v=0
  536617.9356  0.0082 -5.9794 3  946.6486147  71510 303733637      723636        syn-C2H3C(O)NH2, v=0
  536617.9356  0.0082 -5.9794 3  946.6486147  71510 303733638      723637        syn-C2H3C(O)NH2, v=0
  536663.8527  0.0012 -2.8954 3  271.7638 85  71510 303421726      411625        syn-C2H3C(O)NH2, v=0
  536665.2487  0.0012 -2.8954 3  271.7638 85  71510 303421725      411626        syn-C2H3C(O)NH2, v=0
  536667.4644  0.0016 -2.6273 3  216.9230 57  71510 3032824 4      2723 5        syn-C2H3C(O)NH2, v=0
  536667.4644  0.0016 -2.6273 3  216.9230 57  71510 3032824 5      2723 4        syn-C2H3C(O)NH2, v=0
  536745.4291  0.0057 -5.5924 3  787.0619145  71510 303722647      712646        syn-C2H3C(O)NH2, v=0
  536745.4579  0.0057 -5.5924 3  787.0619145  71510 303722646      712645        syn-C2H3C(O)NH2, v=0
  536770.0832  0.0031 -3.3162 3  390.3700107  71510 303531539      521438        syn-C2H3C(O)NH2, v=0
  536834.3638  0.0510 -4.5975 3  928.9921187  71510 30393 390      93 291        syn-C2H3C(O)NH2, v=0
  536834.3638  0.0510 -4.5975 3  928.9921187  71510 30393 490      93 391        syn-C2H3C(O)NH2, v=0
  536878.2431  0.0132 -4.1117 3  981.0061145  71510 303723933      723834        syn-C2H3C(O)NH2, v=0
  536878.2431  0.0132 -4.1117 3  981.0061145  71510 303723934      723835        syn-C2H3C(O)NH2, v=0
  537080.4564  0.0038 -5.2747 3  639.8970137  71510 303681751      671750        syn-C2H3C(O)NH2, v=0
  537081.5748  0.0014 -2.6531 3  220.2126 61  71510 3033023 7      2922 8        syn-C2H3C(O)NH2, v=0
  537081.5748  0.0014 -2.6531 3  220.2126 61  71510 3033023 8      2922 7        syn-C2H3C(O)NH2, v=0
  537114.9946  0.0079 -5.9368 3  930.2042147  71510 303733538      723537        syn-C2H3C(O)NH2, v=0
  537114.9946  0.0079 -5.9368 3  930.2042147  71510 303733539      723538        syn-C2H3C(O)NH2, v=0
  537123.3661  0.0712 -5.1226 3 1485.5804221  71510 303B01397      B01298        syn-C2H3C(O)NH2, v=0
  537123.3661  0.0712 -5.1226 3 1485.5804221  71510 303B01497      B01398        syn-C2H3C(O)NH2, v=0
  537177.6739  0.0065 -3.4911 3  733.0567151  71510 303751362      741461        syn-C2H3C(O)NH2, v=0
  537179.6604  0.0065 -5.4268 3  733.0567151  71510 303751462      741461        syn-C2H3C(O)NH2, v=0
  537181.1785  0.0065 -5.4268 3  733.0566151  71510 303751362      741361        syn-C2H3C(O)NH2, v=0
  537183.1650  0.0065 -3.4911 3  733.0566151  71510 303751462      741361        syn-C2H3C(O)NH2, v=0
  537253.6364  0.0623 -5.7226 3 1900.0682223  71510 303B14170      B14071        syn-C2H3C(O)NH2, v=0
  537253.6364  0.0623 -5.7226 3 1900.0682223  71510 303B14171      B14072        syn-C2H3C(O)NH2, v=0
  537261.7073  0.0130 -4.0860 3  963.3860143  71510 303713932      713833        syn-C2H3C(O)NH2, v=0
  537261.7073  0.0130 -4.0860 3  963.3860143  71510 303713933      713834        syn-C2H3C(O)NH2, v=0
  537301.4453  0.0073 -5.3174 3   81.7129 53  71510 30326 719      25 422        syn-C2H3C(O)NH2, v=0
  537334.8361  0.0318 -4.9770 3 1496.8648193  71510 303964056      963957        syn-C2H3C(O)NH2, v=0
  537334.8361  0.0318 -4.9770 3 1496.8648193  71510 303964057      963958        syn-C2H3C(O)NH2, v=0
  537404.0020  0.0568 -4.8791 3  836.2460181  71510 30390 189      90 090        syn-C2H3C(O)NH2, v=0
  537404.0020  0.0568 -4.8791 3  836.2460181  71510 30390 289      90 190        syn-C2H3C(O)NH2, v=0
  537440.4861  0.2819 -5.8880 3 1643.6879217  71510 303A82979      A73078        syn-C2H3C(O)NH2, v=0
  537457.3272  0.0018 -3.2122 3  320.1207 97  71510 303481434      471335        syn-C2H3C(O)NH2, v=0
  537458.1794  0.0013 -2.6816 3  224.9830 65  71510 303322210      312111        syn-C2H3C(O)NH2, v=0
  537458.1794  0.0013 -2.6816 3  224.9830 65  71510 303322211      312110        syn-C2H3C(O)NH2, v=0
  537503.2017  0.0028 -4.6377 3  344.7013 99  71510 303491634      491337        syn-C2H3C(O)NH2, v=0
  537601.2780  0.0012 -2.8384 3  259.2367 81  71510 303401823      391722        syn-C2H3C(O)NH2, v=0
  537601.2933  0.0012 -2.8384 3  259.2367 81  71510 303401822      391723        syn-C2H3C(O)NH2, v=0
  537630.2589  0.0127 -4.0613 3  946.0157141  71510 303703931      703832        syn-C2H3C(O)NH2, v=0
  537630.2589  0.0127 -4.0613 3  946.0157141  71510 303703932      703833        syn-C2H3C(O)NH2, v=0
  537654.2348  0.0076 -5.8955 3  914.2529147  71510 303733439      723438        syn-C2H3C(O)NH2, v=0
  537654.2348  0.0076 -5.8955 3  914.2529147  71510 303733440      723439        syn-C2H3C(O)NH2, v=0
  537698.7451  0.0029 -5.4287 3  171.3100 71  71510 303351223      35 728        syn-C2H3C(O)NH2, v=0
  537734.2237  0.0529 -4.7847 3 1247.3432207  71510 303A3 994      A3 895        syn-C2H3C(O)NH2, v=0
  537734.2237  0.0529 -4.7847 3 1247.3432207  71510 303A31094      A3 995        syn-C2H3C(O)NH2, v=0
  537766.7130  0.0012 -2.7134 3  231.2478 69  71510 303342113      332014        syn-C2H3C(O)NH2, v=0
  537766.7130  0.0012 -2.7134 3  231.2478 69  71510 303342114      332013        syn-C2H3C(O)NH2, v=0
  537784.8253  0.0030 -5.6172 3  154.0582 67  71510 303331221      33 726        syn-C2H3C(O)NH2, v=0
  537916.1987  0.0042 -3.5466 3  248.3674 87  71510 303431132      421033        syn-C2H3C(O)NH2, v=0
  537942.5137  0.0024 -5.5909 3   57.0100 39  71510 3031911 9      18 810        syn-C2H3C(O)NH2, v=0
  537948.7591  0.0012 -2.7905 3  248.3428 77  71510 303381920      371819        syn-C2H3C(O)NH2, v=0
  537948.7592  0.0012 -2.7905 3  248.3428 77  71510 303381919      371820        syn-C2H3C(O)NH2, v=0
  537955.8584  0.0486 -4.6195 3 1084.1201197  71510 30398 692      98 593        syn-C2H3C(O)NH2, v=0
  537955.8584  0.0486 -4.6195 3 1084.1201197  71510 30398 792      98 693        syn-C2H3C(O)NH2, v=0
  537957.5164  0.0012 -2.7494 3  239.0257 73  71510 303362016      351917        syn-C2H3C(O)NH2, v=0
  537957.5164  0.0012 -2.7494 3  239.0257 73  71510 303362017      351916        syn-C2H3C(O)NH2, v=0
  537973.7810  0.0024 -5.5908 3   57.0090 39  71510 3031911 8      18 811        syn-C2H3C(O)NH2, v=0
  537978.9570  0.0014 -3.0840 3  313.7318 95  71510 303471532      461433        syn-C2H3C(O)NH2, v=0
  537984.3503  0.0125 -4.0374 3  928.8948139  71510 303693930      693831        syn-C2H3C(O)NH2, v=0
  537984.3503  0.0125 -4.0374 3  928.8948139  71510 303693931      693832        syn-C2H3C(O)NH2, v=0
  538044.4650  0.0792 -5.2312 3 1553.8781225  71510 303B21498      B21399        syn-C2H3C(O)NH2, v=0
  538044.4650  0.0792 -5.2312 3 1553.8781225  71510 303B21598      B21499        syn-C2H3C(O)NH2, v=0
  538058.0491  0.2574 -5.7088 3 1551.7124211  71510 303A52877      A42976        syn-C2H3C(O)NH2, v=0
  538059.8649  0.0060 -3.5279 3  725.0075149  71510 303741460      731559        syn-C2H3C(O)NH2, v=0
  538060.9252  0.0029 -3.3349 3  303.0426 95  71510 303471334      461235        syn-C2H3C(O)NH2, v=0
  538095.2048  0.0060 -5.4158 3  725.0075149  71510 303741560      731559        syn-C2H3C(O)NH2, v=0
  538119.9976  0.0060 -5.4157 3  725.0055149  71510 303741460      731459        syn-C2H3C(O)NH2, v=0
  538128.9579  0.0238 -4.9033 3  922.6944163  71510 303812259      811962        syn-C2H3C(O)NH2, v=0
  538143.2198  0.0016 -3.1172 3  325.7893 97  71510 303481534      471433        syn-C2H3C(O)NH2, v=0
  538155.3374  0.0060 -3.5277 3  725.0055149  71510 303741560      731459        syn-C2H3C(O)NH2, v=0
  538156.7349  0.0056 -5.5618 3  775.7682145  71510 303722548      712547        syn-C2H3C(O)NH2, v=0
  538157.0588  0.0056 -5.5618 3  775.7682145  71510 303722547      712546        syn-C2H3C(O)NH2, v=0
  538183.7773  0.0306 -4.9338 3 1473.2032191  71510 303954055      953956        syn-C2H3C(O)NH2, v=0
  538183.7773  0.0306 -4.9338 3 1473.2032191  71510 303954056      953957        syn-C2H3C(O)NH2, v=0
  538241.8996  0.0074 -5.8554 3  898.7981147  71510 303733340      723339        syn-C2H3C(O)NH2, v=0
  538241.8996  0.0074 -5.8554 3  898.7981147  71510 303733341      723340        syn-C2H3C(O)NH2, v=0
  538324.4220  0.0124 -4.0145 3  912.0233137  71510 303683929      683830        syn-C2H3C(O)NH2, v=0
  538324.4220  0.0124 -4.0145 3  912.0233137  71510 303683930      683831        syn-C2H3C(O)NH2, v=0
  538366.0840  0.0023 -4.9660 3  207.5842 75  71510 303371522      371225        syn-C2H3C(O)NH2, v=0
  538539.4424  0.0597 -5.6695 3 1872.5742221  71510 303B04169      B04070        syn-C2H3C(O)NH2, v=0
  538539.4425  0.0597 -5.6695 3 1872.5742221  71510 303B04170      B04071        syn-C2H3C(O)NH2, v=0
  538643.6503  0.0051 -5.4321 3  718.7415143  71510 303712151      702150        syn-C2H3C(O)NH2, v=0
  538650.9032  0.0122 -3.9925 3  895.4008135  71510 303673928      673829        syn-C2H3C(O)NH2, v=0
  538650.9032  0.0122 -3.9925 3  895.4008135  71510 303673929      673830        syn-C2H3C(O)NH2, v=0
  538779.9303  0.0885 -5.3447 3 1623.4124229  71510 303B41599      B414A0        syn-C2H3C(O)NH2, v=0
  538779.9303  0.0885 -5.3447 3 1623.4124229  71510 303B41699      B415A0        syn-C2H3C(O)NH2, v=0
  538833.2432  0.0043 -4.6442 3  371.0335105  71510 303521439      521142        syn-C2H3C(O)NH2, v=0
  538885.5116  0.0072 -5.8167 3  883.8437147  71510 303733241      723240        syn-C2H3C(O)NH2, v=0
  538885.5116  0.0072 -5.8167 3  883.8437147  71510 303733242      723241        syn-C2H3C(O)NH2, v=0
  538951.3632  0.0056 -3.5771 3  716.1393147  71510 303731558      721657        syn-C2H3C(O)NH2, v=0
  538964.2120  0.0120 -3.9716 3  879.0273133  71510 303663927      663828        syn-C2H3C(O)NH2, v=0
  538964.2120  0.0120 -3.9716 3  879.0273133  71510 303663928      663829        syn-C2H3C(O)NH2, v=0
  538968.1215  0.0047 -5.3573 3  688.1304143  71510 303711655      701654        syn-C2H3C(O)NH2, v=0
  539004.4518  0.0294 -4.8912 3 1449.7971189  71510 303944054      943955        syn-C2H3C(O)NH2, v=0
  539004.4518  0.0294 -4.8912 3 1449.7971189  71510 303944055      943956        syn-C2H3C(O)NH2, v=0
  539159.8552  0.0043 -4.6956 3  339.3697101  71510 303501338      501041        syn-C2H3C(O)NH2, v=0
  539259.9774  0.0035 -4.5869 3  410.2116109  71510 303541639      541342        syn-C2H3C(O)NH2, v=0
  539264.7559  0.0119 -3.9516 3  862.9024131  71510 303653926      653827        syn-C2H3C(O)NH2, v=0
  539264.7559  0.0119 -3.9516 3  862.9024131  71510 303653927      653828        syn-C2H3C(O)NH2, v=0
  539323.2396  0.0991 -5.4631 3 1694.1776233  71510 303B616A0      B615A1        syn-C2H3C(O)NH2, v=0
  539323.2396  0.0991 -5.4631 3 1694.1776233  71510 303B617A0      B616A1        syn-C2H3C(O)NH2, v=0
  539353.4241  0.0507 -4.5889 3  986.4397191  71510 30395 491      95 392        syn-C2H3C(O)NH2, v=0
  539353.4241  0.0507 -4.5889 3  986.4397191  71510 30395 591      95 492        syn-C2H3C(O)NH2, v=0
  539354.1896  0.0571 -4.8697 3 1311.2425211  71510 303A51095      A5 996        syn-C2H3C(O)NH2, v=0
  539354.1896  0.0571 -4.8697 3 1311.2425211  71510 303A51195      A51096        syn-C2H3C(O)NH2, v=0
  539419.7540  0.1584 -5.9797 3 1989.4323249  71510 303C420A4      C419A5        syn-C2H3C(O)NH2, v=0
  539419.7540  0.1584 -5.9797 3 1989.4323249  71510 303C421A4      C420A5        syn-C2H3C(O)NH2, v=0
  539448.7703  0.0056 -5.4022 3  716.1393147  71510 303731658      721657        syn-C2H3C(O)NH2, v=0
  539452.3857  0.0052 -5.4309 3  718.7824143  71510 303712150      702149        syn-C2H3C(O)NH2, v=0
  539552.9322  0.0118 -3.9327 3  847.0259129  71510 303643925      643826        syn-C2H3C(O)NH2, v=0
  539552.9322  0.0118 -3.9327 3  847.0259129  71510 303643926      643827        syn-C2H3C(O)NH2, v=0
  539594.2402  0.0070 -5.7791 3  869.3944147  71510 303733142      723141        syn-C2H3C(O)NH2, v=0
  539594.2402  0.0070 -5.7791 3  869.3944147  71510 303733143      723142        syn-C2H3C(O)NH2, v=0
  539604.4852  0.0022 -4.9644 3  207.5429 75  71510 303371523      371226        syn-C2H3C(O)NH2, v=0
  539667.2206  0.1113 -5.5859 3 1766.1680237  71510 303B817A1      B816A2        syn-C2H3C(O)NH2, v=0
  539667.2206  0.1113 -5.5859 3 1766.1680237  71510 303B818A1      B817A2        syn-C2H3C(O)NH2, v=0
  539724.7141  0.1407 -5.8444 3 1913.8014245  71510 303C219A3      C218A4        syn-C2H3C(O)NH2, v=0
  539724.7141  0.1407 -5.8444 3 1913.8014245  71510 303C220A3      C219A4        syn-C2H3C(O)NH2, v=0
  539760.4657  0.0056 -5.4016 3  716.1123147  71510 303731558      721557        syn-C2H3C(O)NH2, v=0
  539783.5906  0.0572 -5.6172 3 1845.3404219  71510 303A94168      A94069        syn-C2H3C(O)NH2, v=0
  539783.5907  0.0572 -5.6172 3 1845.3404219  71510 303A94169      A94070        syn-C2H3C(O)NH2, v=0
  539797.7298  0.0283 -4.8493 3 1426.6463187  71510 303934053      933954        syn-C2H3C(O)NH2, v=0
  539797.7298  0.0283 -4.8493 3 1426.6463187  71510 303934054      933955        syn-C2H3C(O)NH2, v=0
  539803.9630  0.1251 -5.7131 3 1839.3779241  71510 303C018A2      C017A3        syn-C2H3C(O)NH2, v=0
  539803.9630  0.1251 -5.7131 3 1839.3779241  71510 303C019A2      C018A3        syn-C2H3C(O)NH2, v=0
  539820.8338  0.0056 -5.5321 3  765.0536145  71510 303722449      712448        syn-C2H3C(O)NH2, v=0
  539824.0586  0.0056 -5.5321 3  765.0537145  71510 303722448      712447        syn-C2H3C(O)NH2, v=0
  539829.1286  0.0117 -3.9150 3  831.3978127  71510 303633924      633825        syn-C2H3C(O)NH2, v=0
  539829.1286  0.0117 -3.9150 3  831.3978127  71510 303633925      633826        syn-C2H3C(O)NH2, v=0
  539888.6866  0.0056 -4.6785 3  466.6646115  71510 303571839      571542        syn-C2H3C(O)NH2, v=0
  539990.7541  0.0020 -4.6512 3   98.5609 55  71510 303271017      26 720        syn-C2H3C(O)NH2, v=0
  540044.8572  0.0505 -4.6761 3 1144.8159201  71510 303A0 793      A0 694        syn-C2H3C(O)NH2, v=0
  540044.8572  0.0505 -4.6761 3 1144.8159201  71510 303A0 893      A0 794        syn-C2H3C(O)NH2, v=0
  540093.7230  0.0117 -3.8983 3  816.0178125  71510 303623923      623824        syn-C2H3C(O)NH2, v=0
  540093.7230  0.0117 -3.8983 3  816.0178125  71510 303623924      623825        syn-C2H3C(O)NH2, v=0
  540138.3565  0.2301 -5.5308 3 1462.3761205  71510 303A22775      A12874        syn-C2H3C(O)NH2, v=0
  540191.0756  0.0555 -4.6900 3  891.7048185  71510 30392 290      92 191        syn-C2H3C(O)NH2, v=0
  540191.0756  0.0555 -4.6900 3  891.7048185  71510 30392 390      92 291        syn-C2H3C(O)NH2, v=0
  540257.8728  0.0056 -3.5749 3  716.1123147  71510 303731658      721557        syn-C2H3C(O)NH2, v=0
  540340.6284  0.0144 -4.8569 3  860.7341157  71510 303782256      781959        syn-C2H3C(O)NH2, v=0
  540347.0843  0.0116 -3.8829 3  800.8856123  71510 303613922      613823        syn-C2H3C(O)NH2, v=0
  540347.0843  0.0116 -3.8829 3  800.8856123  71510 303613923      613824        syn-C2H3C(O)NH2, v=0
  540379.4137  0.0068 -5.7428 3  855.4557147  71510 303733043      723042        syn-C2H3C(O)NH2, v=0
  540379.4137  0.0068 -5.7428 3  855.4557147  71510 303733044      723043        syn-C2H3C(O)NH2, v=0
  540398.4044  0.0047 -3.5105 3  513.3103123  71510 303611646      601545        syn-C2H3C(O)NH2, v=0
  540444.7322  0.0048 -5.3724 3  695.8515143  71510 303711854      701853        syn-C2H3C(O)NH2, v=0
  540564.4486  0.0273 -4.8082 3 1403.7504185  71510 303924052      923953        syn-C2H3C(O)NH2, v=0
  540564.4486  0.0273 -4.8082 3 1403.7504185  71510 303924053      923954        syn-C2H3C(O)NH2, v=0
  540589.5725  0.0116 -3.8688 3  786.0012121  71510 303603921      603822        syn-C2H3C(O)NH2, v=0
  540589.5725  0.0116 -3.8688 3  786.0012121  71510 303603922      603823        syn-C2H3C(O)NH2, v=0
  540811.6710  0.0623 -4.9618 3 1376.3998215  71510 303A71196      A71097        syn-C2H3C(O)NH2, v=0
  540811.6710  0.0623 -4.9618 3 1376.3998215  71510 303A71296      A71197        syn-C2H3C(O)NH2, v=0
  540821.5391  0.0116 -3.8560 3  771.3643119  71510 303593920      593821        syn-C2H3C(O)NH2, v=0
  540821.5391  0.0116 -3.8560 3  771.3643119  71510 303593921      593822        syn-C2H3C(O)NH2, v=0
  540840.7189  0.0027 -3.2706 3  376.7851105  71510 303521538      511437        syn-C2H3C(O)NH2, v=0
  540918.8831  0.0039 -3.7636 3  175.4799 75  71510 30337 829      36 730        syn-C2H3C(O)NH2, v=0
  540941.4564  0.0052 -5.3864 3  706.3761145  71510 303721756      711755        syn-C2H3C(O)NH2, v=0
  540987.5330  0.0549 -5.5655 3 1818.3663217  71510 303A84167      A84068        syn-C2H3C(O)NH2, v=0
  540987.5330  0.0549 -5.5655 3 1818.3663217  71510 303A84168      A84069        syn-C2H3C(O)NH2, v=0
  541040.9509  0.0013 -2.9828 3  297.0228 91  71510 303451630      441529        syn-C2H3C(O)NH2, v=0
  541043.3270  0.0116 -3.8446 3  756.9748117  71510 303583919      583820        syn-C2H3C(O)NH2, v=0
  541043.3270  0.0116 -3.8446 3  756.9748117  71510 303583920      583821        syn-C2H3C(O)NH2, v=0
  541088.5962  0.0027 -4.6606 3  332.2877 97  71510 303481633      481336        syn-C2H3C(O)NH2, v=0
  541185.6650  0.0013 -2.9826 3  297.0187 91  71510 303451629      441530        syn-C2H3C(O)NH2, v=0
  541218.9334  0.0017 -3.1492 3  338.0483 99  71510 303491535      481434        syn-C2H3C(O)NH2, v=0
  541247.0893  0.0048 -5.4459 3  175.4687 73  71510 303361125      36 630        syn-C2H3C(O)NH2, v=0
  541255.2531  0.0067 -5.7078 3  842.0342147  71510 303732944      722943        syn-C2H3C(O)NH2, v=0
  541255.2531  0.0067 -5.7078 3  842.0342147  71510 303732945      722944        syn-C2H3C(O)NH2, v=0
  541255.2712  0.0117 -3.8348 3  742.8324115  71510 303573918      573819        syn-C2H3C(O)NH2, v=0
  541255.2712  0.0117 -3.8348 3  742.8324115  71510 303573919      573820        syn-C2H3C(O)NH2, v=0
  541305.4136  0.0263 -4.7677 3 1381.1090183  71510 303914051      913952        syn-C2H3C(O)NH2, v=0
  541305.4136  0.0263 -4.7677 3 1381.1090183  71510 303914052      913953        syn-C2H3C(O)NH2, v=0
  541332.9649  0.0051 -5.4070 3  710.5804143  71510 303712052      702051        syn-C2H3C(O)NH2, v=0
  541445.0193  0.0021 -3.7203 3  180.1997 75  71510 303371028      36 729        syn-C2H3C(O)NH2, v=0
  541457.6989  0.0117 -3.8266 3  728.9371113  71510 303563917      563818        syn-C2H3C(O)NH2, v=0
  541457.6989  0.0117 -3.8266 3  728.9371113  71510 303563918      563819        syn-C2H3C(O)NH2, v=0
  541482.0162  0.0118 -5.4776 3  794.6959171  71510 30385 481      84 480        syn-C2H3C(O)NH2, v=0
  541482.0162  0.0118 -3.3240 3  794.6959171  71510 30385 481      84 580        syn-C2H3C(O)NH2, v=0
  541482.0162  0.0118 -3.3240 3  794.6959171  71510 30385 581      84 480        syn-C2H3C(O)NH2, v=0
  541482.0162  0.0118 -5.4776 3  794.6959171  71510 30385 581      84 580        syn-C2H3C(O)NH2, v=0
  541486.1492  0.0112 -5.4792 3  792.0930169  71510 30384 579      83 578        syn-C2H3C(O)NH2, v=0
  541486.1492  0.0112 -3.3405 3  792.0930169  71510 30384 579      83 678        syn-C2H3C(O)NH2, v=0
  541486.1492  0.0112 -3.3405 3  792.0930169  71510 30384 679      83 578        syn-C2H3C(O)NH2, v=0
  541486.1492  0.0112 -5.4792 3  792.0930169  71510 30384 679      83 678        syn-C2H3C(O)NH2, v=0
  541487.0380  0.0127 -5.4749 3  796.7739173  71510 30386 383      85 382        syn-C2H3C(O)NH2, v=0
  541487.0380  0.0127 -3.3075 3  796.7739173  71510 30386 383      85 482        syn-C2H3C(O)NH2, v=0
  541487.0380  0.0127 -3.3075 3  796.7739173  71510 30386 483      85 382        syn-C2H3C(O)NH2, v=0
  541487.0380  0.0127 -5.4749 3  796.7739173  71510 30386 483      85 482        syn-C2H3C(O)NH2, v=0
  541497.2345  0.0140 -5.4712 3  798.3335175  71510 30387 285      86 284        syn-C2H3C(O)NH2, v=0
  541497.2345  0.0140 -3.2910 3  798.3335175  71510 30387 285      86 384        syn-C2H3C(O)NH2, v=0
  541497.2345  0.0140 -3.2910 3  798.3335175  71510 30387 385      86 284        syn-C2H3C(O)NH2, v=0
  541497.2345  0.0140 -5.4712 3  798.3335175  71510 30387 385      86 384        syn-C2H3C(O)NH2, v=0
  541504.6146  0.0107 -5.4798 3  788.9576167  71510 30383 677      82 676        syn-C2H3C(O)NH2, v=0
  541504.6146  0.0107 -3.3573 3  788.9576167  71510 30383 677      82 776        syn-C2H3C(O)NH2, v=0
  541504.6146  0.0107 -3.3573 3  788.9576167  71510 30383 777      82 676        syn-C2H3C(O)NH2, v=0
  541504.6146  0.0107 -5.4798 3  788.9576167  71510 30383 777      82 776        syn-C2H3C(O)NH2, v=0
  541509.5084  0.0159 -5.4664 3  799.3802177  71510 30388 187      87 186        syn-C2H3C(O)NH2, v=0
  541509.5084  0.0159 -3.2743 3  799.3802177  71510 30388 187      87 286        syn-C2H3C(O)NH2, v=0
  541509.5084  0.0159 -3.2743 3  799.3802177  71510 30388 287      87 186        syn-C2H3C(O)NH2, v=0
  541509.5084  0.0159 -5.4664 3  799.3802177  71510 30388 287      87 286        syn-C2H3C(O)NH2, v=0
  541521.4235  0.0186 -5.4607 3  799.9185179  71510 30389 089      88 088        syn-C2H3C(O)NH2, v=0
  541521.4235  0.0186 -3.2575 3  799.9185179  71510 30389 089      88 188        syn-C2H3C(O)NH2, v=0
  541521.4235  0.0186 -3.2575 3  799.9185179  71510 30389 189      88 088        syn-C2H3C(O)NH2, v=0
  541521.4235  0.0186 -5.4607 3  799.9185179  71510 30389 189      88 188        syn-C2H3C(O)NH2, v=0
  541544.2438  0.0103 -5.4792 3  785.2804165  71510 30382 775      81 774        syn-C2H3C(O)NH2, v=0
  541544.2438  0.0103 -3.3746 3  785.2804165  71510 30382 775      81 874        syn-C2H3C(O)NH2, v=0
  541544.2438  0.0103 -3.3746 3  785.2804165  71510 30382 875      81 774        syn-C2H3C(O)NH2, v=0
  541544.2438  0.0103 -5.4792 3  785.2804165  71510 30382 875      81 874        syn-C2H3C(O)NH2, v=0
  541614.2035  0.0098 -5.4775 3  781.0503163  71510 30381 873      80 872        syn-C2H3C(O)NH2, v=0
  541614.2035  0.0098 -3.3924 3  781.0503163  71510 30381 873      80 972        syn-C2H3C(O)NH2, v=0
  541614.2035  0.0098 -3.3924 3  781.0503163  71510 30381 973      80 872        syn-C2H3C(O)NH2, v=0
  541614.2035  0.0098 -5.4775 3  781.0503163  71510 30381 973      80 972        syn-C2H3C(O)NH2, v=0
  541650.9294  0.0118 -3.8201 3  715.2886111  71510 303553916      553817        syn-C2H3C(O)NH2, v=0
  541650.9294  0.0118 -3.8201 3  715.2886111  71510 303553917      553818        syn-C2H3C(O)NH2, v=0
  541727.0463  0.0093 -5.4746 3  776.2535161  71510 30380 971      79 970        syn-C2H3C(O)NH2, v=0
  541727.0463  0.0093 -3.4112 3  776.2535161  71510 30380 971      791070        syn-C2H3C(O)NH2, v=0
  541727.0463  0.0093 -3.4112 3  776.2535161  71510 303801071      79 970        syn-C2H3C(O)NH2, v=0
  541727.0463  0.0093 -5.4746 3  776.2535161  71510 303801071      791070        syn-C2H3C(O)NH2, v=0
  541733.3126  0.0511 -4.6111 3 1045.1756195  71510 30397 592      97 493        syn-C2H3C(O)NH2, v=0
  541733.3126  0.0511 -4.6111 3 1045.1756195  71510 30397 692      97 593        syn-C2H3C(O)NH2, v=0
  541820.4419  0.0056 -5.5035 3  754.9459145  71510 303722350      712349        syn-C2H3C(O)NH2, v=0
  541835.2748  0.0118 -3.8156 3  701.8868109  71510 303543915      543816        syn-C2H3C(O)NH2, v=0
  541835.2748  0.0118 -3.8156 3  701.8868109  71510 303543916      543817        syn-C2H3C(O)NH2, v=0
  541848.4960  0.0056 -5.5035 3  754.9471145  71510 303722349      712348        syn-C2H3C(O)NH2, v=0
  541900.3982  0.0088 -3.4314 3  770.8730159  71510 303791069      781168        syn-C2H3C(O)NH2, v=0
  541900.3983  0.0088 -5.4704 3  770.8730159  71510 303791069      781068        syn-C2H3C(O)NH2, v=0
  541900.3983  0.0088 -5.4704 3  770.8730159  71510 303791169      781168        syn-C2H3C(O)NH2, v=0
  541900.3984  0.0088 -3.4314 3  770.8730159  71510 303791169      781068        syn-C2H3C(O)NH2, v=0
  541929.4474  0.0041 -4.7651 3  308.9035 97  71510 303481237      48 940        syn-C2H3C(O)NH2, v=0
  541935.0291  0.0031 -5.3726 3  180.1997 73  71510 303361224      36 729        syn-C2H3C(O)NH2, v=0
  541984.4656  0.0531 -4.7444 3 1206.7852205  71510 303A2 894      A2 795        syn-C2H3C(O)NH2, v=0
  541984.4656  0.0531 -4.7444 3 1206.7852205  71510 303A2 994      A2 895        syn-C2H3C(O)NH2, v=0
  542011.0397  0.0119 -3.8133 3  688.7315107  71510 303533914      533815        syn-C2H3C(O)NH2, v=0
  542011.0397  0.0119 -3.8133 3  688.7315107  71510 303533915      533816        syn-C2H3C(O)NH2, v=0
  542021.4009  0.0254 -4.7279 3 1358.7218181  71510 303904050      903951        syn-C2H3C(O)NH2, v=0
  542021.4009  0.0254 -4.7279 3 1358.7218181  71510 303904051      903952        syn-C2H3C(O)NH2, v=0
  542102.2458  0.0684 -5.0604 3 1442.8101219  71510 303A91297      A91198        syn-C2H3C(O)NH2, v=0
  542102.2458  0.0684 -5.0604 3 1442.8101219  71510 303A91397      A91298        syn-C2H3C(O)NH2, v=0
  542151.5928  0.0033 -5.7533 3  145.6885 65  71510 303321220      32 725        syn-C2H3C(O)NH2, v=0
  542152.6488  0.0527 -5.5144 3 1791.6514215  71510 303A74166      A74067        syn-C2H3C(O)NH2, v=0
  542152.6488  0.0527 -5.5144 3 1791.6514215  71510 303A74167      A74068        syn-C2H3C(O)NH2, v=0
  542159.8068  0.0083 -3.4534 3  764.8870157  71510 303781167      771266        syn-C2H3C(O)NH2, v=0
  542159.8086  0.0083 -5.4648 3  764.8870157  71510 303781267      771266        syn-C2H3C(O)NH2, v=0
  542159.8102  0.0083 -5.4648 3  764.8870157  71510 303781167      771166        syn-C2H3C(O)NH2, v=0
  542159.8120  0.0083 -3.4534 3  764.8870157  71510 303781267      771166        syn-C2H3C(O)NH2, v=0
  542178.5217  0.0120 -3.8132 3  675.8225105  71510 303523913      523814        syn-C2H3C(O)NH2, v=0
  542178.5217  0.0120 -3.8132 3  675.8225105  71510 303523914      523815        syn-C2H3C(O)NH2, v=0
  542239.9571  0.0066 -5.6739 3  829.1381147  71510 303732846      722845        syn-C2H3C(O)NH2, v=0
  542239.9575  0.0066 -5.6739 3  829.1381147  71510 303732845      722844        syn-C2H3C(O)NH2, v=0
  542338.0116  0.0121 -3.8158 3  663.1598103  71510 303513912      513813        syn-C2H3C(O)NH2, v=0
  542338.0116  0.0121 -3.8158 3  663.1598103  71510 303513913      513814        syn-C2H3C(O)NH2, v=0
  542489.7932  0.0123 -3.8214 3  650.7431101  71510 303503911      503812        syn-C2H3C(O)NH2, v=0
  542489.7932  0.0123 -3.8214 3  650.7431101  71510 303503912      503813        syn-C2H3C(O)NH2, v=0
  542537.7685  0.0050 -5.3862 3  703.0488143  71510 303711953      701952        syn-C2H3C(O)NH2, v=0
  542543.8168  0.0077 -3.4781 3  758.2672155  71510 303771265      761364        syn-C2H3C(O)NH2, v=0
  542543.8664  0.0077 -5.4576 3  758.2672155  71510 303771365      761364        syn-C2H3C(O)NH2, v=0
  542543.9073  0.0077 -5.4576 3  758.2672155  71510 303771265      761264        syn-C2H3C(O)NH2, v=0
  542543.9569  0.0077 -3.4781 3  758.2672155  71510 303771365      761264        syn-C2H3C(O)NH2, v=0
  542634.1439  0.0124 -3.8304 3  638.5724 99  71510 303493910      493811        syn-C2H3C(O)NH2, v=0
  542634.1439  0.0124 -3.8304 3  638.5724 99  71510 303493911      493812        syn-C2H3C(O)NH2, v=0
  542662.5443  0.0022 -5.0165 3  198.2767 73  71510 303361521      361224        syn-C2H3C(O)NH2, v=0
  542713.1582  0.0245 -4.6888 3 1336.5887179  71510 303894049      893950        syn-C2H3C(O)NH2, v=0
  542713.1582  0.0245 -4.6888 3 1336.5887179  71510 303894050      893951        syn-C2H3C(O)NH2, v=0
  542771.3342  0.0125 -3.8434 3  626.6473 97  71510 3034839 9      483810        syn-C2H3C(O)NH2, v=0
  542771.3342  0.0125 -3.8434 3  626.6473 97  71510 303483910      483811        syn-C2H3C(O)NH2, v=0
  542845.0459  0.0546 -4.6286 3  948.4616189  71510 30394 391      94 292        syn-C2H3C(O)NH2, v=0
  542845.0459  0.0546 -4.6286 3  948.4616189  71510 30394 491      94 392        syn-C2H3C(O)NH2, v=0
  542851.0803  0.0043 -4.6130 3  403.8813109  71510 303541540      541243        syn-C2H3C(O)NH2, v=0
  542854.0499  0.0044 -3.6343 3  222.8669 83  71510 303411031      40 932        syn-C2H3C(O)NH2, v=0
  542865.0270  0.0023 -3.2264 3  363.5373103  71510 303511537      501436        syn-C2H3C(O)NH2, v=0
  542901.6287  0.0127 -3.8612 3  614.9680 95  71510 3034739 8      4738 9        syn-C2H3C(O)NH2, v=0
  542901.6287  0.0127 -3.8612 3  614.9680 95  71510 3034739 9      473810        syn-C2H3C(O)NH2, v=0
  542906.6741  0.0020 -3.1856 3  350.6274101  71510 303501536      491435        syn-C2H3C(O)NH2, v=0
  543025.2853  0.0129 -3.8847 3  603.5340 93  71510 3034639 7      4638 8        syn-C2H3C(O)NH2, v=0
  543025.2853  0.0129 -3.8847 3  603.5340 93  71510 3034639 8      4638 9        syn-C2H3C(O)NH2, v=0
  543030.2683  0.0038 -5.6564 3   64.9981 47  71510 30323 816      22 319        syn-C2H3C(O)NH2, v=0
  543112.8184  0.0072 -3.5067 3  750.9751153  71510 303761363      751462        syn-C2H3C(O)NH2, v=0
  543113.9385  0.0072 -5.4488 3  750.9751153  71510 303761463      751462        syn-C2H3C(O)NH2, v=0
  543114.8048  0.0072 -5.4488 3  750.9750153  71510 303761363      751362        syn-C2H3C(O)NH2, v=0
  543115.9249  0.0072 -3.5067 3  750.9750153  71510 303761463      751362        syn-C2H3C(O)NH2, v=0
  543142.5560  0.0130 -3.9154 3  592.3455 91  71510 3034539 6      4538 7        syn-C2H3C(O)NH2, v=0
  543142.5560  0.0130 -3.9154 3  592.3455 91  71510 3034539 7      4538 8        syn-C2H3C(O)NH2, v=0
  543221.1047  0.0756 -5.1648 3 1510.4679223  71510 303B11398      B11299        syn-C2H3C(O)NH2, v=0
  543221.1047  0.0756 -5.1648 3 1510.4679223  71510 303B11498      B11399        syn-C2H3C(O)NH2, v=0
  543251.8690  0.0042 -5.2964 3  657.8120139  71510 303691752      681751        syn-C2H3C(O)NH2, v=0
  543253.6866  0.0132 -3.9555 3  581.4021 89  71510 3034439 5      4438 6        syn-C2H3C(O)NH2, v=0
  543253.6866  0.0132 -3.9555 3  581.4021 89  71510 3034439 6      4438 7        syn-C2H3C(O)NH2, v=0
  543280.2501  0.0506 -5.4641 3 1765.1955213  71510 303A64165      A64066        syn-C2H3C(O)NH2, v=0
  543280.2501  0.0506 -5.4641 3 1765.1955213  71510 303A64166      A64067        syn-C2H3C(O)NH2, v=0
  543344.6062  0.0022 -5.0156 3  198.2539 73  71510 303361522      361225        syn-C2H3C(O)NH2, v=0
  543357.3685  0.0065 -5.6411 3  816.7777147  71510 303732747      722746        syn-C2H3C(O)NH2, v=0
  543357.3732  0.0065 -5.6411 3  816.7777147  71510 303732746      722745        syn-C2H3C(O)NH2, v=0
  543358.9169  0.0134 -4.0081 3  570.7038 87  71510 3034339 4      4338 5        syn-C2H3C(O)NH2, v=0
  543358.9169  0.0134 -4.0081 3  570.7038 87  71510 3034339 5      4338 6        syn-C2H3C(O)NH2, v=0
  543381.4073  0.0236 -4.6503 3 1314.7091177  71510 303884048      883949        syn-C2H3C(O)NH2, v=0
  543381.4073  0.0236 -4.6503 3 1314.7091177  71510 303884049      883950        syn-C2H3C(O)NH2, v=0
  543382.6364  0.1997 -5.3530 3 1375.6791199  71510 303992673      982772        syn-C2H3C(O)NH2, v=0
  543418.8934  0.0606 -4.9081 3  854.7113183  71510 30391 190      91 091        syn-C2H3C(O)NH2, v=0
  543418.8934  0.0606 -4.9081 3  854.7113183  71510 30391 290      91 191        syn-C2H3C(O)NH2, v=0
  543429.0675  0.0060 -3.6587 3  724.4200147  71510 303731657      721756        syn-C2H3C(O)NH2, v=0
  543458.4808  0.0136 -4.0788 3  560.2504 85  71510 3034239 3      4238 4        syn-C2H3C(O)NH2, v=0
  543458.4808  0.0136 -4.0788 3  560.2504 85  71510 3034239 4      4238 5        syn-C2H3C(O)NH2, v=0
  543476.3488  0.0012 -2.9080 3  282.1963 87  71510 303431727      421626        syn-C2H3C(O)NH2, v=0
  543479.3575  0.0012 -2.9080 3  282.1962 87  71510 303431726      421627        syn-C2H3C(O)NH2, v=0
  543510.2564  0.0017 -2.6064 3  221.4321 55  71510 3032725 2      2624 3        syn-C2H3C(O)NH2, v=0
  543510.2564  0.0017 -2.6064 3  221.4321 55  71510 3032725 3      2624 2        syn-C2H3C(O)NH2, v=0
  543545.7623  0.0029 -4.7570 3  296.9400 91  71510 303451629      451332        syn-C2H3C(O)NH2, v=0
  543552.6066  0.0138 -4.1779 3  550.0419 83  71510 3034139 2      4138 3        syn-C2H3C(O)NH2, v=0
  543552.6066  0.0138 -4.1779 3  550.0419 83  71510 3034139 3      4138 4        syn-C2H3C(O)NH2, v=0
  543641.5164  0.0140 -4.3285 3  540.0781 81  71510 3034039 1      4038 2        syn-C2H3C(O)NH2, v=0
  543641.5164  0.0140 -4.3285 3  540.0781 81  71510 3034039 2      4038 3        syn-C2H3C(O)NH2, v=0
  543702.7891  0.0052 -5.3813 3  706.1085145  71510 303721656      711655        syn-C2H3C(O)NH2, v=0
  543725.4270  0.0142 -4.6042 3  530.3589 79  71510 3033939 0      3938 1        syn-C2H3C(O)NH2, v=0
  543725.4270  0.0142 -4.6042 3  530.3589 79  71510 3033939 1      3938 2        syn-C2H3C(O)NH2, v=0
  543771.3117  0.0566 -4.8225 3 1270.0229209  71510 303A4 995      A4 896        syn-C2H3C(O)NH2, v=0
  543771.3117  0.0566 -4.8225 3 1270.0229209  71510 303A41095      A4 996        syn-C2H3C(O)NH2, v=0
  543938.8125  0.0016 -2.6305 3  223.7450 59  71510 3032924 5      2823 6        syn-C2H3C(O)NH2, v=0
  543938.8125  0.0016 -2.6305 3  223.7450 59  71510 3032924 6      2823 5        syn-C2H3C(O)NH2, v=0
  543950.5133  0.0067 -3.5414 3  742.9564151  71510 303751461      741560        syn-C2H3C(O)NH2, v=0
  543971.1459  0.0067 -5.4379 3  742.9564151  71510 303751561      741560        syn-C2H3C(O)NH2, v=0
  543971.4040  0.0523 -4.6539 3 1105.1949199  71510 30399 693      99 594        syn-C2H3C(O)NH2, v=0
  543971.4040  0.0523 -4.6539 3 1105.1949199  71510 30399 793      99 694        syn-C2H3C(O)NH2, v=0
  543985.8531  0.0067 -5.4378 3  742.9552151  71510 303751461      741460        syn-C2H3C(O)NH2, v=0
  544006.4857  0.0067 -3.5413 3  742.9552151  71510 303751561      741460        syn-C2H3C(O)NH2, v=0
  544026.8446  0.0228 -4.6126 3 1293.0830175  71510 303874047      873948        syn-C2H3C(O)NH2, v=0
  544026.8446  0.0228 -4.6126 3 1293.0830175  71510 303874048      873949        syn-C2H3C(O)NH2, v=0
  544060.1888  0.0023 -5.4637 3   61.7130 41  71510 303201110      19 811        syn-C2H3C(O)NH2, v=0
  544063.7207  0.0046 -5.0175 3   97.0102 63  71510 30331 229      30 130        syn-C2H3C(O)NH2, v=0
  544063.7886  0.0046 -5.0175 3   97.0102 63  71510 30331 329      30 030        syn-C2H3C(O)NH2, v=0
  544134.4795  0.0023 -5.4637 3   61.7105 41  71510 3032011 9      19 812        syn-C2H3C(O)NH2, v=0
  544163.0064  0.0840 -5.2747 3 1579.3679227  71510 303B31499      B313A0        syn-C2H3C(O)NH2, v=0
  544163.0064  0.0840 -5.2747 3 1579.3679227  71510 303B31599      B314A0        syn-C2H3C(O)NH2, v=0
  544247.8217  0.0057 -5.4758 3  745.4829145  71510 303722251      712250        syn-C2H3C(O)NH2, v=0
  544297.0991  0.0047 -5.3060 3  662.4330139  71510 303691851      681850        syn-C2H3C(O)NH2, v=0
  544344.0658  0.0014 -2.6568 3  227.5315 63  71510 3033123 8      3022 9        syn-C2H3C(O)NH2, v=0
  544344.0658  0.0014 -2.6568 3  227.5315 63  71510 3033123 9      3022 8        syn-C2H3C(O)NH2, v=0
  544371.5863  0.0486 -5.4144 3 1738.9980211  71510 303A54164      A54065        syn-C2H3C(O)NH2, v=0
  544371.5863  0.0486 -5.4144 3 1738.9980211  71510 303A54165      A54066        syn-C2H3C(O)NH2, v=0
  544428.1676  0.0067 -4.6980 3  549.8527125  71510 303621943      621646        syn-C2H3C(O)NH2, v=0
  544447.6462  0.0058 -5.7152 3  152.0478 73  71510 30336 531      36 234        syn-C2H3C(O)NH2, v=0
  544456.8039  0.0057 -5.4754 3  745.4926145  71510 303722250      712249        syn-C2H3C(O)NH2, v=0
  544474.6310  0.0058 -5.7152 3  152.0478 73  71510 30336 631      36 334        syn-C2H3C(O)NH2, v=0
  544529.5697  0.0228 -4.1192 3  842.5706157  71510 303781959      772058        syn-C2H3C(O)NH2, v=0
  544599.7319  0.0012 -2.8485 3  269.1219 83  71510 303411824      401723        syn-C2H3C(O)NH2, v=0
  544599.7689  0.0012 -2.8485 3  269.1219 83  71510 303411823      401724        syn-C2H3C(O)NH2, v=0
  544639.6445  0.0064 -5.6095 3  804.9658147  71510 303732648      722647        syn-C2H3C(O)NH2, v=0
  544639.7016  0.0064 -5.6095 3  804.9658147  71510 303732647      722646        syn-C2H3C(O)NH2, v=0
  544650.1431  0.0221 -4.5757 3 1271.7099173  71510 303864046      863947        syn-C2H3C(O)NH2, v=0
  544650.1431  0.0221 -4.5757 3 1271.7099173  71510 303864047      863948        syn-C2H3C(O)NH2, v=0
  544672.0941  0.0086 -5.9529 3  948.1204149  71510 303743539      733538        syn-C2H3C(O)NH2, v=0
  544672.0941  0.0086 -5.9529 3  948.1204149  71510 303743540      733539        syn-C2H3C(O)NH2, v=0
  544676.3562  0.0043 -4.9630 3  251.6231 89  71510 30344 935      44 638        syn-C2H3C(O)NH2, v=0
  544704.8082  0.0013 -2.6861 3  232.8023 67  71510 303332211      322112        syn-C2H3C(O)NH2, v=0
  544704.8082  0.0013 -2.6861 3  232.8023 67  71510 303332212      322111        syn-C2H3C(O)NH2, v=0
  544770.8659  0.0014 -3.1091 3  325.6123 97  71510 303481533      471434        syn-C2H3C(O)NH2, v=0
  544884.8401  0.0042 -3.7004 3  198.5703 79  71510 30339 930      38 831        syn-C2H3C(O)NH2, v=0
  544922.2258  0.0936 -5.3895 3 1649.5047231  71510 303B515A0      B514A1        syn-C2H3C(O)NH2, v=0
  544922.2258  0.0936 -5.3895 3 1649.5047231  71510 303B516A0      B515A1        syn-C2H3C(O)NH2, v=0
  544949.1309  0.0062 -3.5868 3  734.1334149  71510 303741559      731658        syn-C2H3C(O)NH2, v=0
  544986.8461  0.0013 -2.7189 3  239.5721 71  71510 303352114      342015        syn-C2H3C(O)NH2, v=0
  544986.8461  0.0013 -2.7189 3  239.5721 71  71510 303352115      342014        syn-C2H3C(O)NH2, v=0
  545029.4783  0.0054 -5.3524 3  685.9921141  71510 303701951      691950        syn-C2H3C(O)NH2, v=0
  545042.9840  0.0038 -4.5929 3  423.9561111  71510 303551640      551343        syn-C2H3C(O)NH2, v=0
  545057.6904  0.0012 -2.7988 3  257.6973 79  71510 303391921      381820        syn-C2H3C(O)NH2, v=0
  545057.6906  0.0012 -2.7988 3  257.6973 79  71510 303391920      381821        syn-C2H3C(O)NH2, v=0
  545134.8520  0.0012 -2.7561 3  247.8610 75  71510 303372017      361918        syn-C2H3C(O)NH2, v=0
  545134.8520  0.0012 -2.7561 3  247.8610 75  71510 303372018      361917        syn-C2H3C(O)NH2, v=0
  545234.1877  0.0083 -5.9118 3  932.1871149  71510 303743440      733439        syn-C2H3C(O)NH2, v=0
  545234.1877  0.0083 -5.9118 3  932.1871149  71510 303743441      733440        syn-C2H3C(O)NH2, v=0
  545251.9537  0.0214 -4.5394 3 1250.5896171  71510 303854045      853946        syn-C2H3C(O)NH2, v=0
  545251.9537  0.0214 -4.5394 3 1250.5896171  71510 303854046      853947        syn-C2H3C(O)NH2, v=0
  545252.1675  0.0062 -5.4245 3  734.1334149  71510 303741659      731658        syn-C2H3C(O)NH2, v=0
  545363.6861  0.0544 -4.6213 3 1006.5114193  71510 30396 492      96 393        syn-C2H3C(O)NH2, v=0
  545363.6861  0.0544 -4.6213 3 1006.5114193  71510 30396 592      96 493        syn-C2H3C(O)NH2, v=0
  545383.0815  0.0026 -4.6864 3  320.1207 95  71510 303471632      471335        syn-C2H3C(O)NH2, v=0
  545401.7517  0.0611 -4.9087 3 1334.5239213  71510 303A61096      A6 997        syn-C2H3C(O)NH2, v=0
  545401.7517  0.0611 -4.9087 3 1334.5239213  71510 303A61196      A61097        syn-C2H3C(O)NH2, v=0
  545414.3164  0.0040 -4.8522 3  279.6499 93  71510 303461136      46 839        syn-C2H3C(O)NH2, v=0
  545427.8487  0.0467 -5.3654 3 1713.0585209  71510 303A44163      A44064        syn-C2H3C(O)NH2, v=0
  545427.8487  0.0467 -5.3654 3 1713.0585209  71510 303A44164      A44065        syn-C2H3C(O)NH2, v=0
  545432.2519  0.0056 -5.4009 3  710.8293143  71510 303712051      702050        syn-C2H3C(O)NH2, v=0
  545446.5381  0.0062 -5.4241 3  734.1168149  71510 303741559      731558        syn-C2H3C(O)NH2, v=0
  545492.4944  0.1046 -5.5090 3 1720.8727235  71510 303B716A1      B715A2        syn-C2H3C(O)NH2, v=0
  545492.4944  0.1046 -5.5090 3 1720.8727235  71510 303B717A1      B716A2        syn-C2H3C(O)NH2, v=0
  545545.1612  0.0275 -4.8401 3  807.0094153  71510 303762056      761759        syn-C2H3C(O)NH2, v=0
  545749.5747  0.0062 -3.5855 3  734.1168149  71510 303741659      731558        syn-C2H3C(O)NH2, v=0
  545832.9057  0.0207 -4.5038 3 1229.7219169  71510 303844044      843945        syn-C2H3C(O)NH2, v=0
  545832.9057  0.0207 -4.5038 3 1229.7219169  71510 303844045      843946        syn-C2H3C(O)NH2, v=0
  545847.2241  0.0081 -5.8720 3  916.7519149  71510 303743341      733340        syn-C2H3C(O)NH2, v=0
  545847.2241  0.0081 -5.8720 3  916.7519149  71510 303743342      733341        syn-C2H3C(O)NH2, v=0
  545866.9306  0.1171 -5.6331 3 1793.4663239  71510 303B917A2      B916A3        syn-C2H3C(O)NH2, v=0
  545866.9306  0.1171 -5.6331 3 1793.4663239  71510 303B918A2      B917A3        syn-C2H3C(O)NH2, v=0
  545997.2069  0.1475 -5.8940 3 1942.3071247  71510 303C319A4      C318A5        syn-C2H3C(O)NH2, v=0
  545997.2069  0.1475 -5.8940 3 1942.3071247  71510 303C320A4      C319A5        syn-C2H3C(O)NH2, v=0
  546037.9575  0.1313 -5.7615 3 1867.2797243  71510 303C118A3      C117A4        syn-C2H3C(O)NH2, v=0
  546037.9575  0.1313 -5.7615 3 1867.2797243  71510 303C119A3      C118A4        syn-C2H3C(O)NH2, v=0
  546064.8768  0.0542 -4.7118 3 1166.4925203  71510 303A1 794      A1 695        syn-C2H3C(O)NH2, v=0
  546064.8768  0.0542 -4.7118 3 1166.4925203  71510 303A1 894      A1 795        syn-C2H3C(O)NH2, v=0
  546131.6763  0.0063 -5.5790 3  793.7191147  71510 303732549      722548        syn-C2H3C(O)NH2, v=0
  546132.2936  0.0063 -5.5790 3  793.7192147  71510 303732548      722547        syn-C2H3C(O)NH2, v=0
  546202.7006  0.0593 -4.7203 3  910.7728187  71510 30393 291      93 192        syn-C2H3C(O)NH2, v=0
  546202.7006  0.0593 -4.7203 3  910.7728187  71510 30393 391      93 292        syn-C2H3C(O)NH2, v=0
  546364.1573  0.0330 -4.8884 3  874.0360159  71510 303792158      791861        syn-C2H3C(O)NH2, v=0
  546393.6086  0.0201 -4.4690 3 1209.1064167  71510 303834043      833944        syn-C2H3C(O)NH2, v=0
  546393.6086  0.0201 -4.4690 3 1209.1064167  71510 303834044      833945        syn-C2H3C(O)NH2, v=0
  546410.3598  0.0022 -5.0704 3  189.2457 71  71510 303351520      351223        syn-C2H3C(O)NH2, v=0
  546450.1745  0.0448 -5.3170 3 1687.3767207  71510 303A34162      A34063        syn-C2H3C(O)NH2, v=0
  546450.1745  0.0448 -5.3170 3 1687.3767207  71510 303A34163      A34064        syn-C2H3C(O)NH2, v=0
  546519.1922  0.0079 -5.8335 3  901.8190149  71510 303743242      733241        syn-C2H3C(O)NH2, v=0
  546519.1922  0.0079 -5.8335 3  901.8190149  71510 303743243      733242        syn-C2H3C(O)NH2, v=0
  546525.5429  0.0048 -3.6276 3  670.3013141  71510 303701754      691653        syn-C2H3C(O)NH2, v=0
  546733.9970  0.0050 -4.8068 3  320.5528 99  71510 303491138      49 841        syn-C2H3C(O)NH2, v=0
  546775.4451  0.0022 -5.0699 3  189.2335 71  71510 303351521      351224        syn-C2H3C(O)NH2, v=0
  546828.6586  0.0058 -5.4086 3  724.4200147  71510 303731757      721756        syn-C2H3C(O)NH2, v=0
  546871.8419  0.0664 -5.0021 3 1400.2831217  71510 303A81197      A81098        syn-C2H3C(O)NH2, v=0
  546871.8419  0.0664 -5.0021 3 1400.2831217  71510 303A81297      A81198        syn-C2H3C(O)NH2, v=0
  546918.4545  0.0084 -4.7350 3  639.8970135  71510 303672047      671750        syn-C2H3C(O)NH2, v=0
  546934.6527  0.0195 -4.4349 3 1188.7429165  71510 303824042      823943        syn-C2H3C(O)NH2, v=0
  546934.6527  0.0195 -4.4349 3 1188.7429165  71510 303824043      823944        syn-C2H3C(O)NH2, v=0
  546991.8518  0.0049 -3.6319 3  688.1304143  71510 303711755      701654        syn-C2H3C(O)NH2, v=0
  547042.5571  0.0054 -5.3933 3  713.8788145  71510 303721855      711854        syn-C2H3C(O)NH2, v=0
  547057.5668  0.0058 -5.4491 3  736.7087145  71510 303722152      712151        syn-C2H3C(O)NH2, v=0
  547212.6215  0.0037 -4.6057 3  108.6205 59  71510 30329 920      28 623        syn-C2H3C(O)NH2, v=0
  547259.8584  0.0077 -5.7962 3  887.3933149  71510 303743144      733143        syn-C2H3C(O)NH2, v=0
  547259.8585  0.0077 -5.7962 3  887.3933149  71510 303743143      733142        syn-C2H3C(O)NH2, v=0
  547276.9842  0.1673 -5.1744 3 1291.6210193  71510 303962571      952670        syn-C2H3C(O)NH2, v=0
  547281.9699  0.0081 -3.7806 3  750.5866149  71510 303741757      731856        syn-C2H3C(O)NH2, v=0
  547348.4775  0.0014 -3.0006 3  308.3001 93  71510 303461631      451530        syn-C2H3C(O)NH2, v=0
  547439.6505  0.0431 -5.2693 3 1661.9522205  71510 303A24161      A24062        syn-C2H3C(O)NH2, v=0
  547439.6505  0.0431 -5.2693 3 1661.9522205  71510 303A24162      A24063        syn-C2H3C(O)NH2, v=0
  547456.6103  0.0190 -4.4016 3 1168.6312163  71510 303814041      813942        syn-C2H3C(O)NH2, v=0
  547456.6103  0.0190 -4.4016 3 1168.6312163  71510 303814042      813943        syn-C2H3C(O)NH2, v=0
  547509.4287  0.0130 -5.5006 3  812.7578173  71510 30386 482      85 481        syn-C2H3C(O)NH2, v=0
  547509.4287  0.0130 -3.3463 3  812.7578173  71510 30386 482      85 581        syn-C2H3C(O)NH2, v=0
  547509.4287  0.0130 -3.3463 3  812.7578173  71510 30386 582      85 481        syn-C2H3C(O)NH2, v=0
  547509.4287  0.0130 -5.5006 3  812.7578173  71510 30386 582      85 581        syn-C2H3C(O)NH2, v=0
  547512.6606  0.0123 -5.5022 3  810.1550171  71510 30385 580      84 579        syn-C2H3C(O)NH2, v=0
  547512.6606  0.0123 -3.3625 3  810.1550171  71510 30385 580      84 679        syn-C2H3C(O)NH2, v=0
  547512.6606  0.0123 -3.3625 3  810.1550171  71510 30385 680      84 579        syn-C2H3C(O)NH2, v=0
  547512.6606  0.0123 -5.5022 3  810.1550171  71510 30385 680      84 679        syn-C2H3C(O)NH2, v=0
  547514.9749  0.0139 -5.4980 3  814.8360175  71510 30387 384      86 383        syn-C2H3C(O)NH2, v=0
  547514.9749  0.0139 -3.3301 3  814.8360175  71510 30387 384      86 483        syn-C2H3C(O)NH2, v=0
  547514.9749  0.0139 -3.3301 3  814.8360175  71510 30387 484      86 383        syn-C2H3C(O)NH2, v=0
  547514.9749  0.0139 -5.4980 3  814.8360175  71510 30387 484      86 483        syn-C2H3C(O)NH2, v=0
  547525.4469  0.0153 -5.4944 3  816.3959177  71510 30388 286      87 285        syn-C2H3C(O)NH2, v=0
  547525.4469  0.0153 -3.3138 3  816.3959177  71510 30388 286      87 385        syn-C2H3C(O)NH2, v=0
  547525.4469  0.0153 -3.3138 3  816.3959177  71510 30388 386      87 285        syn-C2H3C(O)NH2, v=0
  547525.4469  0.0153 -5.4944 3  816.3959177  71510 30388 386      87 385        syn-C2H3C(O)NH2, v=0
  547529.6621  0.0117 -5.5027 3  807.0202169  71510 30384 678      83 677        syn-C2H3C(O)NH2, v=0
  547529.6621  0.0117 -3.3790 3  807.0202169  71510 30384 678      83 777        syn-C2H3C(O)NH2, v=0
  547529.6621  0.0117 -3.3790 3  807.0202169  71510 30384 778      83 677        syn-C2H3C(O)NH2, v=0
  547529.6621  0.0117 -5.5027 3  807.0202169  71510 30384 778      83 777        syn-C2H3C(O)NH2, v=0
  547534.1700  0.0213 -4.8053 3  742.5468147  71510 303731954      731657        syn-C2H3C(O)NH2, v=0
  547537.8361  0.0174 -5.4897 3  817.4430179  71510 30389 188      88 187        syn-C2H3C(O)NH2, v=0
  547537.8361  0.0174 -3.2974 3  817.4430179  71510 30389 188      88 287        syn-C2H3C(O)NH2, v=0
  547537.8361  0.0174 -3.2974 3  817.4430179  71510 30389 288      88 187        syn-C2H3C(O)NH2, v=0
  547537.8361  0.0174 -5.4897 3  817.4430179  71510 30389 288      88 287        syn-C2H3C(O)NH2, v=0
  547549.7679  0.0202 -5.4841 3  817.9817181  71510 30390 090      89 089        syn-C2H3C(O)NH2, v=0
  547549.7679  0.0202 -3.2808 3  817.9817181  71510 30390 090      89 189        syn-C2H3C(O)NH2, v=0
  547549.7679  0.0202 -3.2808 3  817.9817181  71510 30390 190      89 089        syn-C2H3C(O)NH2, v=0
  547549.7679  0.0202 -5.4841 3  817.9817181  71510 30390 190      89 189        syn-C2H3C(O)NH2, v=0
  547566.9910  0.0112 -5.5020 3  803.3443167  71510 30383 776      82 775        syn-C2H3C(O)NH2, v=0
  547566.9910  0.0112 -3.3958 3  803.3443167  71510 30383 776      82 875        syn-C2H3C(O)NH2, v=0
  547566.9910  0.0112 -3.3958 3  803.3443167  71510 30383 876      82 775        syn-C2H3C(O)NH2, v=0
  547566.9910  0.0112 -5.5020 3  803.3443167  71510 30383 876      82 875        syn-C2H3C(O)NH2, v=0
  547621.5929  0.0014 -3.0003 3  308.2925 93  71510 303461630      451531        syn-C2H3C(O)NH2, v=0
  547633.4047  0.0107 -5.5003 3  799.1166165  71510 30382 874      81 873        syn-C2H3C(O)NH2, v=0
  547633.4047  0.0107 -3.4132 3  799.1166165  71510 30382 874      81 973        syn-C2H3C(O)NH2, v=0
  547633.4047  0.0107 -3.4132 3  799.1166165  71510 30382 974      81 873        syn-C2H3C(O)NH2, v=0
  547633.4047  0.0107 -5.5003 3  799.1166165  71510 30382 974      81 973        syn-C2H3C(O)NH2, v=0
  547740.8287  0.0102 -5.4973 3  794.3236163  71510 30381 972      80 971        syn-C2H3C(O)NH2, v=0
  547740.8287  0.0102 -3.4315 3  794.3236163  71510 30381 972      801071        syn-C2H3C(O)NH2, v=0
  547740.8287  0.0102 -3.4315 3  794.3236163  71510 303811072      80 971        syn-C2H3C(O)NH2, v=0
  547740.8287  0.0102 -5.4973 3  794.3236163  71510 303811072      801071        syn-C2H3C(O)NH2, v=0
  547744.6116  0.0549 -4.6448 3 1065.8493197  71510 30398 593      98 494        syn-C2H3C(O)NH2, v=0
  547744.6116  0.0549 -4.6448 3 1065.8493197  71510 30398 693      98 594        syn-C2H3C(O)NH2, v=0
  547834.6061  0.0052 -5.4522 3  175.0373 77  71510 30338 632      38 335        syn-C2H3C(O)NH2, v=0
  547891.0217  0.0020 -4.5876 3  105.2881 57  71510 303281018      27 721        syn-C2H3C(O)NH2, v=0
  547897.9783  0.0063 -5.5495 3  783.0601147  71510 303732450      722449        syn-C2H3C(O)NH2, v=0
  547903.8740  0.0063 -5.5495 3  783.0603147  71510 303732449      722448        syn-C2H3C(O)NH2, v=0
  547905.8986  0.0097 -5.4930 3  788.9489161  71510 303801070      791069        syn-C2H3C(O)NH2, v=0
  547905.8986  0.0097 -3.4510 3  788.9489161  71510 303801070      791169        syn-C2H3C(O)NH2, v=0
  547905.8986  0.0097 -3.4510 3  788.9489161  71510 303801170      791069        syn-C2H3C(O)NH2, v=0
  547905.8986  0.0097 -5.4930 3  788.9489161  71510 303801170      791169        syn-C2H3C(O)NH2, v=0
  547912.9633  0.0048 -3.6238 3  652.6132139  71510 303691753      681652        syn-C2H3C(O)NH2, v=0
  547944.8425  0.0052 -5.4520 3  175.0373 77  71510 30338 732      38 435        syn-C2H3C(O)NH2, v=0
  547960.0362  0.0185 -4.3690 3 1148.7709161  71510 303804040      803941        syn-C2H3C(O)NH2, v=0
  547960.0362  0.0185 -4.3690 3 1148.7709161  71510 303804041      803942        syn-C2H3C(O)NH2, v=0
  547999.2707  0.0041 -4.7001 3  376.7851103  71510 303511734      511437        syn-C2H3C(O)NH2, v=0
  548010.6940  0.0569 -4.7814 3 1229.0636207  71510 303A3 895      A3 796        syn-C2H3C(O)NH2, v=0
  548010.6940  0.0569 -4.7814 3 1229.0636207  71510 303A3 995      A3 896        syn-C2H3C(O)NH2, v=0
  548081.3310  0.0075 -5.7601 3  873.4808149  71510 303743044      733043        syn-C2H3C(O)NH2, v=0
  548081.3310  0.0075 -5.7601 3  873.4808149  71510 303743045      733044        syn-C2H3C(O)NH2, v=0
  548152.5334  0.0091 -3.4722 3  782.9715159  71510 303791168      781267        syn-C2H3C(O)NH2, v=0
  548152.5344  0.0091 -5.4874 3  782.9715159  71510 303791268      781267        syn-C2H3C(O)NH2, v=0
  548152.5352  0.0091 -5.4874 3  782.9715159  71510 303791168      781167        syn-C2H3C(O)NH2, v=0
  548152.5362  0.0091 -3.4722 3  782.9715159  71510 303791268      781167        syn-C2H3C(O)NH2, v=0
  548177.3065  0.0728 -5.1020 3 1467.2952221  71510 303B01298      B01199        syn-C2H3C(O)NH2, v=0
  548177.3065  0.0728 -5.1020 3 1467.2952221  71510 303B01398      B01299        syn-C2H3C(O)NH2, v=0
  548323.7205  0.0040 -4.9587 3  251.6232 89  71510 303441035      44 738        syn-C2H3C(O)NH2, v=0
  548341.7569  0.0060 -5.4472 3  736.7766145  71510 303722151      712150        syn-C2H3C(O)NH2, v=0
  548397.3163  0.0415 -5.2223 3 1636.7846203  71510 303A14160      A14061        syn-C2H3C(O)NH2, v=0
  548397.3163  0.0415 -5.2223 3 1636.7846203  71510 303A14161      A14062        syn-C2H3C(O)NH2, v=0
  548445.4691  0.0180 -4.3372 3 1129.1620159  71510 303794039      793940        syn-C2H3C(O)NH2, v=0
  548445.4691  0.0180 -4.3372 3 1129.1620159  71510 303794040      793941        syn-C2H3C(O)NH2, v=0
  548461.0594  0.0059 -4.9219 3   98.0449 57  71510 30328 820      27 523        syn-C2H3C(O)NH2, v=0
  548503.1576  0.0046 -5.3206 3  675.9330141  71510 303701753      691752        syn-C2H3C(O)NH2, v=0
  548516.4721  0.0085 -3.4959 3  776.3645157  71510 303781266      771365        syn-C2H3C(O)NH2, v=0
  548516.4991  0.0085 -5.4802 3  776.3645157  71510 303781366      771365        syn-C2H3C(O)NH2, v=0
  548516.5216  0.0085 -5.4802 3  776.3645157  71510 303781266      771265        syn-C2H3C(O)NH2, v=0
  548516.5486  0.0085 -3.4959 3  776.3645157  71510 303781366      771265        syn-C2H3C(O)NH2, v=0
  548571.5191  0.0762 -5.9582 3 2030.3896231  71510 303B54273      B54174        syn-C2H3C(O)NH2, v=0
  548571.5191  0.0762 -5.9582 3 2030.3896231  71510 303B54274      B54175        syn-C2H3C(O)NH2, v=0
  548617.8803  0.0044 -5.0904 3  224.8370 85  71510 30342 834      42 537        syn-C2H3C(O)NH2, v=0
  548691.4651  0.0058 -5.4052 3  724.2444147  71510 303731657      721656        syn-C2H3C(O)NH2, v=0
  548706.6253  0.0043 -4.5653 3  109.4271 65  71510 30332 329      31 230        syn-C2H3C(O)NH2, v=0
  548707.6243  0.0043 -4.5653 3  109.4271 65  71510 30332 429      31 130        syn-C2H3C(O)NH2, v=0
  548854.7116  0.0585 -4.6602 3  968.1319191  71510 30395 392      95 293        syn-C2H3C(O)NH2, v=0
  548854.7116  0.0585 -4.6602 3  968.1319191  71510 30395 492      95 393        syn-C2H3C(O)NH2, v=0
  548913.4318  0.0175 -4.3061 3 1109.8040157  71510 303784038      783939        syn-C2H3C(O)NH2, v=0
  548913.4318  0.0175 -4.3061 3 1109.8040157  71510 303784039      783940        syn-C2H3C(O)NH2, v=0
  548965.1867  0.0053 -3.6373 3  706.1085145  71510 303721756      711655        syn-C2H3C(O)NH2, v=0
  548975.8264  0.0034 -5.3390 3  189.2723 75  71510 303371225      37 730        syn-C2H3C(O)NH2, v=0
  548998.8755  0.0074 -5.7252 3  860.0885149  71510 303742946      732945        syn-C2H3C(O)NH2, v=0
  548998.8756  0.0074 -5.7252 3  860.0885149  71510 303742945      732944        syn-C2H3C(O)NH2, v=0
  549053.3664  0.0080 -3.5233 3  769.0914155  71510 303771364      761463        syn-C2H3C(O)NH2, v=0
  549053.9949  0.0080 -5.4714 3  769.0914155  71510 303771464      761463        syn-C2H3C(O)NH2, v=0
  549054.4865  0.0080 -5.4714 3  769.0914155  71510 303771364      761363        syn-C2H3C(O)NH2, v=0
  549055.1151  0.0080 -3.5233 3  769.0914155  71510 303771464      761363        syn-C2H3C(O)NH2, v=0
  549184.3975  0.0119 -4.7912 3  736.7485145  71510 303722151      721854        syn-C2H3C(O)NH2, v=0
  549248.1112  0.0038 -5.9160 3  137.4916 63  71510 303311219      31 724        syn-C2H3C(O)NH2, v=0
  549313.5007  0.0803 -5.2076 3 1535.5550225  71510 303B21399      B212A0        syn-C2H3C(O)NH2, v=0
  549313.5007  0.0803 -5.2076 3 1535.5550225  71510 303B21499      B213A0        syn-C2H3C(O)NH2, v=0
  549324.1674  0.0399 -5.1759 3 1611.8736201  71510 303A04159      A04060        syn-C2H3C(O)NH2, v=0
  549324.1674  0.0399 -5.1759 3 1611.8736201  71510 303A04160      A04061        syn-C2H3C(O)NH2, v=0
  549364.4323  0.0171 -4.2759 3 1090.6968155  71510 303774037      773938        syn-C2H3C(O)NH2, v=0
  549364.4323  0.0171 -4.2759 3 1090.6968155  71510 303774038      773939        syn-C2H3C(O)NH2, v=0
  549381.4695  0.0047 -5.2501 3  199.3043 81  71510 30340 733      40 436        syn-C2H3C(O)NH2, v=0
  549433.0136  0.0646 -4.9377 3  873.3777185  71510 30392 191      92 092        syn-C2H3C(O)NH2, v=0
  549433.0136  0.0646 -4.9377 3  873.3777185  71510 30392 291      92 192        syn-C2H3C(O)NH2, v=0
  549493.6793  0.0046 -3.4864 3  497.5038121  71510 303601645      591544        syn-C2H3C(O)NH2, v=0
  549500.4878  0.0055 -5.9183 3   61.4752 47  71510 30323 717      22 220        syn-C2H3C(O)NH2, v=0
  549578.1981  0.0058 -5.4247 3  728.6373145  71510 303722053      712052        syn-C2H3C(O)NH2, v=0
  549710.5495  0.0022 -5.1279 3  180.4868 69  71510 303341519      341222        syn-C2H3C(O)NH2, v=0
  549777.7871  0.0047 -5.2496 3  199.3043 81  71510 30340 833      40 536        syn-C2H3C(O)NH2, v=0
  549798.9641  0.0167 -4.2464 3 1071.8401153  71510 303764036      763937        syn-C2H3C(O)NH2, v=0
  549798.9641  0.0167 -4.2464 3 1071.8401153  71510 303764037      763938        syn-C2H3C(O)NH2, v=0
  549805.5825  0.0606 -4.8607 3 1292.9029211  71510 303A5 996      A5 897        syn-C2H3C(O)NH2, v=0
  549805.5825  0.0606 -4.8607 3 1292.9029211  71510 303A51096      A5 997        syn-C2H3C(O)NH2, v=0
  549810.7599  0.0022 -3.2546 3  332.2877 99  71510 303491435      481336        syn-C2H3C(O)NH2, v=0
  549845.4222  0.0074 -3.5561 3  761.1013153  71510 303761462      751561        syn-C2H3C(O)NH2, v=0
  549857.3933  0.0074 -5.4606 3  761.1013153  71510 303761562      751561        syn-C2H3C(O)NH2, v=0
  549866.0548  0.0074 -5.4605 3  761.1007153  71510 303761462      751461        syn-C2H3C(O)NH2, v=0
  549878.0259  0.0074 -3.5560 3  761.1007153  71510 303761562      751461        syn-C2H3C(O)NH2, v=0
  549887.9892  0.0043 -5.0888 3  224.8370 85  71510 30342 934      42 637        syn-C2H3C(O)NH2, v=0
  549900.4306  0.0022 -5.1277 3  180.4805 69  71510 303341520      341223        syn-C2H3C(O)NH2, v=0
  549913.4300  0.0731 -5.9028 3 2001.8992229  71510 303B44272      B44173        syn-C2H3C(O)NH2, v=0
  549913.4300  0.0731 -5.9028 3 2001.8992229  71510 303B44273      B44174        syn-C2H3C(O)NH2, v=0
  549925.5563  0.0023 -5.3460 3   66.6758 43  71510 303211111      20 812        syn-C2H3C(O)NH2, v=0
  549985.2655  0.0561 -4.6889 3 1126.4704201  71510 303A0 694      A0 595        syn-C2H3C(O)NH2, v=0
  549985.2655  0.0561 -4.6889 3 1126.4704201  71510 303A0 794      A0 695        syn-C2H3C(O)NH2, v=0
  550027.9236  0.0064 -5.5210 3  773.0191147  71510 303732351      722350        syn-C2H3C(O)NH2, v=0
  550032.1317  0.0073 -5.6915 3  847.2253149  71510 303742847      732846        syn-C2H3C(O)NH2, v=0
  550032.1324  0.0073 -5.6915 3  847.2253149  71510 303742846      732845        syn-C2H3C(O)NH2, v=0
  550076.9588  0.0064 -5.5209 3  773.0212147  71510 303732350      722349        syn-C2H3C(O)NH2, v=0
  550092.3192  0.0023 -5.3459 3   66.6703 43  71510 303211110      20 813        syn-C2H3C(O)NH2, v=0
  550092.3653  0.0056 -5.4054 3  721.1459145  71510 303721954      711953        syn-C2H3C(O)NH2, v=0
  550137.6063  0.0026 -4.7147 3  308.2071 93  71510 303461631      461334        syn-C2H3C(O)NH2, v=0
  550217.5074  0.0164 -4.2178 3 1053.2338151  71510 303754035      753936        syn-C2H3C(O)NH2, v=0
  550217.5074  0.0164 -4.2178 3 1053.2338151  71510 303754036      753937        syn-C2H3C(O)NH2, v=0
  550221.1581  0.0384 -5.1303 3 1587.2188199  71510 303994158      994059        syn-C2H3C(O)NH2, v=0
  550221.1581  0.0384 -5.1303 3 1587.2188199  71510 303994159      994060        syn-C2H3C(O)NH2, v=0
  550231.9116  0.0013 -2.9216 3  292.8907 89  71510 303441728      431627        syn-C2H3C(O)NH2, v=0
  550238.2432  0.0013 -2.9216 3  292.8905 89  71510 303441727      431628        syn-C2H3C(O)NH2, v=0
  550275.3693  0.0889 -5.3187 3 1605.0572229  71510 303B414A0      B413A1        syn-C2H3C(O)NH2, v=0
  550275.3693  0.0889 -5.3187 3 1605.0572229  71510 303B415A0      B414A1        syn-C2H3C(O)NH2, v=0
  550347.5237  0.0019 -2.5871 3  226.6654 53  71510 3032626 0      2525 1        syn-C2H3C(O)NH2, v=0
  550347.5237  0.0019 -2.5871 3  226.6654 53  71510 3032626 1      2525 0        syn-C2H3C(O)NH2, v=0
  550492.7795  0.0065 -3.6615 3  742.6602149  71510 303741658      731757        syn-C2H3C(O)NH2, v=0
  550620.5290  0.0161 -4.1899 3 1034.8775149  71510 303744034      743935        syn-C2H3C(O)NH2, v=0
  550620.5290  0.0161 -4.1899 3 1034.8775149  71510 303744035      743936        syn-C2H3C(O)NH2, v=0
  550784.2666  0.0017 -2.6096 3  228.0054 57  71510 3032825 3      2724 4        syn-C2H3C(O)NH2, v=0
  550784.2666  0.0017 -2.6096 3  228.0054 57  71510 3032825 4      2724 3        syn-C2H3C(O)NH2, v=0
  550880.1675  0.0069 -3.5982 3  752.3211151  71510 303751560      741659        syn-C2H3C(O)NH2, v=0
  551008.4834  0.0158 -4.1630 3 1016.7712147  71510 303734033      733934        syn-C2H3C(O)NH2, v=0
  551008.4834  0.0158 -4.1630 3 1016.7712147  71510 303734034      733935        syn-C2H3C(O)NH2, v=0
  551047.9792  0.0362 -4.9539 3  943.6105165  71510 303822260      821963        syn-C2H3C(O)NH2, v=0
  551057.3982  0.0989 -5.4348 3 1675.7963233  71510 303B615A1      B614A2        syn-C2H3C(O)NH2, v=0
  551057.3982  0.0989 -5.4348 3 1675.7963233  71510 303B616A1      B615A2        syn-C2H3C(O)NH2, v=0
  551063.2476  0.0069 -5.4473 3  752.3211151  71510 303751660      741659        syn-C2H3C(O)NH2, v=0
  551089.2040  0.0370 -5.0852 3 1562.8199197  71510 303984157      984058        syn-C2H3C(O)NH2, v=0
  551089.2040  0.0370 -5.0852 3 1562.8199197  71510 303984158      984059        syn-C2H3C(O)NH2, v=0
  551139.5530  0.1346 -4.9946 3 1210.2004187  71510 303932469      922568        syn-C2H3C(O)NH2, v=0
  551183.2041  0.0069 -5.4471 3  752.3110151  71510 303751560      741559        syn-C2H3C(O)NH2, v=0
  551206.9657  0.0159 -4.7804 3  680.6626141  71510 303701852      701555        syn-C2H3C(O)NH2, v=0
  551207.0021  0.0072 -5.6589 3  834.9021149  71510 303742748      732747        syn-C2H3C(O)NH2, v=0
  551207.0117  0.0072 -5.6589 3  834.9021149  71510 303742747      732746        syn-C2H3C(O)NH2, v=0
  551207.3827  0.0016 -2.6341 3  230.8132 61  71510 3033024 6      2923 7        syn-C2H3C(O)NH2, v=0
  551207.3827  0.0016 -2.6341 3  230.8132 61  71510 3033024 7      2923 6        syn-C2H3C(O)NH2, v=0
  551212.8696  0.0702 -5.8481 3 1973.6692227  71510 303B34271      B34172        syn-C2H3C(O)NH2, v=0
  551212.8697  0.0702 -5.8481 3 1973.6692227  71510 303B34272      B34173        syn-C2H3C(O)NH2, v=0
  551313.2033  0.0358 -4.2831 3  910.8442163  71510 303812061      802160        syn-C2H3C(O)NH2, v=0
  551366.2842  0.0069 -3.5974 3  752.3110151  71510 303751660      741559        syn-C2H3C(O)NH2, v=0
  551372.4034  0.0035 -3.8432 3  161.8079 73  71510 30336 729      35 630        syn-C2H3C(O)NH2, v=0
  551372.7528  0.0583 -4.6542 3 1026.7838195  71510 30397 493      97 394        syn-C2H3C(O)NH2, v=0
  551372.7528  0.0583 -4.6542 3 1026.7838195  71510 30397 593      97 494        syn-C2H3C(O)NH2, v=0
  551376.8830  0.0134 -3.9318 3  795.9718153  71510 303761858      751957        syn-C2H3C(O)NH2, v=0
  551381.8132  0.0155 -4.1368 3  998.9144145  71510 303724032      723933        syn-C2H3C(O)NH2, v=0
  551381.8132  0.0155 -4.1368 3  998.9144145  71510 303724033      723934        syn-C2H3C(O)NH2, v=0
  551403.8801  0.0050 -3.6194 3  635.0629137  71510 303681752      671651        syn-C2H3C(O)NH2, v=0
  551446.0090  0.0652 -4.9482 3 1358.0056215  71510 303A71097      A7 998        syn-C2H3C(O)NH2, v=0
  551446.0090  0.0652 -4.9482 3 1358.0056215  71510 303A71197      A71098        syn-C2H3C(O)NH2, v=0
  551563.5103  0.0012 -2.8595 3  279.2643 85  71510 303421825      411724        syn-C2H3C(O)NH2, v=0
  551563.5976  0.0012 -2.8595 3  279.2643 85  71510 303421824      411725        syn-C2H3C(O)NH2, v=0
  551602.0933  0.0014 -2.6612 3  235.0974 65  71510 3033223 9      312210        syn-C2H3C(O)NH2, v=0
  551602.0933  0.0014 -2.6612 3  235.0974 65  71510 303322310      3122 9        syn-C2H3C(O)NH2, v=0
  551653.5588  0.1102 -5.5556 3 1747.7668237  71510 303B816A2      B815A3        syn-C2H3C(O)NH2, v=0
  551653.5588  0.1102 -5.5556 3 1747.7668237  71510 303B817A2      B816A3        syn-C2H3C(O)NH2, v=0
  551740.9491  0.0153 -4.1116 3  981.3071143  71510 303714031      713932        syn-C2H3C(O)NH2, v=0
  551740.9491  0.0153 -4.1116 3  981.3071143  71510 303714032      713933        syn-C2H3C(O)NH2, v=0
  551929.1844  0.0356 -5.0409 3 1538.6765195  71510 303974156      974057        syn-C2H3C(O)NH2, v=0
  551929.1844  0.0356 -5.0409 3 1538.6765195  71510 303974157      974058        syn-C2H3C(O)NH2, v=0
  551944.5857  0.0013 -2.6913 3  240.8697 69  71510 303342212      332113        syn-C2H3C(O)NH2, v=0
  551944.5857  0.0013 -2.6913 3  240.8697 69  71510 303342213      332112        syn-C2H3C(O)NH2, v=0
  552022.3060  0.0015 -3.1369 3  337.7635 99  71510 303491534      481435        syn-C2H3C(O)NH2, v=0
  552057.2428  0.1232 -5.6809 3 1820.9633241  71510 303C017A3      C016A4        syn-C2H3C(O)NH2, v=0
  552057.2428  0.1232 -5.6809 3 1820.9633241  71510 303C018A3      C017A4        syn-C2H3C(O)NH2, v=0
  552082.9018  0.0581 -4.7480 3 1188.3697205  71510 303A2 795      A2 696        syn-C2H3C(O)NH2, v=0
  552082.9018  0.0581 -4.7480 3 1188.3697205  71510 303A2 895      A2 796        syn-C2H3C(O)NH2, v=0
  552086.3112  0.0151 -4.0873 3  963.9491141  71510 303704030      703931        syn-C2H3C(O)NH2, v=0
  552086.3112  0.0151 -4.0873 3  963.9491141  71510 303704031      703932        syn-C2H3C(O)NH2, v=0
  552091.0562  0.0057 -3.6441 3  724.2444147  71510 303731757      721656        syn-C2H3C(O)NH2, v=0
  552143.9432  0.0012 -2.8078 3  267.3059 81  71510 303401922      391821        syn-C2H3C(O)NH2, v=0
  552143.9439  0.0012 -2.8078 3  267.3059 81  71510 303401921      391822        syn-C2H3C(O)NH2, v=0
  552196.7218  0.0013 -2.7252 3  248.1460 73  71510 303362115      352016        syn-C2H3C(O)NH2, v=0
  552196.7218  0.0013 -2.7252 3  248.1460 73  71510 303362116      352015        syn-C2H3C(O)NH2, v=0
  552213.4466  0.0633 -4.7511 3  930.0417189  71510 30394 292      94 193        syn-C2H3C(O)NH2, v=0
  552213.4466  0.0633 -4.7511 3  930.0417189  71510 30394 392      94 293        syn-C2H3C(O)NH2, v=0
  552238.0112  0.0094 -5.9698 3  966.2887151  71510 303753540      743539        syn-C2H3C(O)NH2, v=0
  552238.0112  0.0094 -5.9698 3  966.2887151  71510 303753541      743540        syn-C2H3C(O)NH2, v=0
  552256.3544  0.0039 -4.2908 3  122.1323 67  71510 30333 429      32 330        syn-C2H3C(O)NH2, v=0
  552257.3837  0.1545 -5.9442 3 1971.0109249  71510 303C419A5      C418A6        syn-C2H3C(O)NH2, v=0
  552257.3837  0.1545 -5.9442 3 1971.0109249  71510 303C420A5      C419A6        syn-C2H3C(O)NH2, v=0
  552261.1871  0.1379 -5.8104 3 1895.3799245  71510 303C218A4      C217A5        syn-C2H3C(O)NH2, v=0
  552261.1871  0.1379 -5.8104 3 1895.3799245  71510 303C219A4      C218A5        syn-C2H3C(O)NH2, v=0
  552267.0816  0.0039 -4.2908 3  122.1323 67  71510 30333 529      32 230        syn-C2H3C(O)NH2, v=0
  552296.9775  0.0012 -2.7636 3  256.9479 77  71510 303382018      371919        syn-C2H3C(O)NH2, v=0
  552296.9775  0.0012 -2.7636 3  256.9479 77  71510 303382019      371918        syn-C2H3C(O)NH2, v=0
  552418.3088  0.0149 -4.0639 3  946.8401139  71510 303694029      693930        syn-C2H3C(O)NH2, v=0
  552418.3088  0.0149 -4.0639 3  946.8401139  71510 303694030      693931        syn-C2H3C(O)NH2, v=0
  552471.3102  0.0675 -5.7940 3 1945.6993225  71510 303B24270      B24171        syn-C2H3C(O)NH2, v=0
  552471.3102  0.0675 -5.7940 3 1945.6993225  71510 303B24271      B24172        syn-C2H3C(O)NH2, v=0
  552558.7112  0.0071 -5.6275 3  823.1330149  71510 303742649      732648        syn-C2H3C(O)NH2, v=0
  552558.8229  0.0071 -5.6275 3  823.1330149  71510 303742648      732647        syn-C2H3C(O)NH2, v=0
  552602.4980  0.0064 -5.4934 3  763.6371147  71510 303732252      722251        syn-C2H3C(O)NH2, v=0
  552636.4002  0.0022 -5.1892 3  171.9967 67  71510 303331518      331221        syn-C2H3C(O)NH2, v=0
  552660.1819  0.0064 -5.4315 3  742.6602149  71510 303741758      731757        syn-C2H3C(O)NH2, v=0
  552732.3044  0.0022 -5.1890 3  171.9935 67  71510 303331519      331222        syn-C2H3C(O)NH2, v=0
  552737.3409  0.0147 -4.0414 3  929.9799137  71510 303684028      683929        syn-C2H3C(O)NH2, v=0
  552737.3409  0.0147 -4.0414 3  929.9799137  71510 303684029      683930        syn-C2H3C(O)NH2, v=0
  552741.9447  0.0343 -4.9972 3 1514.7883193  71510 303964155      964056        syn-C2H3C(O)NH2, v=0
  552741.9447  0.0343 -4.9972 3 1514.7883193  71510 303964156      964057        syn-C2H3C(O)NH2, v=0
  552823.7577  0.0091 -5.9290 3  950.3741151  71510 303753441      743440        syn-C2H3C(O)NH2, v=0
  552823.7577  0.0091 -5.9290 3  950.3741151  71510 303753442      743441        syn-C2H3C(O)NH2, v=0
  552853.1108  0.0027 -4.7860 3  285.4072 89  71510 303441628      441331        syn-C2H3C(O)NH2, v=0
  552916.8360  0.0041 -4.6045 3  437.9034113  71510 303561641      561344        syn-C2H3C(O)NH2, v=0
  552928.1536  0.0708 -5.0429 3 1424.3664219  71510 303A91198      A91099        syn-C2H3C(O)NH2, v=0
  552928.1536  0.0708 -5.0429 3 1424.3664219  71510 303A91298      A91199        syn-C2H3C(O)NH2, v=0
  552949.5471  0.0065 -5.4929 3  763.6537147  71510 303732251      722250        syn-C2H3C(O)NH2, v=0
  553043.7966  0.0146 -4.0200 3  913.3683135  71510 303674027      673928        syn-C2H3C(O)NH2, v=0
  553043.7966  0.0146 -4.0200 3  913.3683135  71510 303674028      673929        syn-C2H3C(O)NH2, v=0
  553050.8480  0.0050 -5.3464 3  694.2291143  71510 303711754      701753        syn-C2H3C(O)NH2, v=0
  553294.1672  0.0169 -4.8705 3  840.3527155  71510 303772255      771958        syn-C2H3C(O)NH2, v=0
  553338.0558  0.0144 -3.9996 3  897.0052133  71510 303664026      663927        syn-C2H3C(O)NH2, v=0
  553338.0558  0.0144 -3.9996 3  897.0052133  71510 303664027      663928        syn-C2H3C(O)NH2, v=0
  553417.4523  0.0052 -5.3222 3  680.5888141  71510 303701852      691851        syn-C2H3C(O)NH2, v=0
  553428.1984  0.0060 -5.4152 3  732.1262147  71510 303731856      721855        syn-C2H3C(O)NH2, v=0
  553463.0895  0.0089 -5.8895 3  934.9594151  71510 303753342      743341        syn-C2H3C(O)NH2, v=0
  553463.0895  0.0089 -5.8895 3  934.9594151  71510 303753343      743342        syn-C2H3C(O)NH2, v=0
  553471.2853  0.0027 -4.0273 3  165.8181 71  71510 303351125      34 826        syn-C2H3C(O)NH2, v=0
  553486.2701  0.0014 -3.0201 3  319.8504 95  71510 303471632      461531        syn-C2H3C(O)NH2, v=0
  553491.1008  0.0029 -3.7553 3  175.4687 75  71510 30337 929      36 630        syn-C2H3C(O)NH2, v=0
  553528.2979  0.0331 -4.9543 3 1491.1551191  71510 303954154      954055        syn-C2H3C(O)NH2, v=0
  553528.2979  0.0331 -4.9543 3 1491.1551191  71510 303954155      954056        syn-C2H3C(O)NH2, v=0
  553536.1291  0.0142 -5.5242 3  831.0207175  71510 30387 483      86 482        syn-C2H3C(O)NH2, v=0
  553536.1291  0.0142 -3.3692 3  831.0207175  71510 30387 483      86 582        syn-C2H3C(O)NH2, v=0
  553536.1291  0.0142 -3.3692 3  831.0207175  71510 30387 583      86 482        syn-C2H3C(O)NH2, v=0
  553536.1291  0.0142 -5.5242 3  831.0207175  71510 30387 583      86 582        syn-C2H3C(O)NH2, v=0
  553538.4917  0.0134 -5.5257 3  828.4181173  71510 30386 581      85 580        syn-C2H3C(O)NH2, v=0
  553538.4917  0.0134 -3.3852 3  828.4181173  71510 30386 581      85 680        syn-C2H3C(O)NH2, v=0
  553538.4917  0.0134 -3.3852 3  828.4181173  71510 30386 681      85 580        syn-C2H3C(O)NH2, v=0
  553538.4917  0.0134 -5.5257 3  828.4181173  71510 30386 681      85 680        syn-C2H3C(O)NH2, v=0
  553542.1828  0.0152 -5.5217 3  833.0991177  71510 30388 385      87 384        syn-C2H3C(O)NH2, v=0
  553542.1828  0.0152 -3.3533 3  833.0991177  71510 30388 385      87 484        syn-C2H3C(O)NH2, v=0
  553542.1828  0.0152 -3.3533 3  833.0991177  71510 30388 485      87 384        syn-C2H3C(O)NH2, v=0
  553542.1828  0.0152 -5.5217 3  833.0991177  71510 30388 485      87 484        syn-C2H3C(O)NH2, v=0
  553552.9223  0.0167 -5.5181 3  834.6594179  71510 30389 287      88 286        syn-C2H3C(O)NH2, v=0
  553552.9223  0.0167 -3.3372 3  834.6594179  71510 30389 287      88 386        syn-C2H3C(O)NH2, v=0
  553552.9223  0.0167 -3.3372 3  834.6594179  71510 30389 387      88 286        syn-C2H3C(O)NH2, v=0
  553552.9223  0.0167 -5.5181 3  834.6594179  71510 30389 387      88 386        syn-C2H3C(O)NH2, v=0
  553554.0859  0.0128 -5.5261 3  825.2838171  71510 30385 679      84 678        syn-C2H3C(O)NH2, v=0
  553554.0859  0.0128 -3.4013 3  825.2838171  71510 30385 679      84 778        syn-C2H3C(O)NH2, v=0
  553554.0859  0.0128 -3.4013 3  825.2838171  71510 30385 779      84 678        syn-C2H3C(O)NH2, v=0
  553554.0859  0.0128 -5.5261 3  825.2838171  71510 30385 779      84 778        syn-C2H3C(O)NH2, v=0
  553565.4235  0.0189 -5.5136 3  835.7069181  71510 30390 189      89 188        syn-C2H3C(O)NH2, v=0
  553565.4235  0.0189 -3.3211 3  835.7069181  71510 30390 189      89 288        syn-C2H3C(O)NH2, v=0
  553565.4235  0.0189 -3.3211 3  835.7069181  71510 30390 289      89 188        syn-C2H3C(O)NH2, v=0
  553565.4235  0.0189 -5.5136 3  835.7069181  71510 30390 289      89 288        syn-C2H3C(O)NH2, v=0
  553577.3708  0.0218 -5.5080 3  836.2460183  71510 30391 091      90 090        syn-C2H3C(O)NH2, v=0
  553577.3708  0.0218 -3.3046 3  836.2460183  71510 30391 091      90 190        syn-C2H3C(O)NH2, v=0
  553577.3708  0.0218 -3.3046 3  836.2460183  71510 30391 191      90 090        syn-C2H3C(O)NH2, v=0
  553577.3708  0.0218 -5.5080 3  836.2460183  71510 30391 191      90 190        syn-C2H3C(O)NH2, v=0
  553589.2122  0.0123 -5.5254 3  821.6092169  71510 30384 777      83 776        syn-C2H3C(O)NH2, v=0
  553589.2122  0.0123 -3.4177 3  821.6092169  71510 30384 777      83 876        syn-C2H3C(O)NH2, v=0
  553589.2122  0.0123 -3.4177 3  821.6092169  71510 30384 877      83 776        syn-C2H3C(O)NH2, v=0
  553589.2122  0.0123 -5.5254 3  821.6092169  71510 30384 877      83 876        syn-C2H3C(O)NH2, v=0
  553620.4890  0.0143 -3.9802 3  880.8903131  71510 303654025      653926        syn-C2H3C(O)NH2, v=0
  553620.4890  0.0143 -3.9802 3  880.8903131  71510 303654026      653927        syn-C2H3C(O)NH2, v=0
  553652.2445  0.0117 -5.5236 3  817.3836167  71510 30383 875      82 874        syn-C2H3C(O)NH2, v=0
  553652.2445  0.0117 -3.4347 3  817.3836167  71510 30383 875      82 974        syn-C2H3C(O)NH2, v=0
  553652.2445  0.0117 -3.4347 3  817.3836167  71510 30383 975      82 874        syn-C2H3C(O)NH2, v=0
  553652.2445  0.0117 -5.5236 3  817.3836167  71510 30383 975      82 974        syn-C2H3C(O)NH2, v=0
  553690.1496  0.0648 -5.7407 3 1917.9891223  71510 303B14269      B14170        syn-C2H3C(O)NH2, v=0
  553690.1496  0.0648 -5.7407 3 1917.9891223  71510 303B14270      B14171        syn-C2H3C(O)NH2, v=0
  553754.4985  0.0588 -4.6790 3 1086.7236199  71510 30399 594      99 495        syn-C2H3C(O)NH2, v=0
  553754.4985  0.0588 -4.6790 3 1086.7236199  71510 30399 694      99 595        syn-C2H3C(O)NH2, v=0
  553754.5253  0.0112 -5.5205 3  812.5942165  71510 30382 973      81 972        syn-C2H3C(O)NH2, v=0
  553754.5253  0.0112 -3.4524 3  812.5942165  71510 30382 973      811072        syn-C2H3C(O)NH2, v=0
  553754.5253  0.0112 -3.4524 3  812.5942165  71510 303821073      81 972        syn-C2H3C(O)NH2, v=0
  553754.5253  0.0112 -5.5205 3  812.5942165  71510 303821073      811072        syn-C2H3C(O)NH2, v=0
  553762.1296  0.0022 -3.9271 3  174.8782 73  71510 303361126      35 827        syn-C2H3C(O)NH2, v=0
  553860.8515  0.0216 -5.0018 3  993.9031169  71510 303842361      842064        syn-C2H3C(O)NH2, v=0
  553891.4578  0.0142 -3.9619 3  865.0235129  71510 303644024      643925        syn-C2H3C(O)NH2, v=0
  553891.4578  0.0142 -3.9619 3  865.0235129  71510 303644025      643926        syn-C2H3C(O)NH2, v=0
  553892.3706  0.0064 -5.4293 3  742.5468149  71510 303741658      731657        syn-C2H3C(O)NH2, v=0
  553911.7775  0.0106 -5.5162 3  807.2250163  71510 303811071      801070        syn-C2H3C(O)NH2, v=0
  553911.7775  0.0106 -3.4713 3  807.2250163  71510 303811071      801170        syn-C2H3C(O)NH2, v=0
  553911.7775  0.0106 -5.5162 3  807.2250163  71510 303811171      801170        syn-C2H3C(O)NH2, v=0
  553911.7776  0.0106 -3.4713 3  807.2250163  71510 303811171      801070        syn-C2H3C(O)NH2, v=0
  553990.5663  0.0014 -3.0194 3  319.8363 95  71510 303471631      461532        syn-C2H3C(O)NH2, v=0
  554034.5685  0.0610 -4.8189 3 1251.5423209  71510 303A4 896      A4 797        syn-C2H3C(O)NH2, v=0
  554034.5685  0.0610 -4.8189 3 1251.5423209  71510 303A4 996      A4 897        syn-C2H3C(O)NH2, v=0
  554136.8605  0.0071 -5.5971 3  811.9361149  71510 303742550      732549        syn-C2H3C(O)NH2, v=0
  554138.0212  0.0071 -5.5971 3  811.9362149  71510 303742549      732548        syn-C2H3C(O)NH2, v=0
  554146.4342  0.0100 -3.4918 3  801.2559161  71510 303801169      791268        syn-C2H3C(O)NH2, v=0
  554146.4347  0.0100 -5.5105 3  801.2559161  71510 303801269      791268        syn-C2H3C(O)NH2, v=0
  554146.4352  0.0100 -5.5105 3  801.2559161  71510 303801169      791168        syn-C2H3C(O)NH2, v=0
  554146.4357  0.0100 -3.4918 3  801.2559161  71510 303801269      791168        syn-C2H3C(O)NH2, v=0
  554151.3154  0.0142 -3.9448 3  849.4046127  71510 303634023      633924        syn-C2H3C(O)NH2, v=0
  554151.3154  0.0142 -3.9448 3  849.4046127  71510 303634024      633925        syn-C2H3C(O)NH2, v=0
  554164.4942  0.0087 -5.8512 3  920.0489151  71510 303753243      743242        syn-C2H3C(O)NH2, v=0
  554164.4942  0.0087 -5.8512 3  920.0489151  71510 303753244      743243        syn-C2H3C(O)NH2, v=0
  554200.9230  0.1038 -4.8138 3 1131.4154181  71510 303902367      892466        syn-C2H3C(O)NH2, v=0
  554247.8793  0.0774 -5.1440 3 1491.9802223  71510 303B11299      B111A0        syn-C2H3C(O)NH2, v=0
  554247.8793  0.0774 -5.1440 3 1491.9802223  71510 303B11399      B112A0        syn-C2H3C(O)NH2, v=0
  554286.3600  0.0170 -4.9823 3  972.2164167  71510 303832360      832063        syn-C2H3C(O)NH2, v=0
  554289.0270  0.0319 -4.9120 3 1467.7764189  71510 303944153      944054        syn-C2H3C(O)NH2, v=0
  554289.0270  0.0319 -4.9120 3 1467.7764189  71510 303944154      944055        syn-C2H3C(O)NH2, v=0
  554400.4065  0.0142 -3.9289 3  834.0333125  71510 303624022      623923        syn-C2H3C(O)NH2, v=0
  554400.4065  0.0142 -3.9289 3  834.0333125  71510 303624023      623924        syn-C2H3C(O)NH2, v=0
  554425.1441  0.0037 -4.0974 3  135.1103 69  71510 30334 529      33 430        syn-C2H3C(O)NH2, v=0
  554451.2240  0.0032 -3.8400 3  161.8062 73  71510 30336 829      35 530        syn-C2H3C(O)NH2, v=0
  554491.7005  0.0094 -3.5146 3  794.6611159  71510 303791267      781366        syn-C2H3C(O)NH2, v=0
  554491.7152  0.0094 -5.5034 3  794.6611159  71510 303791367      781366        syn-C2H3C(O)NH2, v=0
  554491.7275  0.0094 -5.5034 3  794.6611159  71510 303791267      781266        syn-C2H3C(O)NH2, v=0
  554491.7422  0.0094 -3.5146 3  794.6611159  71510 303791367      781266        syn-C2H3C(O)NH2, v=0
  554514.1054  0.0037 -4.0973 3  135.1102 69  71510 30334 629      33 330        syn-C2H3C(O)NH2, v=0
  554631.9181  0.0035 -3.9527 3  148.3428 71  71510 30335 629      34 530        syn-C2H3C(O)NH2, v=0
  554639.0681  0.0141 -3.9143 3  818.9097123  71510 303614021      613922        syn-C2H3C(O)NH2, v=0
  554639.0681  0.0141 -3.9143 3  818.9097123  71510 303614022      613923        syn-C2H3C(O)NH2, v=0
  554685.6794  0.0057 -4.7707 3  364.1066105  71510 303521240      52 943        syn-C2H3C(O)NH2, v=0
  554863.3580  0.0625 -4.6924 3  988.0031193  71510 30396 393      96 294        syn-C2H3C(O)NH2, v=0
  554863.3580  0.0625 -4.6924 3  988.0031193  71510 30396 493      96 394        syn-C2H3C(O)NH2, v=0
  554867.6289  0.0141 -3.9011 3  804.0333121  71510 303604020      603921        syn-C2H3C(O)NH2, v=0
  554867.6289  0.0141 -3.9011 3  804.0333121  71510 303604021      603922        syn-C2H3C(O)NH2, v=0
  554870.7172  0.0623 -5.6879 3 1890.5380221  71510 303B04268      B04169        syn-C2H3C(O)NH2, v=0
  554870.7172  0.0623 -5.6879 3 1890.5380221  71510 303B04269      B04170        syn-C2H3C(O)NH2, v=0
  554913.3353  0.0537 -4.4555 3  981.7405169  71510 303842163      832262        syn-C2H3C(O)NH2, v=0
  554938.3795  0.0085 -5.8141 3  905.6479151  71510 303753144      743143        syn-C2H3C(O)NH2, v=0
  554938.3795  0.0085 -5.8141 3  905.6479151  71510 303753145      743144        syn-C2H3C(O)NH2, v=0
  554998.8626  0.0088 -3.5407 3  787.4059157  71510 303781365      771464        syn-C2H3C(O)NH2, v=0
  554999.2136  0.0088 -5.4945 3  787.4059157  71510 303781465      771464        syn-C2H3C(O)NH2, v=0
  554999.4911  0.0088 -5.4945 3  787.4059157  71510 303781365      771364        syn-C2H3C(O)NH2, v=0
  554999.8421  0.0088 -3.5407 3  787.4059157  71510 303781465      771364        syn-C2H3C(O)NH2, v=0
  555024.8864  0.0308 -4.8703 3 1444.6520187  71510 303934152      934053        syn-C2H3C(O)NH2, v=0
  555024.8864  0.0308 -4.8703 3 1444.6520187  71510 303934153      934054        syn-C2H3C(O)NH2, v=0
  555086.4106  0.0141 -3.8892 3  789.4042119  71510 303594019      593920        syn-C2H3C(O)NH2, v=0
  555086.4106  0.0141 -3.8892 3  789.4042119  71510 303594020      593921        syn-C2H3C(O)NH2, v=0
  555131.5084  0.0025 -4.7452 3  296.5528 91  71510 303451630      451333        syn-C2H3C(O)NH2, v=0
  555217.6966  0.0034 -3.9520 3  148.3426 71  71510 30335 729      34 430        syn-C2H3C(O)NH2, v=0
  555241.9544  0.0022 -5.2545 3  163.7727 65  71510 303321517      321220        syn-C2H3C(O)NH2, v=0
  555288.9519  0.0022 -5.2544 3  163.7711 65  71510 303321518      321221        syn-C2H3C(O)NH2, v=0
  555295.7270  0.0142 -3.8789 3  775.0220117  71510 303584018      583919        syn-C2H3C(O)NH2, v=0
  555295.7270  0.0142 -3.8789 3  775.0220117  71510 303584019      583920        syn-C2H3C(O)NH2, v=0
  555298.6984  0.0045 -4.6709 3  383.9274107  71510 303531440      531143        syn-C2H3C(O)NH2, v=0
  555339.2032  0.0031 -4.1360 3  156.9529 69  71510 303341124      33 825        syn-C2H3C(O)NH2, v=0
  555400.6980  0.0851 -5.2510 3 1560.8417227  71510 303B313A0      B312A1        syn-C2H3C(O)NH2, v=0
  555400.6980  0.0851 -5.2510 3 1560.8417227  71510 303B314A0      B313A1        syn-C2H3C(O)NH2, v=0
  555446.3554  0.0689 -4.9677 3  892.2451187  71510 30393 192      93 093        syn-C2H3C(O)NH2, v=0
  555446.3554  0.0689 -4.9677 3  892.2451187  71510 30393 292      93 193        syn-C2H3C(O)NH2, v=0
  555451.5135  0.0121 -4.7627 3  621.3691135  71510 303671750      671453        syn-C2H3C(O)NH2, v=0
  555475.1774  0.0065 -5.4670 3  754.9566147  71510 303732153      722152        syn-C2H3C(O)NH2, v=0
  555476.8812  0.0023 -5.2364 3   71.9015 45  71510 303221112      21 813        syn-C2H3C(O)NH2, v=0
  555495.8851  0.0142 -3.8702 3  760.8867115  71510 303574017      573918        syn-C2H3C(O)NH2, v=0
  555495.8851  0.0142 -3.8702 3  760.8867115  71510 303574018      573919        syn-C2H3C(O)NH2, v=0
  555500.2416  0.0066 -5.4159 3  729.0230145  71510 303722052      712051        syn-C2H3C(O)NH2, v=0
  555687.1848  0.0143 -3.8633 3  746.9982113  71510 303564016      563917        syn-C2H3C(O)NH2, v=0
  555687.1848  0.0143 -3.8633 3  746.9982113  71510 303564017      563918        syn-C2H3C(O)NH2, v=0
  555690.6341  0.0765 -4.6334 3 1055.2631175  71510 303872265      862364        syn-C2H3C(O)NH2, v=0
  555713.7638  0.0063 -5.3659 3  704.1723143  71510 303711952      701951        syn-C2H3C(O)NH2, v=0
  555736.6039  0.0298 -4.8294 3 1421.7816185  71510 303924151      924052        syn-C2H3C(O)NH2, v=0
  555736.6039  0.0298 -4.8294 3 1421.7816185  71510 303924152      924053        syn-C2H3C(O)NH2, v=0
  555746.2530  0.0082 -3.5718 3  779.4426155  71510 303771463      761562        syn-C2H3C(O)NH2, v=0
  555753.1577  0.0082 -5.4838 3  779.4426155  71510 303771563      761562        syn-C2H3C(O)NH2, v=0
  555758.2241  0.0082 -5.4838 3  779.4422155  71510 303771463      761462        syn-C2H3C(O)NH2, v=0
  555765.1287  0.0082 -3.5718 3  779.4422155  71510 303771563      761462        syn-C2H3C(O)NH2, v=0
  555797.6972  0.0083 -5.7782 3  891.7628151  71510 303753046      743045        syn-C2H3C(O)NH2, v=0
  555797.6973  0.0083 -5.7782 3  891.7628151  71510 303753045      743044        syn-C2H3C(O)NH2, v=0
  555832.1797  0.0023 -5.2361 3   71.8896 45  71510 303221111      21 814        syn-C2H3C(O)NH2, v=0
  555837.0866  0.0648 -4.8995 3 1315.9832213  71510 303A6 997      A6 898        syn-C2H3C(O)NH2, v=0
  555837.0866  0.0648 -4.8995 3 1315.9832213  71510 303A61097      A6 998        syn-C2H3C(O)NH2, v=0
  555869.9191  0.0144 -3.8584 3  733.3561111  71510 303554015      553916        syn-C2H3C(O)NH2, v=0
  555869.9191  0.0144 -3.8584 3  733.3561111  71510 303554016      553917        syn-C2H3C(O)NH2, v=0
  555997.4571  0.0601 -4.7244 3 1147.9465203  71510 303A1 695      A1 596        syn-C2H3C(O)NH2, v=0
  555997.4571  0.0601 -4.7244 3 1147.9465203  71510 303A1 795      A1 696        syn-C2H3C(O)NH2, v=0
  556012.7945  0.0071 -5.5678 3  801.3360149  71510 303742451      732450        syn-C2H3C(O)NH2, v=0
  556014.2785  0.0599 -5.6359 3 1863.3456219  71510 303A94267      A94168        syn-C2H3C(O)NH2, v=0
  556014.2785  0.0599 -5.6359 3 1863.3456219  71510 303A94268      A94169        syn-C2H3C(O)NH2, v=0
  556023.4258  0.0071 -5.5678 3  801.3364149  71510 303742450      732449        syn-C2H3C(O)NH2, v=0
  556044.3745  0.0145 -3.8555 3  719.9604109  71510 303544014      543915        syn-C2H3C(O)NH2, v=0
  556044.3745  0.0145 -3.8555 3  719.9604109  71510 303544015      543916        syn-C2H3C(O)NH2, v=0
  556059.7731  0.0063 -3.6522 3  742.5468149  71510 303741758      731657        syn-C2H3C(O)NH2, v=0
  556210.8309  0.0146 -3.8550 3  706.8110107  71510 303534013      533914        syn-C2H3C(O)NH2, v=0
  556210.8309  0.0146 -3.8550 3  706.8110107  71510 303534014      533915        syn-C2H3C(O)NH2, v=0
  556314.8831  0.0024 -3.7053 3  189.2723 77  71510 303381029      37 730        syn-C2H3C(O)NH2, v=0
  556369.5619  0.0147 -3.8572 3  693.9077105  71510 303524012      523913        syn-C2H3C(O)NH2, v=0
  556369.5619  0.0147 -3.8572 3  693.9077105  71510 303524013      523914        syn-C2H3C(O)NH2, v=0
  556381.7311  0.0941 -5.3633 3 1630.9458231  71510 303B514A1      B513A2        syn-C2H3C(O)NH2, v=0
  556381.7311  0.0941 -5.3633 3 1630.9458231  71510 303B515A1      B514A2        syn-C2H3C(O)NH2, v=0
  556424.8817  0.0288 -4.7891 3 1399.1650183  71510 303914150      914051        syn-C2H3C(O)NH2, v=0
  556424.8817  0.0288 -4.7891 3 1399.1650183  71510 303914151      914052        syn-C2H3C(O)NH2, v=0
  556443.7748  0.0045 -4.6359 3  417.4017111  71510 303551541      551244        syn-C2H3C(O)NH2, v=0
  556520.8349  0.0148 -3.8623 3  681.2503103  71510 303514011      513912        syn-C2H3C(O)NH2, v=0
  556520.8349  0.0148 -3.8623 3  681.2503103  71510 303514012      513913        syn-C2H3C(O)NH2, v=0
  556664.9111  0.0150 -3.8709 3  668.8386101  71510 303504010      503911        syn-C2H3C(O)NH2, v=0
  556664.9111  0.0150 -3.8709 3  668.8386101  71510 303504011      503912        syn-C2H3C(O)NH2, v=0
  556670.6542  0.0018 -3.8416 3  184.1164 75  71510 303371127      36 828        syn-C2H3C(O)NH2, v=0
  556758.8509  0.0082 -5.7435 3  878.4011151  71510 303752947      742946        syn-C2H3C(O)NH2, v=0
  556758.8510  0.0082 -5.7435 3  878.4011151  71510 303752946      742945        syn-C2H3C(O)NH2, v=0
  556775.0853  0.0076 -3.6111 3  770.7026153  71510 303761561      751660        syn-C2H3C(O)NH2, v=0
  556802.0459  0.0151 -3.8834 3  656.6727 99  71510 3034940 9      493910        syn-C2H3C(O)NH2, v=0
  556802.0459  0.0151 -3.8834 3  656.6727 99  71510 303494010      493911        syn-C2H3C(O)NH2, v=0
  556884.8332  0.0076 -5.4708 3  770.7026153  71510 303761661      751660        syn-C2H3C(O)NH2, v=0
  556923.6859  0.0013 -2.9364 3  303.8484 91  71510 303451729      441628        syn-C2H3C(O)NH2, v=0
  556932.4885  0.0153 -3.9007 3  644.7523 97  71510 3034840 8      4839 9        syn-C2H3C(O)NH2, v=0
  556932.4885  0.0153 -3.9007 3  644.7523 97  71510 3034840 9      483910        syn-C2H3C(O)NH2, v=0
  556936.7081  0.0013 -2.9364 3  303.8480 91  71510 303451728      441629        syn-C2H3C(O)NH2, v=0
  556958.1654  0.0076 -5.4706 3  770.6964153  71510 303761561      751560        syn-C2H3C(O)NH2, v=0
  557048.4999  0.0053 -3.6129 3  617.6548135  71510 303671751      661650        syn-C2H3C(O)NH2, v=0
  557056.4828  0.0155 -3.9238 3  633.0772 95  71510 3034740 7      4739 8        syn-C2H3C(O)NH2, v=0
  557056.4828  0.0155 -3.9238 3  633.0772 95  71510 3034740 8      4739 9        syn-C2H3C(O)NH2, v=0
  557067.9133  0.0076 -3.6106 3  770.6964153  71510 303761661      751560        syn-C2H3C(O)NH2, v=0
  557077.6971  0.0021 -4.5352 3  112.2423 59  71510 303291019      28 722        syn-C2H3C(O)NH2, v=0
  557090.3979  0.0279 -4.7496 3 1376.8017181  71510 303904149      904050        syn-C2H3C(O)NH2, v=0
  557090.3979  0.0279 -4.7496 3 1376.8017181  71510 303904150      904051        syn-C2H3C(O)NH2, v=0
  557092.4137  0.0072 -3.6676 3  761.0950151  71510 303751659      741758        syn-C2H3C(O)NH2, v=0
  557122.0398  0.0576 -5.5845 3 1836.4117217  71510 303A84266      A84167        syn-C2H3C(O)NH2, v=0
  557122.0398  0.0576 -5.5845 3 1836.4117217  71510 303A84267      A84168        syn-C2H3C(O)NH2, v=0
  557174.2665  0.0156 -3.9541 3  621.6474 93  71510 3034640 6      4639 7        syn-C2H3C(O)NH2, v=0
  557174.2665  0.0156 -3.9541 3  621.6474 93  71510 3034640 7      4639 8        syn-C2H3C(O)NH2, v=0
  557185.6642  0.1044 -5.4806 3 1702.2870235  71510 303B715A2      B714A3        syn-C2H3C(O)NH2, v=0
  557185.6642  0.1044 -5.4806 3 1702.2870235  71510 303B716A2      B715A3        syn-C2H3C(O)NH2, v=0
  557190.0125  0.0055 -5.3732 3  712.6769145  71510 303721755      711754        syn-C2H3C(O)NH2, v=0
  557286.0721  0.0158 -3.9937 3  610.4627 91  71510 3034540 5      4539 6        syn-C2H3C(O)NH2, v=0
  557286.0721  0.0158 -3.9937 3  610.4627 91  71510 3034540 6      4539 7        syn-C2H3C(O)NH2, v=0
  557380.6254  0.0624 -4.6876 3 1047.2571197  71510 30398 494      98 395        syn-C2H3C(O)NH2, v=0
  557380.6254  0.0624 -4.6876 3 1047.2571197  71510 30398 594      98 495        syn-C2H3C(O)NH2, v=0
  557392.1264  0.0160 -4.0460 3  599.5231 89  71510 3034440 4      4439 5        syn-C2H3C(O)NH2, v=0
  557392.1264  0.0160 -4.0460 3  599.5231 89  71510 3034440 5      4439 6        syn-C2H3C(O)NH2, v=0
  557403.7453  0.0063 -5.4258 3  739.4950147  71510 303731955      721954        syn-C2H3C(O)NH2, v=0
  557425.2648  0.0084 -3.7704 3  769.2539151  71510 303751758      741857        syn-C2H3C(O)NH2, v=0
  557471.9852  0.0069 -5.4641 3  755.0673147  71510 303732152      722151        syn-C2H3C(O)NH2, v=0
  557487.0284  0.0696 -4.9883 3 1381.6873217  71510 303A81098      A8 999        syn-C2H3C(O)NH2, v=0
  557487.0284  0.0696 -4.9883 3 1381.6873217  71510 303A81198      A81099        syn-C2H3C(O)NH2, v=0
  557492.6507  0.0162 -4.1163 3  588.8283 87  71510 3034340 3      4339 4        syn-C2H3C(O)NH2, v=0
  557492.6507  0.0162 -4.1163 3  588.8283 87  71510 3034340 4      4339 5        syn-C2H3C(O)NH2, v=0
  557568.1879  0.0022 -5.3241 3  155.8126 63  71510 303311516      311219        syn-C2H3C(O)NH2, v=0
  557572.6195  0.0044 -4.7237 3  351.6400103  71510 303511339      511042        syn-C2H3C(O)NH2, v=0
  557587.8610  0.0164 -4.2149 3  578.3783 85  71510 3034240 2      4239 3        syn-C2H3C(O)NH2, v=0
  557587.8610  0.0164 -4.2149 3  578.3783 85  71510 3034240 3      4239 4        syn-C2H3C(O)NH2, v=0
  557590.5071  0.0022 -5.3241 3  155.8118 63  71510 303311517      311220        syn-C2H3C(O)NH2, v=0
  557622.6139  0.0019 -2.5903 3  232.9910 55  71510 3032726 1      2625 2        syn-C2H3C(O)NH2, v=0
  557622.6139  0.0019 -2.5903 3  232.9910 55  71510 3032726 2      2625 1        syn-C2H3C(O)NH2, v=0
  557677.9680  0.0166 -4.3651 3  568.1729 83  71510 3034140 1      4139 2        syn-C2H3C(O)NH2, v=0
  557677.9680  0.0166 -4.3651 3  568.1729 83  71510 3034140 2      4139 3        syn-C2H3C(O)NH2, v=0
  557703.4259  0.0065 -5.4435 3  746.9693147  71510 303732054      722053        syn-C2H3C(O)NH2, v=0
  557733.8082  0.0270 -4.7107 3 1354.6916179  71510 303894148      894049        syn-C2H3C(O)NH2, v=0
  557733.8082  0.0270 -4.7107 3 1354.6916179  71510 303894149      894050        syn-C2H3C(O)NH2, v=0
  557763.1772  0.0169 -4.6405 3  558.2120 81  71510 3034040 0      4039 1        syn-C2H3C(O)NH2, v=0
  557763.1772  0.0169 -4.6405 3  558.2120 81  71510 3034040 1      4039 2        syn-C2H3C(O)NH2, v=0
  557806.6952  0.1161 -5.6026 3 1774.8599239  71510 303B916A3      B915A4        syn-C2H3C(O)NH2, v=0
  557806.6952  0.1161 -5.6026 3 1774.8599239  71510 303B917A3      B916A4        syn-C2H3C(O)NH2, v=0
  557843.0638  0.0081 -5.7100 3  865.5724151  71510 303752848      742847        syn-C2H3C(O)NH2, v=0
  557843.0654  0.0081 -5.7100 3  865.5724151  71510 303752847      742846        syn-C2H3C(O)NH2, v=0
  558056.3541  0.0017 -2.6132 3  234.8243 59  71510 3032925 4      2824 5        syn-C2H3C(O)NH2, v=0
  558056.3541  0.0017 -2.6132 3  234.8243 59  71510 3032925 5      2824 4        syn-C2H3C(O)NH2, v=0
  558098.9558  0.0622 -4.7848 3 1210.4474207  71510 303A3 796      A3 697        syn-C2H3C(O)NH2, v=0
  558098.9558  0.0622 -4.7848 3 1210.4474207  71510 303A3 896      A3 797        syn-C2H3C(O)NH2, v=0
  558129.1400  0.0035 -3.3923 3  314.8990 97  71510 303481335      471236        syn-C2H3C(O)NH2, v=0
  558195.1521  0.0554 -5.5337 3 1809.7357215  71510 303A74265      A74166        syn-C2H3C(O)NH2, v=0
  558195.1521  0.0554 -5.5337 3 1809.7357215  71510 303A74266      A74167        syn-C2H3C(O)NH2, v=0
  558223.3080  0.0676 -4.7825 3  949.5116191  71510 30395 293      95 194        syn-C2H3C(O)NH2, v=0
  558223.3080  0.0676 -4.7825 3  949.5116191  71510 30395 393      95 294        syn-C2H3C(O)NH2, v=0
  558238.4741  0.1295 -5.7291 3 1848.6589243  71510 303C117A4      C116A5        syn-C2H3C(O)NH2, v=0
  558238.4741  0.1295 -5.7291 3 1848.6589243  71510 303C118A4      C117A5        syn-C2H3C(O)NH2, v=0
  558280.9598  0.0072 -5.5394 3  791.3661149  71510 303742352      732351        syn-C2H3C(O)NH2, v=0
  558353.5043  0.0070 -5.7506 3  161.8062 71  71510 303351025      35 530        syn-C2H3C(O)NH2, v=0
  558355.7465  0.0261 -4.6726 3 1332.8344177  71510 303884147      884048        syn-C2H3C(O)NH2, v=0
  558355.7465  0.0261 -4.6726 3 1332.8344177  71510 303884148      884049        syn-C2H3C(O)NH2, v=0
  558365.4246  0.0072 -5.5392 3  791.3698149  71510 303742351      732350        syn-C2H3C(O)NH2, v=0
  558458.1472  0.0071 -5.4551 3  761.0950151  71510 303751759      741758        syn-C2H3C(O)NH2, v=0
  558472.7401  0.0015 -2.6383 3  238.1277 63  71510 3033124 7      3023 8        syn-C2H3C(O)NH2, v=0
  558472.7401  0.0015 -2.6383 3  238.1277 63  71510 3033124 8      3023 7        syn-C2H3C(O)NH2, v=0
  558474.0323  0.1447 -5.8599 3 1923.6785247  71510 303C318A5      C317A6        syn-C2H3C(O)NH2, v=0
  558474.0323  0.1447 -5.8599 3 1923.6785247  71510 303C319A5      C318A6        syn-C2H3C(O)NH2, v=0
  558489.3444  0.0013 -2.8714 3  289.6650 87  71510 303431826      421725        syn-C2H3C(O)NH2, v=0
  558489.5448  0.0013 -2.8714 3  289.6650 87  71510 303431825      421726        syn-C2H3C(O)NH2, v=0
  558535.9179  0.0044 -3.4533 3  481.9447119  71510 303591644      581543        syn-C2H3C(O)NH2, v=0
  558628.2490  0.0026 -5.9042 3   62.5704 45  71510 30322 914      21 417        syn-C2H3C(O)NH2, v=0
  558726.0592  0.0034 -4.2464 3  148.3047 67  71510 303331123      32 824        syn-C2H3C(O)NH2, v=0
  558743.4130  0.0052 -4.6992 3  451.6916113  71510 303561838      561541        syn-C2H3C(O)NH2, v=0
  558851.8581  0.0038 -5.3263 3  198.5326 77  71510 303381226      38 731        syn-C2H3C(O)NH2, v=0
  558855.0861  0.0014 -2.6661 3  242.9107 67  71510 303332310      322211        syn-C2H3C(O)NH2, v=0
  558855.0861  0.0014 -2.6661 3  242.9107 67  71510 303332311      322210        syn-C2H3C(O)NH2, v=0
  558956.8263  0.0253 -4.6351 3 1311.2297175  71510 303874146      874047        syn-C2H3C(O)NH2, v=0
  558956.8263  0.0253 -4.6351 3 1311.2297175  71510 303874147      874048        syn-C2H3C(O)NH2, v=0
  558980.6921  0.0753 -5.0843 3 1448.6496221  71510 303B01199      B010A0        syn-C2H3C(O)NH2, v=0
  558980.6921  0.0753 -5.0843 3 1448.6496221  71510 303B01299      B011A0        syn-C2H3C(O)NH2, v=0
  559078.5259  0.0080 -5.6776 3  853.2884151  71510 303752749      742748        syn-C2H3C(O)NH2, v=0
  559078.5451  0.0080 -5.6776 3  853.2884151  71510 303752748      742747        syn-C2H3C(O)NH2, v=0
  559109.8296  0.0043 -4.8855 3  290.6832 95  71510 303471037      47 740        syn-C2H3C(O)NH2, v=0
  559176.7576  0.0014 -2.6972 3  249.1858 71  71510 303352213      342114        syn-C2H3C(O)NH2, v=0
  559176.7576  0.0014 -2.6972 3  249.1858 71  71510 303352214      342113        syn-C2H3C(O)NH2, v=0
  559205.4743  0.0012 -2.8177 3  277.1691 83  71510 303411923      401822        syn-C2H3C(O)NH2, v=0
  559205.4762  0.0012 -2.8177 3  277.1691 83  71510 303411922      401823        syn-C2H3C(O)NH2, v=0
  559234.7150  0.0533 -5.4837 3 1783.3173213  71510 303A64264      A64165        syn-C2H3C(O)NH2, v=0
  559234.7150  0.0533 -5.4837 3 1783.3173213  71510 303A64265      A64166        syn-C2H3C(O)NH2, v=0
  559235.5988  0.0098 -4.7502 3  564.6773129  71510 303641648      641351        syn-C2H3C(O)NH2, v=0
  559259.8162  0.0071 -5.4537 3  761.0227151  71510 303751659      741658        syn-C2H3C(O)NH2, v=0
  559395.3281  0.0013 -2.7321 3  256.9701 75  71510 303372116      362017        syn-C2H3C(O)NH2, v=0
  559395.3281  0.0013 -2.7321 3  256.9701 75  71510 303372117      362016        syn-C2H3C(O)NH2, v=0
  559399.1087  0.0014 -3.0414 3  331.6769 97  71510 303481633      471532        syn-C2H3C(O)NH2, v=0
  559442.4919  0.0013 -2.7719 3  266.2868 79  71510 303392019      381920        syn-C2H3C(O)NH2, v=0
  559442.4919  0.0013 -2.7719 3  266.2868 79  71510 303392020      381919        syn-C2H3C(O)NH2, v=0
  559533.7983  0.0041 -3.4943 3  286.3565 93  71510 303461234      451135        syn-C2H3C(O)NH2, v=0
  559537.6420  0.0246 -4.5984 3 1289.8775173  71510 303864145      864046        syn-C2H3C(O)NH2, v=0
  559537.6420  0.0246 -4.5984 3 1289.8775173  71510 303864146      864047        syn-C2H3C(O)NH2, v=0
  559562.1077  0.0155 -5.5484 3  849.4847177  71510 30388 484      87 483        syn-C2H3C(O)NH2, v=0
  559562.1077  0.0155 -3.3927 3  849.4847177  71510 30388 484      87 583        syn-C2H3C(O)NH2, v=0
  559562.1077  0.0155 -3.3927 3  849.4847177  71510 30388 584      87 483        syn-C2H3C(O)NH2, v=0
  559562.1077  0.0155 -5.5484 3  849.4847177  71510 30388 584      87 583        syn-C2H3C(O)NH2, v=0
  559563.6309  0.0147 -5.5498 3  846.8822175  71510 30387 582      86 581        syn-C2H3C(O)NH2, v=0
  559563.6309  0.0147 -3.4084 3  846.8822175  71510 30387 582      86 681        syn-C2H3C(O)NH2, v=0
  559563.6309  0.0147 -3.4084 3  846.8822175  71510 30387 682      86 581        syn-C2H3C(O)NH2, v=0
  559563.6309  0.0147 -5.5498 3  846.8822175  71510 30387 682      86 681        syn-C2H3C(O)NH2, v=0
  559568.6531  0.0166 -5.5460 3  851.5633179  71510 30389 386      88 385        syn-C2H3C(O)NH2, v=0
  559568.6531  0.0166 -3.3771 3  851.5633179  71510 30389 386      88 485        syn-C2H3C(O)NH2, v=0
  559568.6531  0.0166 -3.3771 3  851.5633179  71510 30389 486      88 385        syn-C2H3C(O)NH2, v=0
  559568.6531  0.0166 -5.5460 3  851.5633179  71510 30389 486      88 485        syn-C2H3C(O)NH2, v=0
  559577.8715  0.0140 -5.5502 3  843.7484173  71510 30386 680      85 679        syn-C2H3C(O)NH2, v=0
  559577.8715  0.0140 -3.4242 3  843.7484173  71510 30386 680      85 779        syn-C2H3C(O)NH2, v=0
  559577.8715  0.0140 -3.4242 3  843.7484173  71510 30386 780      85 679        syn-C2H3C(O)NH2, v=0
  559577.8715  0.0140 -5.5502 3  843.7484173  71510 30386 780      85 779        syn-C2H3C(O)NH2, v=0
  559579.6523  0.0182 -5.5425 3  853.1239181  71510 30390 288      89 287        syn-C2H3C(O)NH2, v=0
  559579.6523  0.0182 -3.3613 3  853.1239181  71510 30390 288      89 387        syn-C2H3C(O)NH2, v=0
  559579.6523  0.0182 -3.3613 3  853.1239181  71510 30390 388      89 287        syn-C2H3C(O)NH2, v=0
  559579.6523  0.0182 -5.5425 3  853.1239181  71510 30390 388      89 387        syn-C2H3C(O)NH2, v=0
  559592.2623  0.0205 -5.5380 3  854.1718183  71510 30391 190      90 189        syn-C2H3C(O)NH2, v=0
  559592.2623  0.0205 -3.3453 3  854.1718183  71510 30391 190      90 289        syn-C2H3C(O)NH2, v=0
  559592.2623  0.0205 -3.3453 3  854.1718183  71510 30391 290      90 189        syn-C2H3C(O)NH2, v=0
  559592.2623  0.0205 -5.5380 3  854.1718183  71510 30391 290      90 289        syn-C2H3C(O)NH2, v=0
  559604.2241  0.0236 -5.5325 3  854.7113185  71510 30392 092      91 091        syn-C2H3C(O)NH2, v=0
  559604.2241  0.0236 -3.3291 3  854.7113185  71510 30392 092      91 191        syn-C2H3C(O)NH2, v=0
  559604.2241  0.0236 -3.3291 3  854.7113185  71510 30392 192      91 091        syn-C2H3C(O)NH2, v=0
  559604.2241  0.0236 -5.5325 3  854.7113185  71510 30392 192      91 191        syn-C2H3C(O)NH2, v=0
  559610.8867  0.0134 -5.5494 3  840.0750171  71510 30385 778      84 777        syn-C2H3C(O)NH2, v=0
  559610.8867  0.0134 -3.4402 3  840.0750171  71510 30385 778      84 877        syn-C2H3C(O)NH2, v=0
  559610.8867  0.0134 -3.4402 3  840.0750171  71510 30385 878      84 777        syn-C2H3C(O)NH2, v=0
  559610.8867  0.0134 -5.5494 3  840.0750171  71510 30385 878      84 877        syn-C2H3C(O)NH2, v=0
  559631.8359  0.0067 -5.4380 3  750.5866149  71510 303741857      731856        syn-C2H3C(O)NH2, v=0
  559647.2523  0.0023 -5.3985 3  148.1144 61  71510 303301515      301218        syn-C2H3C(O)NH2, v=0
  559657.5090  0.0023 -5.3985 3  148.1140 61  71510 303301516      301219        syn-C2H3C(O)NH2, v=0
  559670.6913  0.0128 -5.5475 3  835.8515169  71510 30384 876      83 875        syn-C2H3C(O)NH2, v=0
  559670.6913  0.0128 -3.4568 3  835.8515169  71510 30384 876      83 975        syn-C2H3C(O)NH2, v=0
  559670.6913  0.0128 -3.4568 3  835.8515169  71510 30384 976      83 875        syn-C2H3C(O)NH2, v=0
  559670.6913  0.0128 -5.5475 3  835.8515169  71510 30384 976      83 975        syn-C2H3C(O)NH2, v=0
  559762.9797  0.0630 -4.7137 3 1107.7987201  71510 303A0 595      A0 496        syn-C2H3C(O)NH2, v=0
  559762.9797  0.0630 -4.7137 3 1107.7987201  71510 303A0 695      A0 596        syn-C2H3C(O)NH2, v=0
  559766.2797  0.0067 -4.7504 3  410.3035111  71510 303551342      551045        syn-C2H3C(O)NH2, v=0
  559768.0851  0.0122 -5.5444 3  831.0655167  71510 30383 974      82 973        syn-C2H3C(O)NH2, v=0
  559768.0851  0.0122 -3.4740 3  831.0655167  71510 30383 974      821073        syn-C2H3C(O)NH2, v=0
  559768.0851  0.0122 -3.4740 3  831.0655167  71510 303831074      82 973        syn-C2H3C(O)NH2, v=0
  559768.0851  0.0122 -5.5444 3  831.0655167  71510 303831074      821073        syn-C2H3C(O)NH2, v=0
  559917.9479  0.0116 -5.5400 3  825.7015165  71510 303821072      811071        syn-C2H3C(O)NH2, v=0
  559917.9479  0.0116 -3.4923 3  825.7015165  71510 303821072      811171        syn-C2H3C(O)NH2, v=0
  559917.9479  0.0116 -3.4923 3  825.7015165  71510 303821172      811071        syn-C2H3C(O)NH2, v=0
  559917.9479  0.0116 -5.5400 3  825.7015165  71510 303821172      811171        syn-C2H3C(O)NH2, v=0
  559919.6851  0.0054 -5.4901 3  184.2909 75  71510 303371126      37 631        syn-C2H3C(O)NH2, v=0
  560021.2454  0.0016 -3.1679 3  350.1829101  71510 303501535      491436        syn-C2H3C(O)NH2, v=0
  560056.1232  0.0652 -4.8570 3 1274.2215211  71510 303A5 897      A5 798        syn-C2H3C(O)NH2, v=0
  560056.1232  0.0652 -4.8570 3 1274.2215211  71510 303A5 997      A5 898        syn-C2H3C(O)NH2, v=0
  560098.7693  0.0239 -4.5624 3 1268.7773171  71510 303854144      854045        syn-C2H3C(O)NH2, v=0
  560098.7693  0.0239 -4.5624 3 1268.7773171  71510 303854145      854046        syn-C2H3C(O)NH2, v=0
  560141.3542  0.0110 -3.5121 3  819.7403163  71510 303811170      801269        syn-C2H3C(O)NH2, v=0
  560141.3545  0.0110 -5.5343 3  819.7403163  71510 303811270      801269        syn-C2H3C(O)NH2, v=0
  560141.3547  0.0110 -5.5343 3  819.7403163  71510 303811170      801169        syn-C2H3C(O)NH2, v=0
  560141.3550  0.0110 -3.5121 3  819.7403163  71510 303811270      801169        syn-C2H3C(O)NH2, v=0
  560180.4692  0.0024 -4.7779 3  285.1624 89  71510 303441629      441332        syn-C2H3C(O)NH2, v=0
  560241.7803  0.0513 -5.4343 3 1757.1562211  71510 303A54263      A54164        syn-C2H3C(O)NH2, v=0
  560241.7803  0.0513 -5.4343 3 1757.1562211  71510 303A54264      A54165        syn-C2H3C(O)NH2, v=0
  560310.2573  0.0014 -3.0402 3  331.6517 97  71510 303481632      471533        syn-C2H3C(O)NH2, v=0
  560314.0733  0.0822 -5.1866 3 1516.8649225  71510 303B212A0      B211A1        syn-C2H3C(O)NH2, v=0
  560314.0733  0.0822 -5.1866 3 1516.8649225  71510 303B213A0      B212A1        syn-C2H3C(O)NH2, v=0
  560423.1723  0.0100 -5.9472 3  968.8144153  71510 303763442      753441        syn-C2H3C(O)NH2, v=0
  560423.1723  0.0100 -5.9472 3  968.8144153  71510 303763443      753442        syn-C2H3C(O)NH2, v=0
  560469.2172  0.0103 -3.5340 3  813.1569161  71510 303801268      791367        syn-C2H3C(O)NH2, v=0
  560469.2251  0.0103 -5.5271 3  813.1569161  71510 303801368      791367        syn-C2H3C(O)NH2, v=0
  560469.2318  0.0103 -5.5271 3  813.1569161  71510 303801268      791267        syn-C2H3C(O)NH2, v=0
  560469.2398  0.0103 -3.5340 3  813.1569161  71510 303801368      791267        syn-C2H3C(O)NH2, v=0
  560503.9024  0.0080 -5.6463 3  841.5644151  71510 303752650      742649        syn-C2H3C(O)NH2, v=0
  560504.1180  0.0080 -5.6463 3  841.5644151  71510 303752649      742648        syn-C2H3C(O)NH2, v=0
  560509.4194  0.0353 -5.0392 3 1015.7152171  71510 303852362      852065        syn-C2H3C(O)NH2, v=0
  560625.5496  0.0070 -3.6618 3  761.0227151  71510 303751759      741658        syn-C2H3C(O)NH2, v=0
  560626.9486  0.0023 -5.1339 3   77.3939 47  71510 303231113      22 814        syn-C2H3C(O)NH2, v=0
  560640.7666  0.0232 -4.5271 3 1247.9289169  71510 303844143      844044        syn-C2H3C(O)NH2, v=0
  560640.7666  0.0232 -4.5271 3 1247.9289169  71510 303844144      844045        syn-C2H3C(O)NH2, v=0
  560651.9118  0.0025 -4.8179 3  274.1894 87  71510 303431627      431330        syn-C2H3C(O)NH2, v=0
  560870.9821  0.0668 -4.7250 3 1008.0752195  71510 30397 394      97 295        syn-C2H3C(O)NH2, v=0
  560870.9821  0.0668 -4.7250 3 1008.0752195  71510 30397 494      97 395        syn-C2H3C(O)NH2, v=0
  560948.8456  0.0097 -3.5590 3  805.9187159  71510 303791366      781465        syn-C2H3C(O)NH2, v=0
  560949.0408  0.0097 -5.5183 3  805.9187159  71510 303791466      781465        syn-C2H3C(O)NH2, v=0
  560949.1967  0.0097 -5.5183 3  805.9186159  71510 303791366      781365        syn-C2H3C(O)NH2, v=0
  560949.3918  0.0097 -3.5590 3  805.9186159  71510 303791466      781365        syn-C2H3C(O)NH2, v=0
  560997.4156  0.0073 -5.5119 3  782.0699149  71510 303742253      732252        syn-C2H3C(O)NH2, v=0
  561089.7615  0.0098 -5.9078 3  953.4209153  71510 303763343      753342        syn-C2H3C(O)NH2, v=0
  561089.7615  0.0098 -5.9078 3  953.4209153  71510 303763344      753343        syn-C2H3C(O)NH2, v=0
  561164.1754  0.0226 -4.4926 3 1227.3321167  71510 303834142      834043        syn-C2H3C(O)NH2, v=0
  561164.1754  0.0226 -4.4926 3 1227.3321167  71510 303834143      834044        syn-C2H3C(O)NH2, v=0
  561217.3546  0.0494 -5.3855 3 1731.2520209  71510 303A44262      A44163        syn-C2H3C(O)NH2, v=0
  561217.3546  0.0494 -5.3855 3 1731.2520209  71510 303A44263      A44164        syn-C2H3C(O)NH2, v=0
  561221.2751  0.0061 -5.4003 3  731.2627147  71510 303731756      721755        syn-C2H3C(O)NH2, v=0
  561347.8668  0.0022 -5.1332 3   77.3698 47  71510 303231112      22 815        syn-C2H3C(O)NH2, v=0
  561375.1637  0.0207 -4.9790 3  950.6562165  71510 303822359      822062        syn-C2H3C(O)NH2, v=0
  561397.5653  0.0041 -4.7929 3  320.5538 99  71510 303491238      49 941        syn-C2H3C(O)NH2, v=0
  561458.9115  0.0733 -4.9983 3  911.3135189  71510 30394 193      94 094        syn-C2H3C(O)NH2, v=0
  561458.9115  0.0733 -4.9983 3  911.3135189  71510 30394 293      94 194        syn-C2H3C(O)NH2, v=0
  561482.8327  0.0902 -5.2948 3 1586.3281229  71510 303B413A1      B412A2        syn-C2H3C(O)NH2, v=0
  561482.8327  0.0902 -5.2948 3 1586.3281229  71510 303B414A1      B413A2        syn-C2H3C(O)NH2, v=0
  561505.2847  0.0023 -5.4782 3  140.6766 59  71510 303291514      291217        syn-C2H3C(O)NH2, v=0
  561509.8375  0.0023 -5.4782 3  140.6764 59  71510 303291515      291218        syn-C2H3C(O)NH2, v=0
  561562.6668  0.0057 -5.3414 3  699.0489143  71510 303711853      701852        syn-C2H3C(O)NH2, v=0
  561564.1860  0.0074 -5.5111 3  782.0981149  71510 303742252      732251        syn-C2H3C(O)NH2, v=0
  561653.6366  0.0090 -3.5885 3  797.9805157  71510 303781464      771563        syn-C2H3C(O)NH2, v=0
  561657.5967  0.0090 -5.5076 3  797.9805157  71510 303781564      771563        syn-C2H3C(O)NH2, v=0
  561660.1038  0.0086 -4.7430 3  510.5967123  71510 303611546      611249        syn-C2H3C(O)NH2, v=0
  561660.5412  0.0090 -5.5076 3  797.9803157  71510 303781464      771463        syn-C2H3C(O)NH2, v=0
  561664.5013  0.0090 -3.5885 3  797.9803157  71510 303781564      771463        syn-C2H3C(O)NH2, v=0
  561669.5214  0.0221 -4.4588 3 1206.9867165  71510 303824141      824042        syn-C2H3C(O)NH2, v=0
  561669.5214  0.0221 -4.4588 3 1206.9867165  71510 303824142      824043        syn-C2H3C(O)NH2, v=0
  561821.7320  0.0096 -5.8697 3  938.5339153  71510 303763244      753243        syn-C2H3C(O)NH2, v=0
  561821.7320  0.0096 -5.8697 3  938.5339153  71510 303763245      753244        syn-C2H3C(O)NH2, v=0
  561865.8712  0.0692 -4.9388 3 1339.2637215  71510 303A7 998      A7 899        syn-C2H3C(O)NH2, v=0
  561865.8712  0.0692 -4.9388 3 1339.2637215  71510 303A71098      A7 999        syn-C2H3C(O)NH2, v=0
  561979.9924  0.0043 -5.6258 3   70.3695 49  71510 30324 817      23 320        syn-C2H3C(O)NH2, v=0
  562004.4011  0.0076 -4.7422 3  459.1361117  71510 303581444      581147        syn-C2H3C(O)NH2, v=0
  562007.9923  0.0643 -4.7604 3 1169.6231205  71510 303A2 696      A2 597        syn-C2H3C(O)NH2, v=0
  562007.9923  0.0643 -4.7604 3 1169.6231205  71510 303A2 796      A2 697        syn-C2H3C(O)NH2, v=0
  562157.3154  0.0215 -4.4257 3 1186.8924163  71510 303814140      814041        syn-C2H3C(O)NH2, v=0
  562157.3154  0.0215 -4.4257 3 1186.8924163  71510 303814141      814042        syn-C2H3C(O)NH2, v=0
  562162.4025  0.0476 -5.3374 3 1705.6043207  71510 303A34261      A34162        syn-C2H3C(O)NH2, v=0
  562162.4025  0.0476 -5.3374 3 1705.6043207  71510 303A34262      A34163        syn-C2H3C(O)NH2, v=0
  562174.0753  0.0080 -5.6161 3  830.4201151  71510 303752551      742550        syn-C2H3C(O)NH2, v=0
  562175.2406  0.0036 -4.7195 3  363.5373101  71510 303501733      501436        syn-C2H3C(O)NH2, v=0
  562176.2290  0.0080 -5.6161 3  830.4202151  71510 303752550      742549        syn-C2H3C(O)NH2, v=0
  562251.5989  0.0047 -5.0170 3  103.3776 65  71510 30332 230      31 131        syn-C2H3C(O)NH2, v=0
  562251.6324  0.0047 -5.0170 3  103.3776 65  71510 30332 330      31 031        syn-C2H3C(O)NH2, v=0
  562400.1660  0.0017 -3.7742 3  193.5230 77  71510 303381128      37 829        syn-C2H3C(O)NH2, v=0
  562482.2593  0.0995 -5.4083 3 1657.0339233  71510 303B614A2      B613A3        syn-C2H3C(O)NH2, v=0
  562482.2593  0.0995 -5.4083 3 1657.0339233  71510 303B615A2      B614A3        syn-C2H3C(O)NH2, v=0
  562628.0534  0.0210 -4.3934 3 1167.0489161  71510 303804139      804040        syn-C2H3C(O)NH2, v=0
  562628.0534  0.0210 -4.3934 3 1167.0489161  71510 303804140      804041        syn-C2H3C(O)NH2, v=0
  562630.1818  0.0094 -5.8329 3  924.1587153  71510 303763145      753144        syn-C2H3C(O)NH2, v=0
  562630.1818  0.0094 -5.8329 3  924.1587153  71510 303763146      753145        syn-C2H3C(O)NH2, v=0
  562652.9008  0.0084 -3.6253 3  789.2782155  71510 303771562      761661        syn-C2H3C(O)NH2, v=0
  562718.2100  0.0084 -5.4947 3  789.2782155  71510 303771662      761661        syn-C2H3C(O)NH2, v=0
  562762.6487  0.0084 -5.4947 3  789.2746155  71510 303771562      761561        syn-C2H3C(O)NH2, v=0
  562827.9579  0.0084 -3.6250 3  789.2746155  71510 303771662      761561        syn-C2H3C(O)NH2, v=0
  562876.9881  0.0044 -4.6215 3  452.0507115  71510 303571642      571345        syn-C2H3C(O)NH2, v=0
  562908.4635  0.0035 -4.3524 3  139.8973 65  71510 303321122      31 823        syn-C2H3C(O)NH2, v=0
  562962.6630  0.3384 -5.9046 3 1671.1762219  71510 303A92980      A83079        syn-C2H3C(O)NH2, v=0
  563007.1223  0.0058 -5.7337 3  160.0315 75  71510 30337 532      37 235        syn-C2H3C(O)NH2, v=0
  563021.8316  0.0058 -5.7337 3  160.0315 75  71510 30337 632      37 335        syn-C2H3C(O)NH2, v=0
  563077.8494  0.0459 -5.2900 3 1680.2128205  71510 303A24260      A24161        syn-C2H3C(O)NH2, v=0
  563077.8494  0.0459 -5.2900 3 1680.2128205  71510 303A24261      A24162        syn-C2H3C(O)NH2, v=0
  563082.2178  0.0205 -4.3619 3 1147.4561159  71510 303794138      794039        syn-C2H3C(O)NH2, v=0
  563082.2178  0.0205 -4.3619 3 1147.4561159  71510 303794139      794040        syn-C2H3C(O)NH2, v=0
  563164.2313  0.0024 -5.5637 3  133.4977 57  71510 303281513      281216        syn-C2H3C(O)NH2, v=0
  563166.1792  0.0024 -5.5637 3  133.4976 57  71510 303281514      281217        syn-C2H3C(O)NH2, v=0
  563307.2280  0.1102 -5.5269 3 1728.9769237  71510 303B815A3      B814A4        syn-C2H3C(O)NH2, v=0
  563307.2280  0.1102 -5.5269 3 1728.9769237  71510 303B816A3      B815A4        syn-C2H3C(O)NH2, v=0
  563387.3045  0.0667 -4.7216 3 1067.9311199  71510 30399 495      99 396        syn-C2H3C(O)NH2, v=0
  563387.3045  0.0667 -4.7216 3 1067.9311199  71510 30399 595      99 496        syn-C2H3C(O)NH2, v=0
  563387.8586  0.0079 -3.6764 3  779.7231153  71510 303761660      751759        syn-C2H3C(O)NH2, v=0
  563520.2778  0.0201 -4.3312 3 1128.1138157  71510 303784137      784038        syn-C2H3C(O)NH2, v=0
  563520.2778  0.0201 -4.3312 3 1128.1138157  71510 303784138      784039        syn-C2H3C(O)NH2, v=0
  563524.8727  0.0741 -5.0289 3 1405.5692219  71510 303A91099      A9 9A0        syn-C2H3C(O)NH2, v=0
  563524.8727  0.0741 -5.0289 3 1405.5692219  71510 303A91199      A910A0        syn-C2H3C(O)NH2, v=0
  563528.9766  0.0092 -5.7972 3  910.3022153  71510 303763046      753045        syn-C2H3C(O)NH2, v=0
  563528.9766  0.0092 -5.7972 3  910.3022153  71510 303763047      753046        syn-C2H3C(O)NH2, v=0
  563543.2270  0.0014 -2.9523 3  315.0707 93  71510 303461730      451629        syn-C2H3C(O)NH2, v=0
  563565.1649  0.0036 -3.7625 3  184.2974 77  71510 30338 830      37 731        syn-C2H3C(O)NH2, v=0
  563569.4204  0.0014 -2.9523 3  315.0700 93  71510 303461729      451630        syn-C2H3C(O)NH2, v=0
  563872.1341  0.0074 -5.4859 3  773.4852149  71510 303742154      732153        syn-C2H3C(O)NH2, v=0
  563942.6898  0.0197 -4.3012 3 1109.0216155  71510 303774136      774037        syn-C2H3C(O)NH2, v=0
  563942.6898  0.0197 -4.3012 3 1109.0216155  71510 303774137      774038        syn-C2H3C(O)NH2, v=0
  563952.1513  0.1223 -5.6502 3 1802.1519241  71510 303C016A4      C015A5        syn-C2H3C(O)NH2, v=0
  563952.1513  0.1223 -5.6502 3 1802.1519241  71510 303C017A4      C016A5        syn-C2H3C(O)NH2, v=0
  563964.5834  0.0443 -5.2432 3 1655.0772203  71510 303A14259      A14160        syn-C2H3C(O)NH2, v=0
  563964.5834  0.0443 -5.2432 3 1655.0772203  71510 303A14260      A14161        syn-C2H3C(O)NH2, v=0
  564113.0604  0.0665 -4.8221 3 1232.7255209  71510 303A4 797      A4 698        syn-C2H3C(O)NH2, v=0
  564113.0604  0.0665 -4.8221 3 1232.7255209  71510 303A4 897      A4 798        syn-C2H3C(O)NH2, v=0
  564167.5690  0.0080 -5.5869 3  819.8826151  71510 303752452      742451        syn-C2H3C(O)NH2, v=0
  564186.4773  0.0080 -5.5868 3  819.8834151  71510 303752451      742450        syn-C2H3C(O)NH2, v=0
  564232.2789  0.0720 -4.8144 3  969.1824193  71510 30396 294      96 195        syn-C2H3C(O)NH2, v=0
  564232.2789  0.0720 -4.8144 3  969.1824193  71510 30396 394      96 295        syn-C2H3C(O)NH2, v=0
  564239.4082  0.0078 -5.4792 3  779.7231153  71510 303761760      751759        syn-C2H3C(O)NH2, v=0
  564349.8983  0.0193 -4.2721 3 1090.1795153  71510 303764135      764036        syn-C2H3C(O)NH2, v=0
  564349.8983  0.0193 -4.2721 3 1090.1795153  71510 303764136      764037        syn-C2H3C(O)NH2, v=0
  564408.4160  0.0033 -4.6206 3  430.0451111  71510 303551739      551442        syn-C2H3C(O)NH2, v=0
  564410.9224  0.1361 -5.7779 3 1876.5532245  71510 303C217A5      C216A6        syn-C2H3C(O)NH2, v=0
  564410.9224  0.1361 -5.7779 3 1876.5532245  71510 303C218A5      C217A6        syn-C2H3C(O)NH2, v=0
  564461.5272  0.0070 -5.4474 3  758.0880149  71510 303741956      731955        syn-C2H3C(O)NH2, v=0
  564483.6592  0.0035 -4.6151 3  444.1816113  71510 303561740      561443        syn-C2H3C(O)NH2, v=0
  564517.7545  0.0220 -4.0787 3  862.4277159  71510 303791960      782059        syn-C2H3C(O)NH2, v=0
  564535.7619  0.0091 -5.7627 3  896.9726153  71510 303762948      752947        syn-C2H3C(O)NH2, v=0
  564535.7622  0.0091 -5.7627 3  896.9726153  71510 303762947      752946        syn-C2H3C(O)NH2, v=0
  564629.9376  0.0055 -3.6018 3  600.4030133  71510 303661750      651649        syn-C2H3C(O)NH2, v=0
  564643.0210  0.0024 -5.6558 3  126.5763 55  71510 303271512      271215        syn-C2H3C(O)NH2, v=0
  564643.8222  0.0024 -5.6558 3  126.5763 55  71510 303271513      271216        syn-C2H3C(O)NH2, v=0
  564676.8506  0.1517 -5.9100 3 1952.1754249  71510 303C418A6      C417A7        syn-C2H3C(O)NH2, v=0
  564676.8506  0.1517 -5.9100 3 1952.1754249  71510 303C419A6      C418A7        syn-C2H3C(O)NH2, v=0
  564690.9195  0.0028 -3.3038 3  344.7013101  71510 303501436      491337        syn-C2H3C(O)NH2, v=0
  564742.3360  0.0190 -4.2438 3 1071.5871151  71510 303754134      754035        syn-C2H3C(O)NH2, v=0
  564742.3360  0.0190 -4.2438 3 1071.5871151  71510 303754135      754036        syn-C2H3C(O)NH2, v=0
  564753.5920  0.0078 -5.4783 3  779.6776153  71510 303761660      751659        syn-C2H3C(O)NH2, v=0
  564823.4583  0.0427 -5.1971 3 1630.1971201  71510 303A04258      A04159        syn-C2H3C(O)NH2, v=0
  564823.4583  0.0427 -5.1971 3 1630.1971201  71510 303A04259      A04160        syn-C2H3C(O)NH2, v=0
  564896.4188  0.0018 -2.5939 3  239.5617 57  71510 3032826 2      2725 3        syn-C2H3C(O)NH2, v=0
  564896.4188  0.0018 -2.5939 3  239.5617 57  71510 3032826 3      2725 2        syn-C2H3C(O)NH2, v=0
  565004.8760  0.0015 -3.0647 3  343.7839 99  71510 303491634      481533        syn-C2H3C(O)NH2, v=0
  565029.5389  0.0801 -5.1261 3 1473.1328223  71510 303B111A0      B110A1        syn-C2H3C(O)NH2, v=0
  565029.5389  0.0801 -5.1261 3 1473.1328223  71510 303B112A0      B111A1        syn-C2H3C(O)NH2, v=0
  565120.4246  0.0187 -4.2164 3 1053.2443149  71510 303744133      744034        syn-C2H3C(O)NH2, v=0
  565120.4246  0.0187 -4.2164 3 1053.2443149  71510 303744134      744035        syn-C2H3C(O)NH2, v=0
  565140.2055  0.0023 -4.8127 3  274.0395 87  71510 303431628      431331        syn-C2H3C(O)NH2, v=0
  565141.9414  0.0065 -4.7208 3  533.5122123  71510 303611942      611645        syn-C2H3C(O)NH2, v=0
  565201.1710  0.0044 -3.5849 3  259.0377 89  71510 303441133      431034        syn-C2H3C(O)NH2, v=0
  565236.3305  0.0039 -4.8786 3  290.6834 95  71510 303471137      47 840        syn-C2H3C(O)NH2, v=0
  565252.0630  0.0022 -5.0376 3   83.1581 49  71510 303241114      23 815        syn-C2H3C(O)NH2, v=0
  565326.1672  0.0017 -2.6173 3  241.8889 61  71510 3033025 5      2924 6        syn-C2H3C(O)NH2, v=0
  565326.1672  0.0017 -2.6173 3  241.8889 61  71510 3033025 6      2924 5        syn-C2H3C(O)NH2, v=0
  565373.6203  0.0013 -2.8843 3  300.3247 89  71510 303441827      431726        syn-C2H3C(O)NH2, v=0
  565374.0690  0.0013 -2.8843 3  300.3247 89  71510 303441826      431727        syn-C2H3C(O)NH2, v=0
  565374.5805  0.0067 -5.4274 3  749.9830149  71510 303741757      731756        syn-C2H3C(O)NH2, v=0
  565484.5751  0.0184 -4.1898 3 1035.1508147  71510 303734132      734033        syn-C2H3C(O)NH2, v=0
  565484.5751  0.0184 -4.1898 3 1035.1508147  71510 303734133      734034        syn-C2H3C(O)NH2, v=0
  565540.4449  0.0084 -5.8878 3   71.9926 51  71510 30325 619      24 322        syn-C2H3C(O)NH2, v=0
  565587.3549  0.0169 -5.5732 3  868.1497179  71510 30389 485      88 484        syn-C2H3C(O)NH2, v=0
  565587.3549  0.0169 -3.4168 3  868.1497179  71510 30389 485      88 584        syn-C2H3C(O)NH2, v=0
  565587.3549  0.0169 -3.4168 3  868.1497179  71510 30389 585      88 484        syn-C2H3C(O)NH2, v=0
  565587.3549  0.0169 -5.5732 3  868.1497179  71510 30389 585      88 584        syn-C2H3C(O)NH2, v=0
  565588.0673  0.0160 -5.5746 3  865.5472177  71510 30388 583      87 582        syn-C2H3C(O)NH2, v=0
  565588.0673  0.0160 -3.4322 3  865.5472177  71510 30388 583      87 682        syn-C2H3C(O)NH2, v=0
  565588.0673  0.0160 -3.4322 3  865.5472177  71510 30388 683      87 582        syn-C2H3C(O)NH2, v=0
  565588.0673  0.0160 -5.5746 3  865.5472177  71510 30388 683      87 682        syn-C2H3C(O)NH2, v=0
  565594.3769  0.0181 -5.5708 3  870.2285181  71510 30390 387      89 386        syn-C2H3C(O)NH2, v=0
  565594.3769  0.0181 -3.4014 3  870.2285181  71510 30390 387      89 486        syn-C2H3C(O)NH2, v=0
  565594.3769  0.0181 -3.4014 3  870.2285181  71510 30390 487      89 386        syn-C2H3C(O)NH2, v=0
  565594.3769  0.0181 -5.5708 3  870.2285181  71510 30390 487      89 486        syn-C2H3C(O)NH2, v=0
  565601.0044  0.0152 -5.5748 3  862.4139175  71510 30387 681      86 680        syn-C2H3C(O)NH2, v=0
  565601.0044  0.0152 -3.4477 3  862.4139175  71510 30387 681      86 780        syn-C2H3C(O)NH2, v=0
  565601.0044  0.0152 -3.4477 3  862.4139175  71510 30387 781      86 680        syn-C2H3C(O)NH2, v=0
  565601.0044  0.0152 -5.5748 3  862.4139175  71510 30387 781      86 780        syn-C2H3C(O)NH2, v=0
  565605.1417  0.0078 -3.6728 3  779.6776153  71510 303761760      751659        syn-C2H3C(O)NH2, v=0
  565605.6285  0.0198 -5.5674 3  871.7895183  71510 30391 289      90 288        syn-C2H3C(O)NH2, v=0
  565605.6285  0.0198 -3.3859 3  871.7895183  71510 30391 289      90 388        syn-C2H3C(O)NH2, v=0
  565605.6285  0.0198 -3.3859 3  871.7895183  71510 30391 389      90 288        syn-C2H3C(O)NH2, v=0
  565605.6285  0.0198 -5.5674 3  871.7895183  71510 30391 389      90 388        syn-C2H3C(O)NH2, v=0
  565618.3443  0.0222 -5.5630 3  872.8378185  71510 30392 191      91 190        syn-C2H3C(O)NH2, v=0
  565618.3443  0.0222 -3.3701 3  872.8378185  71510 30392 191      91 290        syn-C2H3C(O)NH2, v=0
  565618.3443  0.0222 -3.3701 3  872.8378185  71510 30392 291      91 190        syn-C2H3C(O)NH2, v=0
  565618.3443  0.0222 -5.5630 3  872.8378185  71510 30392 291      91 290        syn-C2H3C(O)NH2, v=0
  565630.3194  0.0255 -5.5576 3  873.3777187  71510 30393 093      92 092        syn-C2H3C(O)NH2, v=0
  565630.3194  0.0255 -3.3541 3  873.3777187  71510 30393 093      92 192        syn-C2H3C(O)NH2, v=0
  565630.3194  0.0255 -3.3541 3  873.3777187  71510 30393 193      92 092        syn-C2H3C(O)NH2, v=0
  565630.3194  0.0255 -5.5576 3  873.3777187  71510 30393 193      92 192        syn-C2H3C(O)NH2, v=0
  565631.9945  0.0146 -5.5740 3  858.7416173  71510 30386 779      85 778        syn-C2H3C(O)NH2, v=0
  565631.9945  0.0146 -3.4634 3  858.7416173  71510 30386 779      85 878        syn-C2H3C(O)NH2, v=0
  565631.9945  0.0146 -3.4634 3  858.7416173  71510 30386 879      85 778        syn-C2H3C(O)NH2, v=0
  565631.9945  0.0146 -5.5740 3  858.7416173  71510 30386 879      85 878        syn-C2H3C(O)NH2, v=0
  565655.2950  0.0412 -5.1517 3 1605.5722199  71510 303994257      994158        syn-C2H3C(O)NH2, v=0
  565655.2950  0.0412 -5.1517 3 1605.5722199  71510 303994258      994159        syn-C2H3C(O)NH2, v=0
  565668.6672  0.0073 -5.4634 3  765.5723149  71510 303742055      732054        syn-C2H3C(O)NH2, v=0
  565673.5059  0.0090 -5.7293 3  884.1800153  71510 303762849      752848        syn-C2H3C(O)NH2, v=0
  565673.5091  0.0090 -5.7293 3  884.1800153  71510 303762848      752847        syn-C2H3C(O)NH2, v=0
  565683.5896  0.0130 -3.9074 3  815.2464155  71510 303771859      761958        syn-C2H3C(O)NH2, v=0
  565687.3559  0.0074 -5.4618 3  769.2539151  71510 303751858      741857        syn-C2H3C(O)NH2, v=0
  565688.7153  0.0140 -5.5720 3  854.5201171  71510 30385 877      84 876        syn-C2H3C(O)NH2, v=0
  565688.7153  0.0140 -3.4795 3  854.5201171  71510 30385 877      84 976        syn-C2H3C(O)NH2, v=0
  565688.7153  0.0140 -3.4795 3  854.5201171  71510 30385 977      84 876        syn-C2H3C(O)NH2, v=0
  565688.7153  0.0140 -5.5720 3  854.5201171  71510 30385 977      84 976        syn-C2H3C(O)NH2, v=0
  565726.3690  0.3057 -5.7181 3 1578.4626213  71510 303A62878      A52977        syn-C2H3C(O)NH2, v=0
  565734.4240  0.0015 -2.6430 3  245.6888 65  71510 3033224 8      3123 9        syn-C2H3C(O)NH2, v=0
  565734.4240  0.0015 -2.6430 3  245.6888 65  71510 3033224 9      3123 8        syn-C2H3C(O)NH2, v=0
  565770.0609  0.0673 -4.7490 3 1129.0744203  71510 303A1 596      A1 497        syn-C2H3C(O)NH2, v=0
  565770.0609  0.0673 -4.7490 3 1129.0744203  71510 303A1 696      A1 597        syn-C2H3C(O)NH2, v=0
  565775.7300  0.0041 -4.9862 3  262.0428 91  71510 30345 936      45 639        syn-C2H3C(O)NH2, v=0
  565781.4604  0.0133 -5.5688 3  849.7373169  71510 30384 975      83 974        syn-C2H3C(O)NH2, v=0
  565781.4604  0.0133 -3.4963 3  849.7373169  71510 30384 975      831074        syn-C2H3C(O)NH2, v=0
  565781.4604  0.0133 -3.4963 3  849.7373169  71510 303841075      83 974        syn-C2H3C(O)NH2, v=0
  565781.4604  0.0133 -5.5688 3  849.7373169  71510 303841075      831074        syn-C2H3C(O)NH2, v=0
  565835.1881  0.0182 -4.1640 3 1017.3065145  71510 303724131      724032        syn-C2H3C(O)NH2, v=0
  565835.1881  0.0182 -4.1640 3 1017.3065145  71510 303724132      724033        syn-C2H3C(O)NH2, v=0
  565896.0913  0.0032 -4.6305 3  416.1321109  71510 303541738      541441        syn-C2H3C(O)NH2, v=0
  565924.3296  0.0127 -5.5644 3  844.3784167  71510 303831073      821072        syn-C2H3C(O)NH2, v=0
  565924.3296  0.0127 -3.5140 3  844.3784167  71510 303831073      821172        syn-C2H3C(O)NH2, v=0
  565924.3296  0.0127 -5.5644 3  844.3784167  71510 303831173      821172        syn-C2H3C(O)NH2, v=0
  565924.3297  0.0127 -3.5140 3  844.3784167  71510 303831173      821072        syn-C2H3C(O)NH2, v=0
  565949.2531  0.0078 -5.4314 3  747.5525147  71510 303732053      722052        syn-C2H3C(O)NH2, v=0
  565958.3236  0.0025 -5.7553 3  119.9114 53  71510 303261511      261214        syn-C2H3C(O)NH2, v=0
  565958.6395  0.0025 -5.7553 3  119.9114 53  71510 303261512      261215        syn-C2H3C(O)NH2, v=0
  566075.3906  0.0697 -4.8956 3 1297.1010213  71510 303A6 898      A6 799        syn-C2H3C(O)NH2, v=0
  566075.3906  0.0697 -4.8956 3 1297.1010213  71510 303A6 998      A6 899        syn-C2H3C(O)NH2, v=0
  566102.4414  0.0014 -2.6717 3  250.9717 69  71510 303342311      332212        syn-C2H3C(O)NH2, v=0
  566102.4414  0.0014 -2.6717 3  250.9717 69  71510 303342312      332211        syn-C2H3C(O)NH2, v=0
  566137.1526  0.0120 -3.5331 3  838.4246165  71510 303821171      811270        syn-C2H3C(O)NH2, v=0
  566137.1527  0.0120 -5.5586 3  838.4246165  71510 303821271      811270        syn-C2H3C(O)NH2, v=0
  566137.1528  0.0120 -5.5586 3  838.4246165  71510 303821171      811170        syn-C2H3C(O)NH2, v=0
  566137.1530  0.0120 -3.5331 3  838.4246165  71510 303821271      811170        syn-C2H3C(O)NH2, v=0
  566172.6544  0.0179 -4.1392 3  999.7112143  71510 303714130      714031        syn-C2H3C(O)NH2, v=0
  566172.6544  0.0179 -4.1392 3  999.7112143  71510 303714131      714032        syn-C2H3C(O)NH2, v=0
  566175.6007  0.0071 -5.3809 3  722.7089145  71510 303721953      711952        syn-C2H3C(O)NH2, v=0
  566195.3013  0.0088 -3.7670 3  788.1232153  71510 303761759      751858        syn-C2H3C(O)NH2, v=0
  566240.0818  0.0013 -2.8284 3  287.2878 85  71510 303421924      411823        syn-C2H3C(O)NH2, v=0
  566240.0864  0.0013 -2.8284 3  287.2878 85  71510 303421923      411824        syn-C2H3C(O)NH2, v=0
  566345.6147  0.0037 -4.6145 3  458.5348115  71510 303571741      571444        syn-C2H3C(O)NH2, v=0
  566366.5210  0.0760 -5.9222 3 2020.2423229  71510 303B44371      B44272        syn-C2H3C(O)NH2, v=0
  566366.5210  0.0760 -5.9222 3 2020.2423229  71510 303B44372      B44273        syn-C2H3C(O)NH2, v=0
  566375.9915  0.0873 -5.2297 3 1541.9495227  71510 303B312A1      B311A2        syn-C2H3C(O)NH2, v=0
  566375.9915  0.0873 -5.2297 3 1541.9495227  71510 303B313A1      B312A2        syn-C2H3C(O)NH2, v=0
  566400.5285  0.0014 -2.7037 3  257.7509 73  71510 303362214      352115        syn-C2H3C(O)NH2, v=0
  566400.5285  0.0014 -2.7037 3  257.7509 73  71510 303362215      352114        syn-C2H3C(O)NH2, v=0
  566448.7649  0.0113 -3.5542 3  831.8521163  71510 303811269      801368        syn-C2H3C(O)NH2, v=0
  566448.7692  0.0113 -5.5514 3  831.8521163  71510 303811369      801368        syn-C2H3C(O)NH2, v=0
  566448.7729  0.0113 -5.5514 3  831.8521163  71510 303811269      801268        syn-C2H3C(O)NH2, v=0
  566448.7771  0.0113 -3.5542 3  831.8521163  71510 303811369      801268        syn-C2H3C(O)NH2, v=0
  566460.8836  0.0398 -5.1069 3 1581.2022197  71510 303984256      984157        syn-C2H3C(O)NH2, v=0
  566460.8836  0.0398 -5.1069 3 1581.2022197  71510 303984257      984158        syn-C2H3C(O)NH2, v=0
  566497.3552  0.0178 -4.1154 3  982.3647141  71510 303704129      704030        syn-C2H3C(O)NH2, v=0
  566497.3552  0.0178 -4.1154 3  982.3647141  71510 303704130      704031        syn-C2H3C(O)NH2, v=0
  566569.9037  0.0013 -2.7810 3  275.8785 81  71510 303402020      391921        syn-C2H3C(O)NH2, v=0
  566569.9037  0.0013 -2.7810 3  275.8785 81  71510 303402021      391920        syn-C2H3C(O)NH2, v=0
  566580.6203  0.0081 -5.5585 3  809.9883151  71510 303752353      742352        syn-C2H3C(O)NH2, v=0
  566581.5944  0.0013 -2.7398 3  266.0447 77  71510 303382117      372018        syn-C2H3C(O)NH2, v=0
  566581.5944  0.0013 -2.7398 3  266.0447 77  71510 303382118      372017        syn-C2H3C(O)NH2, v=0
  566615.6267  0.0015 -3.0626 3  343.7398 99  71510 303491633      481534        syn-C2H3C(O)NH2, v=0
  566648.2439  0.0022 -5.0365 3   83.1116 49  71510 303241113      23 816        syn-C2H3C(O)NH2, v=0
  566655.3099  0.0026 -5.7418 3   68.0122 47  71510 30323 915      22 418        syn-C2H3C(O)NH2, v=0
  566673.6520  0.0051 -5.4722 3  183.6280 79  71510 30339 633      39 336        syn-C2H3C(O)NH2, v=0
  566723.9728  0.0081 -5.5583 3  809.9949151  71510 303752352      742351        syn-C2H3C(O)NH2, v=0
  566735.6823  0.0051 -5.4721 3  183.6280 79  71510 30339 733      39 436        syn-C2H3C(O)NH2, v=0
  566798.4382  0.0041 -3.4124 3  466.6646117  71510 303581643      571542        syn-C2H3C(O)NH2, v=0
  566809.6627  0.0176 -4.0924 3  965.2667139  71510 303694128      694029        syn-C2H3C(O)NH2, v=0
  566809.6627  0.0176 -4.0924 3  965.2667139  71510 303694129      694030        syn-C2H3C(O)NH2, v=0
  566877.5804  0.0713 -4.7582 3 1028.3481197  71510 30398 395      98 296        syn-C2H3C(O)NH2, v=0
  566877.5804  0.0713 -4.7582 3 1028.3481197  71510 30398 495      98 396        syn-C2H3C(O)NH2, v=0
  566902.8734  0.0106 -3.5781 3  824.6299161  71510 303801367      791466        syn-C2H3C(O)NH2, v=0
  566902.9814  0.0106 -5.5426 3  824.6299161  71510 303801467      791466        syn-C2H3C(O)NH2, v=0
  566903.0685  0.0106 -5.5426 3  824.6299161  71510 303801367      791366        syn-C2H3C(O)NH2, v=0
  566903.1765  0.0106 -3.5781 3  824.6299161  71510 303801467      791366        syn-C2H3C(O)NH2, v=0
  566905.0424  0.0080 -5.4816 3  773.6626149  71510 303742153      732152        syn-C2H3C(O)NH2, v=0
  566960.9943  0.0043 -4.5656 3  116.1985 67  71510 30333 330      32 231        syn-C2H3C(O)NH2, v=0
  566961.5052  0.0043 -4.5656 3  116.1985 67  71510 30333 430      32 131        syn-C2H3C(O)NH2, v=0
  566972.9454  0.0089 -5.6971 3  871.9373153  71510 303762750      752749        syn-C2H3C(O)NH2, v=0
  566972.9835  0.0089 -5.6971 3  871.9373153  71510 303762749      752748        syn-C2H3C(O)NH2, v=0
  567109.9400  0.0174 -4.0705 3  948.4172137  71510 303684127      684028        syn-C2H3C(O)NH2, v=0
  567109.9400  0.0174 -4.0705 3  948.4172137  71510 303684128      684029        syn-C2H3C(O)NH2, v=0
  567125.0492  0.0026 -5.8633 3  113.5017 51  71510 303251510      251213        syn-C2H3C(O)NH2, v=0
  567125.1682  0.0026 -5.8633 3  113.5017 51  71510 303251511      251214        syn-C2H3C(O)NH2, v=0
  567160.9395  0.0035 -4.4505 3  131.7542 63  71510 303311121      30 822        syn-C2H3C(O)NH2, v=0
  567236.6394  0.0024 -4.8529 3  263.2753 85  71510 303421626      421329        syn-C2H3C(O)NH2, v=0
  567240.9853  0.0384 -5.0628 3 1557.0869195  71510 303974255      974156        syn-C2H3C(O)NH2, v=0
  567240.9853  0.0384 -5.0628 3 1557.0869195  71510 303974256      974157        syn-C2H3C(O)NH2, v=0
  567398.5417  0.0173 -4.0496 3  931.8158135  71510 303674126      674027        syn-C2H3C(O)NH2, v=0
  567398.5417  0.0173 -4.0496 3  931.8158135  71510 303674127      674028        syn-C2H3C(O)NH2, v=0
  567470.6748  0.0780 -5.0295 3  930.5828191  71510 30395 194      95 095        syn-C2H3C(O)NH2, v=0
  567470.6748  0.0780 -5.0295 3  930.5828191  71510 30395 294      95 195        syn-C2H3C(O)NH2, v=0
  567489.3741  0.0044 -4.6390 3  115.6135 61  71510 30330 921      29 624        syn-C2H3C(O)NH2, v=0
  567560.0331  0.0956 -5.3392 3 1612.0140231  71510 303B513A2      B512A3        syn-C2H3C(O)NH2, v=0
  567560.0331  0.0956 -5.3392 3 1612.0140231  71510 303B514A2      B513A3        syn-C2H3C(O)NH2, v=0
  567562.1678  0.0731 -5.8678 3 1992.0557227  71510 303B34370      B34271        syn-C2H3C(O)NH2, v=0
  567562.1678  0.0731 -5.8678 3 1992.0557227  71510 303B34371      B34272        syn-C2H3C(O)NH2, v=0
  567567.6193  0.0099 -3.6061 3  816.7154159  71510 303791465      781564        syn-C2H3C(O)NH2, v=0
  567569.8784  0.0099 -5.5320 3  816.7154159  71510 303791565      781564        syn-C2H3C(O)NH2, v=0
  567571.5794  0.0099 -5.5320 3  816.7153159  71510 303791465      781464        syn-C2H3C(O)NH2, v=0
  567573.8385  0.0099 -3.6061 3  816.7153159  71510 303791565      781464        syn-C2H3C(O)NH2, v=0
  567675.8142  0.0172 -4.0298 3  915.4625133  71510 303664125      664026        syn-C2H3C(O)NH2, v=0
  567675.8142  0.0172 -4.0298 3  915.4625133  71510 303664126      664027        syn-C2H3C(O)NH2, v=0
  567877.1325  0.0023 -4.4963 3  119.4174 61  71510 303301020      29 723        syn-C2H3C(O)NH2, v=0
  567891.9811  0.0738 -4.9787 3 1362.7445217  71510 303A8 999      A8 8A0        syn-C2H3C(O)NH2, v=0
  567891.9811  0.0738 -4.9787 3 1362.7445217  71510 303A81099      A8 9A0        syn-C2H3C(O)NH2, v=0
  567942.0957  0.0171 -4.0110 3  899.3571131  71510 303654124      654025        syn-C2H3C(O)NH2, v=0
  567942.0957  0.0171 -4.0110 3  899.3571131  71510 303654125      654026        syn-C2H3C(O)NH2, v=0
  567996.3340  0.0371 -5.0194 3 1533.2258193  71510 303964254      964155        syn-C2H3C(O)NH2, v=0
  567996.3340  0.0371 -5.0194 3 1533.2258193  71510 303964255      964156        syn-C2H3C(O)NH2, v=0
  568016.8834  0.0688 -4.7969 3 1191.5004207  71510 303A3 697      A3 598        syn-C2H3C(O)NH2, v=0
  568016.8834  0.0688 -4.7969 3 1191.5004207  71510 303A3 797      A3 698        syn-C2H3C(O)NH2, v=0
  568057.4416  0.0039 -4.9835 3  262.0429 91  71510 303451036      45 739        syn-C2H3C(O)NH2, v=0
  568197.7169  0.0171 -3.9934 3  883.4993129  71510 303644123      644024        syn-C2H3C(O)NH2, v=0
  568197.7169  0.0171 -3.9934 3  883.4993129  71510 303644124      644025        syn-C2H3C(O)NH2, v=0
  568218.3226  0.0082 -4.7604 3  622.2220133  71510 303662046      661749        syn-C2H3C(O)NH2, v=0
  568443.0007  0.0170 -3.9771 3  867.8891127  71510 303634122      634023        syn-C2H3C(O)NH2, v=0
  568443.0007  0.0170 -3.9771 3  867.8891127  71510 303634123      634024        syn-C2H3C(O)NH2, v=0
  568476.6122  0.0089 -5.6659 3  860.2608153  71510 303762651      752650        syn-C2H3C(O)NH2, v=0
  568477.0232  0.0089 -5.6659 3  860.2608153  71510 303762650      752649        syn-C2H3C(O)NH2, v=0
  568525.0647  0.0093 -3.6407 3  808.0485157  71510 303781563      771662        syn-C2H3C(O)NH2, v=0
  568562.5613  0.0042 -5.1130 3  234.6453 87  71510 30343 835      43 538        syn-C2H3C(O)NH2, v=0
  568563.6626  0.0093 -5.5193 3  808.0485157  71510 303781663      771662        syn-C2H3C(O)NH2, v=0
  568577.1119  0.1052 -5.4540 3 1683.3213235  71510 303B714A3      B713A4        syn-C2H3C(O)NH2, v=0
  568577.1119  0.1052 -5.4540 3 1683.3213235  71510 303B715A3      B714A4        syn-C2H3C(O)NH2, v=0
  568590.3739  0.0092 -5.5192 3  808.0463157  71510 303781563      771562        syn-C2H3C(O)NH2, v=0
  568628.9717  0.0092 -3.6405 3  808.0463157  71510 303781663      771562        syn-C2H3C(O)NH2, v=0
  568644.1812  0.0062 -5.3636 3  717.7806145  71510 303721854      711853        syn-C2H3C(O)NH2, v=0
  568644.9977  0.0046 -5.2715 3  208.5031 83  71510 30341 734      41 437        syn-C2H3C(O)NH2, v=0
  568678.2629  0.0170 -3.9620 3  852.5262125  71510 303624121      624022        syn-C2H3C(O)NH2, v=0
  568678.2629  0.0170 -3.9620 3  852.5262125  71510 303624122      624023        syn-C2H3C(O)NH2, v=0
  568691.0616  0.0031 -4.6442 3  402.4502107  71510 303531737      531440        syn-C2H3C(O)NH2, v=0
  568721.3075  0.0704 -5.8140 3 1964.1278225  71510 303B24369      B24270        syn-C2H3C(O)NH2, v=0
  568721.3075  0.0704 -5.8140 3 1964.1278225  71510 303B24370      B24271        syn-C2H3C(O)NH2, v=0
  568727.5171  0.0107 -5.9271 3  972.1369155  71510 303773344      763343        syn-C2H3C(O)NH2, v=0
  568727.5171  0.0107 -5.9271 3  972.1369155  71510 303773345      763344        syn-C2H3C(O)NH2, v=0
  568727.6378  0.0359 -4.9767 3 1509.6188191  71510 303954253      954154        syn-C2H3C(O)NH2, v=0
  568727.6378  0.0359 -4.9767 3 1509.6188191  71510 303954254      954155        syn-C2H3C(O)NH2, v=0
  568875.4123  0.0046 -5.2713 3  208.5031 83  71510 30341 834      41 537        syn-C2H3C(O)NH2, v=0
  568903.8122  0.0170 -3.9482 3  837.4104123  71510 303614120      614021        syn-C2H3C(O)NH2, v=0
  568903.8122  0.0170 -3.9482 3  837.4104123  71510 303614121      614022        syn-C2H3C(O)NH2, v=0
  569119.9501  0.0170 -3.9359 3  822.5417121  71510 303604119      604020        syn-C2H3C(O)NH2, v=0
  569119.9501  0.0170 -3.9359 3  822.5417121  71510 303604120      604021        syn-C2H3C(O)NH2, v=0
  569151.0992  0.0018 -3.2029 3  362.8668103  71510 303511536      501437        syn-C2H3C(O)NH2, v=0
  569181.1441  0.0023 -4.9470 3   89.2012 51  71510 303251115      24 816        syn-C2H3C(O)NH2, v=0
  569326.9718  0.0171 -3.9251 3  807.9199119  71510 303594118      594019        syn-C2H3C(O)NH2, v=0
  569326.9718  0.0171 -3.9251 3  807.9199119  71510 303594119      594020        syn-C2H3C(O)NH2, v=0
  569327.0255  0.0041 -5.1121 3  234.6453 87  71510 30343 935      43 638        syn-C2H3C(O)NH2, v=0
  569392.7905  0.0713 -4.7561 3 1088.8058201  71510 303A0 496      A0 397        syn-C2H3C(O)NH2, v=0
  569392.7905  0.0713 -4.7561 3 1088.8058201  71510 303A0 596      A0 497        syn-C2H3C(O)NH2, v=0
  569422.2825  0.1162 -5.5738 3 1755.8660239  71510 303B915A4      B914A5        syn-C2H3C(O)NH2, v=0
  569422.2825  0.1162 -5.5738 3 1755.8660239  71510 303B916A4      B915A5        syn-C2H3C(O)NH2, v=0
  569424.3518  0.0082 -5.5312 3  800.7827151  71510 303752254      742253        syn-C2H3C(O)NH2, v=0
  569435.5802  0.0348 -4.9346 3 1486.2655189  71510 303944252      944153        syn-C2H3C(O)NH2, v=0
  569435.5802  0.0348 -4.9346 3 1486.2655189  71510 303944253      944154        syn-C2H3C(O)NH2, v=0
  569486.8219  0.0120 -4.8164 3  717.7806143  71510 303712150      711853        syn-C2H3C(O)NH2, v=0
  569490.1838  0.0087 -3.6873 3  798.5441155  71510 303771661      761760        syn-C2H3C(O)NH2, v=0
  569491.2350  0.0105 -5.8892 3  957.2742155  71510 303773245      763244        syn-C2H3C(O)NH2, v=0
  569491.2350  0.0105 -5.8892 3  957.2742155  71510 303773246      763245        syn-C2H3C(O)NH2, v=0
  569525.1657  0.0171 -3.9160 3  793.5447117  71510 303584117      584018        syn-C2H3C(O)NH2, v=0
  569525.1657  0.0171 -3.9160 3  793.5447117  71510 303584118      584019        syn-C2H3C(O)NH2, v=0
  569559.6016  0.0789 -5.0700 3 1429.6512221  71510 303B010A0      B0 9A1        syn-C2H3C(O)NH2, v=0
  569559.6016  0.0789 -5.0700 3 1429.6512221  71510 303B011A0      B010A1        syn-C2H3C(O)NH2, v=0
  569678.1357  0.2684 -5.5317 3 1488.3845207  71510 303A32776      A22875        syn-C2H3C(O)NH2, v=0
  569714.8139  0.0172 -3.9086 3  779.4161115  71510 303574116      574017        syn-C2H3C(O)NH2, v=0
  569714.8139  0.0172 -3.9086 3  779.4161115  71510 303574117      574018        syn-C2H3C(O)NH2, v=0
  569775.1309  0.0073 -5.4544 3  768.8419151  71510 303751758      741757        syn-C2H3C(O)NH2, v=0
  569845.1054  0.0678 -5.7609 3 1936.4582223  71510 303B14368      B14269        syn-C2H3C(O)NH2, v=0
  569845.1054  0.0678 -5.7609 3 1936.4582223  71510 303B14369      B14270        syn-C2H3C(O)NH2, v=0
  569896.1922  0.0173 -3.9032 3  765.5339113  71510 303564115      564016        syn-C2H3C(O)NH2, v=0
  569896.1922  0.0173 -3.9032 3  765.5339113  71510 303564116      564017        syn-C2H3C(O)NH2, v=0
  569906.0214  0.0023 -4.8497 3  263.1862 85  71510 303421627      421330        syn-C2H3C(O)NH2, v=0
  570016.0505  0.0086 -5.5039 3  798.5441155  71510 303771761      761760        syn-C2H3C(O)NH2, v=0
  570069.5703  0.0174 -3.8999 3  751.8979111  71510 303554114      554015        syn-C2H3C(O)NH2, v=0
  570069.5703  0.0174 -3.8999 3  751.8979111  71510 303554115      554016        syn-C2H3C(O)NH2, v=0
  570079.7249  0.0014 -2.9695 3  326.5592 95  71510 303471731      461630        syn-C2H3C(O)NH2, v=0
  570090.1602  0.1287 -5.6983 3 1829.6427243  71510 303C116A5      C115A6        syn-C2H3C(O)NH2, v=0
  570090.1602  0.1287 -5.6983 3 1829.6427243  71510 303C117A5      C116A6        syn-C2H3C(O)NH2, v=0
  570120.8218  0.0337 -4.8932 3 1463.1657187  71510 303934251      934152        syn-C2H3C(O)NH2, v=0
  570120.8218  0.0337 -4.8932 3 1463.1657187  71510 303934252      934153        syn-C2H3C(O)NH2, v=0
  570125.2363  0.0711 -4.8599 3 1255.2041211  71510 303A5 798      A5 699        syn-C2H3C(O)NH2, v=0
  570125.2363  0.0711 -4.8599 3 1255.2041211  71510 303A5 898      A5 799        syn-C2H3C(O)NH2, v=0
  570131.2849  0.0014 -2.9694 3  326.5577 95  71510 303471730      461631        syn-C2H3C(O)NH2, v=0
  570144.6058  0.0043 -3.6513 3  232.9225 85  71510 303421032      41 933        syn-C2H3C(O)NH2, v=0
  570153.4491  0.0039 -3.7033 3  208.0067 81  71510 30340 931      39 832        syn-C2H3C(O)NH2, v=0
  570171.9844  0.0040 -4.6192 3  473.0987117  71510 303581742      581445        syn-C2H3C(O)NH2, v=0
  570182.7802  0.0015 -3.0903 3  356.1770101  71510 303501635      491534        syn-C2H3C(O)NH2, v=0
  570235.2120  0.0175 -3.8989 3  738.5081109  71510 303544113      544014        syn-C2H3C(O)NH2, v=0
  570235.2120  0.0175 -3.8989 3  738.5081109  71510 303544114      544015        syn-C2H3C(O)NH2, v=0
  570240.3535  0.0767 -4.8468 3  989.0540195  71510 30397 295      97 196        syn-C2H3C(O)NH2, v=0
  570240.3535  0.0767 -4.8468 3  989.0540195  71510 30397 395      97 296        syn-C2H3C(O)NH2, v=0
  570245.2679  0.0089 -5.6359 3  849.1723153  71510 303762552      752551        syn-C2H3C(O)NH2, v=0
  570249.2111  0.0089 -5.6359 3  849.1724153  71510 303762551      752550        syn-C2H3C(O)NH2, v=0
  570333.7952  0.0084 -5.5299 3  800.8299151  71510 303752253      742252        syn-C2H3C(O)NH2, v=0
  570335.6638  0.0103 -5.8525 3  942.9260155  71510 303773146      763145        syn-C2H3C(O)NH2, v=0
  570335.6638  0.0103 -5.8525 3  942.9260155  71510 303773147      763146        syn-C2H3C(O)NH2, v=0
  570341.7335  0.0086 -5.5034 3  798.5157155  71510 303771661      761660        syn-C2H3C(O)NH2, v=0
  570393.3753  0.0176 -3.9006 3  725.3642107  71510 303534112      534013        syn-C2H3C(O)NH2, v=0
  570393.3753  0.0176 -3.9006 3  725.3642107  71510 303534113      534014        syn-C2H3C(O)NH2, v=0
  570544.3124  0.0178 -3.9053 3  712.4662105  71510 303524111      524012        syn-C2H3C(O)NH2, v=0
  570544.3124  0.0178 -3.9053 3  712.4662105  71510 303524112      524013        syn-C2H3C(O)NH2, v=0
  570574.8686  0.1430 -5.8273 3 1904.6461247  71510 303C317A6      C316A7        syn-C2H3C(O)NH2, v=0
  570574.8686  0.1430 -5.8273 3 1904.6461247  71510 303C318A6      C317A7        syn-C2H3C(O)NH2, v=0
  570613.2222  0.0507 -5.0190 3  964.6694167  71510 303832261      831964        syn-C2H3C(O)NH2, v=0
  570633.9353  0.0040 -4.2918 3  129.3083 69  71510 30334 430      33 331        syn-C2H3C(O)NH2, v=0
  570639.6408  0.0040 -4.2918 3  129.3083 69  71510 30334 530      33 231        syn-C2H3C(O)NH2, v=0
  570688.2699  0.0179 -3.9134 3  699.8138103  71510 303514110      514011        syn-C2H3C(O)NH2, v=0
  570688.2699  0.0179 -3.9134 3  699.8138103  71510 303514111      514012        syn-C2H3C(O)NH2, v=0
  570740.0194  0.0079 -5.4261 3   87.6822 55  71510 30327 720      26 423        syn-C2H3C(O)NH2, v=0
  570784.0013  0.0326 -4.8525 3 1440.3190185  71510 303924250      924151        syn-C2H3C(O)NH2, v=0
  570784.0013  0.0326 -4.8525 3 1440.3190185  71510 303924251      924152        syn-C2H3C(O)NH2, v=0
  570821.8967  0.0033 -4.5399 3  123.8962 61  71510 303301120      29 821        syn-C2H3C(O)NH2, v=0
  570825.4889  0.0181 -3.9255 3  687.4070101  71510 3035041 9      504010        syn-C2H3C(O)NH2, v=0
  570825.4889  0.0181 -3.9255 3  687.4070101  71510 303504110      504011        syn-C2H3C(O)NH2, v=0
  570832.8231  0.0185 -4.8907 3  820.1366153  71510 303762254      761957        syn-C2H3C(O)NH2, v=0
  570867.6002  0.0086 -3.6852 3  798.5157155  71510 303771761      761660        syn-C2H3C(O)NH2, v=0
  570885.6337  0.0435 -4.9605 3  894.2231161  71510 303802159      801862        syn-C2H3C(O)NH2, v=0
  570893.1893  0.0017 -3.7251 3  203.0959 79  71510 303391129      38 830        syn-C2H3C(O)NH2, v=0
  570934.6741  0.0653 -5.7085 3 1909.0464221  71510 303B04367      B04268        syn-C2H3C(O)NH2, v=0
  570934.6741  0.0653 -5.7085 3 1909.0464221  71510 303B04368      B04269        syn-C2H3C(O)NH2, v=0
  570956.2051  0.0183 -3.9423 3  675.2456 99  71510 3034941 8      4940 9        syn-C2H3C(O)NH2, v=0
  570956.2051  0.0183 -3.9423 3  675.2456 99  71510 3034941 9      494010        syn-C2H3C(O)NH2, v=0
  571074.7710  0.0852 -5.1685 3 1497.8159225  71510 303B211A1      B210A2        syn-C2H3C(O)NH2, v=0
  571074.7710  0.0852 -5.1685 3 1497.8159225  71510 303B212A1      B211A2        syn-C2H3C(O)NH2, v=0
  571080.6488  0.0184 -3.9650 3  663.3295 97  71510 3034841 7      4840 8        syn-C2H3C(O)NH2, v=0
  571080.6488  0.0184 -3.9650 3  663.3295 97  71510 3034841 8      4840 9        syn-C2H3C(O)NH2, v=0
  571199.0452  0.0186 -3.9949 3  651.6586 95  71510 3034741 6      4740 7        syn-C2H3C(O)NH2, v=0
  571199.0452  0.0186 -3.9949 3  651.6586 95  71510 3034741 7      4740 8        syn-C2H3C(O)NH2, v=0
  571267.8915  0.0077 -5.4703 3  776.9164151  71510 303751957      741956        syn-C2H3C(O)NH2, v=0
  571275.6607  0.0101 -5.8170 3  929.0995155  71510 303773048      763047        syn-C2H3C(O)NH2, v=0
  571275.6608  0.0101 -5.8170 3  929.0995155  71510 303773047      763046        syn-C2H3C(O)NH2, v=0
  571311.6141  0.0188 -4.0341 3  640.2327 93  71510 3034641 5      4640 6        syn-C2H3C(O)NH2, v=0
  571311.6141  0.0188 -4.0341 3  640.2327 93  71510 3034641 6      4640 7        syn-C2H3C(O)NH2, v=0
  571372.4732  0.0047 -4.8312 3  332.4028101  71510 303501139      50 842        syn-C2H3C(O)NH2, v=0
  571418.5705  0.0190 -4.0858 3  629.0518 91  71510 3034541 4      4540 5        syn-C2H3C(O)NH2, v=0
  571418.5705  0.0190 -4.0858 3  629.0518 91  71510 3034541 5      4540 6        syn-C2H3C(O)NH2, v=0
  571425.7365  0.0316 -4.8125 3 1417.7253183  71510 303914249      914150        syn-C2H3C(O)NH2, v=0
  571425.7365  0.0316 -4.8125 3 1417.7253183  71510 303914250      914151        syn-C2H3C(O)NH2, v=0
  571488.8988  0.0034 -3.8439 3  170.2095 75  71510 30337 730      36 631        syn-C2H3C(O)NH2, v=0
  571520.1241  0.0193 -4.1557 3  618.1157 89  71510 3034441 3      4440 4        syn-C2H3C(O)NH2, v=0
  571520.1241  0.0193 -4.1557 3  618.1157 89  71510 3034441 4      4440 5        syn-C2H3C(O)NH2, v=0
  571611.7896  0.0174 -5.5998 3  884.4132179  71510 30389 584      88 583        syn-C2H3C(O)NH2, v=0
  571611.7896  0.0174 -3.4567 3  884.4132179  71510 30389 584      88 683        syn-C2H3C(O)NH2, v=0
  571611.7896  0.0174 -3.4567 3  884.4132179  71510 30389 684      88 583        syn-C2H3C(O)NH2, v=0
  571611.7896  0.0174 -5.5998 3  884.4132179  71510 30389 684      88 683        syn-C2H3C(O)NH2, v=0
  571611.8613  0.0184 -5.5986 3  887.0157181  71510 30390 486      89 485        syn-C2H3C(O)NH2, v=0
  571611.8613  0.0184 -3.4416 3  887.0157181  71510 30390 486      89 585        syn-C2H3C(O)NH2, v=0
  571611.8613  0.0184 -3.4416 3  887.0157181  71510 30390 586      89 485        syn-C2H3C(O)NH2, v=0
  571611.8613  0.0184 -5.5986 3  887.0157181  71510 30390 586      89 585        syn-C2H3C(O)NH2, v=0
  571616.4798  0.0195 -4.2540 3  607.4242 87  71510 3034341 2      4340 3        syn-C2H3C(O)NH2, v=0
  571616.4798  0.0195 -4.2540 3  607.4242 87  71510 3034341 3      4340 4        syn-C2H3C(O)NH2, v=0
  571619.3454  0.0197 -5.5963 3  889.0947183  71510 30391 388      90 387        syn-C2H3C(O)NH2, v=0
  571619.3454  0.0197 -3.4264 3  889.0947183  71510 30391 388      90 487        syn-C2H3C(O)NH2, v=0
  571619.3454  0.0197 -3.4264 3  889.0947183  71510 30391 488      90 387        syn-C2H3C(O)NH2, v=0
  571619.3454  0.0197 -5.5963 3  889.0947183  71510 30391 488      90 487        syn-C2H3C(O)NH2, v=0
  571623.4709  0.0166 -5.6000 3  881.2803177  71510 30388 682      87 681        syn-C2H3C(O)NH2, v=0
  571623.4709  0.0166 -3.4718 3  881.2803177  71510 30388 682      87 781        syn-C2H3C(O)NH2, v=0
  571623.4709  0.0166 -3.4718 3  881.2803177  71510 30388 782      87 681        syn-C2H3C(O)NH2, v=0
  571623.4709  0.0166 -5.6000 3  881.2803177  71510 30388 782      87 781        syn-C2H3C(O)NH2, v=0
  571628.9570  0.0081 -5.4863 3  788.1232153  71510 303761859      751858        syn-C2H3C(O)NH2, v=0
  571630.8426  0.0215 -5.5929 3  890.6561185  71510 30392 290      91 289        syn-C2H3C(O)NH2, v=0
  571630.8426  0.0215 -3.4111 3  890.6561185  71510 30392 290      91 389        syn-C2H3C(O)NH2, v=0
  571630.8426  0.0215 -3.4111 3  890.6561185  71510 30392 390      91 289        syn-C2H3C(O)NH2, v=0
  571630.8426  0.0215 -5.5929 3  890.6561185  71510 30392 390      91 389        syn-C2H3C(O)NH2, v=0
  571643.6612  0.0240 -5.5886 3  891.7048187  71510 30393 192      92 191        syn-C2H3C(O)NH2, v=0
  571643.6612  0.0240 -3.3955 3  891.7048187  71510 30393 192      92 291        syn-C2H3C(O)NH2, v=0
  571643.6612  0.0240 -3.3955 3  891.7048187  71510 30393 292      92 191        syn-C2H3C(O)NH2, v=0
  571643.6612  0.0240 -5.5886 3  891.7048187  71510 30393 292      92 291        syn-C2H3C(O)NH2, v=0
  571652.5169  0.0159 -5.5991 3  877.6090175  71510 30387 780      86 779        syn-C2H3C(O)NH2, v=0
  571652.5169  0.0159 -3.4872 3  877.6090175  71510 30387 780      86 879        syn-C2H3C(O)NH2, v=0
  571652.5169  0.0159 -3.4872 3  877.6090175  71510 30387 880      86 779        syn-C2H3C(O)NH2, v=0
  571652.5169  0.0159 -5.5991 3  877.6090175  71510 30387 880      86 879        syn-C2H3C(O)NH2, v=0
  571655.6487  0.0274 -5.5832 3  892.2451189  71510 30394 094      93 093        syn-C2H3C(O)NH2, v=0
  571655.6487  0.0274 -3.3797 3  892.2451189  71510 30394 094      93 193        syn-C2H3C(O)NH2, v=0
  571655.6487  0.0274 -3.3797 3  892.2451189  71510 30394 194      93 093        syn-C2H3C(O)NH2, v=0
  571655.6487  0.0274 -5.5832 3  892.2451189  71510 30394 194      93 193        syn-C2H3C(O)NH2, v=0
  571676.6208  0.0043 -5.3339 3  207.9842 79  71510 303391227      39 732        syn-C2H3C(O)NH2, v=0
  571706.2883  0.0152 -5.5971 3  873.3894173  71510 30386 878      85 877        syn-C2H3C(O)NH2, v=0
  571706.2883  0.0152 -3.5029 3  873.3894173  71510 30386 878      85 977        syn-C2H3C(O)NH2, v=0
  571706.2883  0.0152 -3.5029 3  873.3894173  71510 30386 978      85 877        syn-C2H3C(O)NH2, v=0
  571706.2883  0.0152 -5.5971 3  873.3894173  71510 30386 978      85 977        syn-C2H3C(O)NH2, v=0
  571707.8373  0.0197 -4.4037 3  596.9774 85  71510 3034241 1      4240 2        syn-C2H3C(O)NH2, v=0
  571707.8373  0.0197 -4.4037 3  596.9774 85  71510 3034241 2      4240 3        syn-C2H3C(O)NH2, v=0
  571725.5039  0.0047 -4.6624 3  431.1190113  71510 303561542      561245        syn-C2H3C(O)NH2, v=0
  571731.1512  0.0020 -2.5762 3  245.0230 55  71510 3032727 0      2626 1        syn-C2H3C(O)NH2, v=0
  571731.1512  0.0020 -2.5762 3  245.0230 55  71510 3032727 1      2626 0        syn-C2H3C(O)NH2, v=0
  571764.6229  0.0022 -4.9451 3   89.1151 51  71510 303251114      24 817        syn-C2H3C(O)NH2, v=0
  571775.7475  0.0719 -4.7847 3 1150.5508205  71510 303A2 597      A2 498        syn-C2H3C(O)NH2, v=0
  571775.7475  0.0719 -4.7847 3 1150.5508205  71510 303A2 697      A2 598        syn-C2H3C(O)NH2, v=0
  571794.3918  0.0199 -4.6787 3  586.7750 83  71510 3034141 0      4140 1        syn-C2H3C(O)NH2, v=0
  571794.3918  0.0199 -4.6787 3  586.7750 83  71510 3034141 1      4140 2        syn-C2H3C(O)NH2, v=0
  571794.6067  0.0145 -5.5938 3  868.6098171  71510 30385 976      84 975        syn-C2H3C(O)NH2, v=0
  571794.6067  0.0145 -3.5192 3  868.6098171  71510 30385 976      841075        syn-C2H3C(O)NH2, v=0
  571794.6067  0.0145 -3.5192 3  868.6098171  71510 303851076      84 975        syn-C2H3C(O)NH2, v=0
  571794.6067  0.0145 -5.5938 3  868.6098171  71510 303851076      841075        syn-C2H3C(O)NH2, v=0
  571915.8678  0.0029 -3.7557 3  184.2909 77  71510 30338 930      37 631        syn-C2H3C(O)NH2, v=0
  571930.8488  0.0138 -5.5893 3  863.2556169  71510 303841074      831073        syn-C2H3C(O)NH2, v=0
  571930.8488  0.0138 -3.5364 3  863.2556169  71510 303841074      831173        syn-C2H3C(O)NH2, v=0
  571930.8488  0.0138 -3.5364 3  863.2556169  71510 303841174      831073        syn-C2H3C(O)NH2, v=0
  571930.8488  0.0138 -5.5893 3  863.2556169  71510 303841174      831173        syn-C2H3C(O)NH2, v=0
  571991.0772  0.0630 -5.6567 3 1881.8923219  71510 303A94366      A94267        syn-C2H3C(O)NH2, v=0
  571991.0772  0.0630 -5.6567 3 1881.8923219  71510 303A94367      A94268        syn-C2H3C(O)NH2, v=0
  572046.6256  0.0307 -4.7732 3 1395.3843181  71510 303904248      904149        syn-C2H3C(O)NH2, v=0
  572046.6256  0.0307 -4.7732 3 1395.3843181  71510 303904249      904150        syn-C2H3C(O)NH2, v=0
  572092.4009  0.0744 -4.9346 3 1320.1808215  71510 303A7 899      A7 7A0        syn-C2H3C(O)NH2, v=0
  572092.4009  0.0744 -4.9346 3 1320.1808215  71510 303A7 999      A7 8A0        syn-C2H3C(O)NH2, v=0
  572133.7009  0.0131 -3.5549 3  857.3089167  71510 303831172      821271        syn-C2H3C(O)NH2, v=0
  572133.7010  0.0131 -5.5835 3  857.3089167  71510 303831272      821271        syn-C2H3C(O)NH2, v=0
  572133.7011  0.0131 -5.5835 3  857.3089167  71510 303831172      821171        syn-C2H3C(O)NH2, v=0
  572133.7011  0.0131 -3.5549 3  857.3089167  71510 303831272      821171        syn-C2H3C(O)NH2, v=0
  572168.6535  0.0018 -2.5980 3  246.3776 59  71510 3032926 3      2825 4        syn-C2H3C(O)NH2, v=0
  572168.6535  0.0018 -2.5980 3  246.3776 59  71510 3032926 4      2825 3        syn-C2H3C(O)NH2, v=0
  572192.1461  0.0024 -4.8614 3   95.5317 53  71510 303261116      25 817        syn-C2H3C(O)NH2, v=0
  572212.3074  0.0013 -2.8982 3  311.2445 91  71510 303451828      441727        syn-C2H3C(O)NH2, v=0
  572213.2886  0.0013 -2.8982 3  311.2445 91  71510 303451827      441728        syn-C2H3C(O)NH2, v=0
  572217.6516  0.0083 -5.5058 3  792.2940151  71510 303752155      742154        syn-C2H3C(O)NH2, v=0
  572330.2305  0.0100 -5.7826 3  915.8035155  71510 303772949      762948        syn-C2H3C(O)NH2, v=0
  572330.2310  0.0100 -5.7826 3  915.8035155  71510 303772948      762947        syn-C2H3C(O)NH2, v=0
  572364.5830  0.0090 -5.6067 3  838.7012153  71510 303762453      752452        syn-C2H3C(O)NH2, v=0
  572397.7516  0.0090 -5.6067 3  838.7026153  71510 303762452      752451        syn-C2H3C(O)NH2, v=0
  572430.1118  0.0123 -3.5751 3  850.7468165  71510 303821270      811369        syn-C2H3C(O)NH2, v=0
  572430.1141  0.0123 -5.5763 3  850.7468165  71510 303821370      811369        syn-C2H3C(O)NH2, v=0
  572430.1160  0.0123 -5.5763 3  850.7468165  71510 303821270      811269        syn-C2H3C(O)NH2, v=0
  572430.1183  0.0123 -3.5751 3  850.7468165  71510 303821370      811269        syn-C2H3C(O)NH2, v=0
  572433.7315  0.0925 -5.2734 3 1567.2338229  71510 303B412A2      B411A3        syn-C2H3C(O)NH2, v=0
  572433.7315  0.0925 -5.2734 3 1567.2338229  71510 303B413A2      B412A3        syn-C2H3C(O)NH2, v=0
  572521.7672  0.0030 -4.6611 3  389.0070105  71510 303521736      521439        syn-C2H3C(O)NH2, v=0
  572546.4941  0.0025 -3.6978 3  198.5326 79  71510 303391030      38 731        syn-C2H3C(O)NH2, v=0
  572593.3323  0.0017 -2.6219 3  249.1995 63  71510 3033125 6      3024 7        syn-C2H3C(O)NH2, v=0
  572593.3323  0.0017 -2.6219 3  249.1995 63  71510 3033125 7      3024 6        syn-C2H3C(O)NH2, v=0
  572647.2483  0.0298 -4.7346 3 1373.2956179  71510 303894247      894148        syn-C2H3C(O)NH2, v=0
  572647.2483  0.0298 -4.7346 3 1373.2956179  71510 303894248      894149        syn-C2H3C(O)NH2, v=0
  572860.5337  0.0116 -3.5980 3  843.5397163  71510 303811368      801467        syn-C2H3C(O)NH2, v=0
  572860.5933  0.0116 -5.5675 3  843.5397163  71510 303811468      801467        syn-C2H3C(O)NH2, v=0
  572860.6418  0.0116 -5.5675 3  843.5397163  71510 303811368      801367        syn-C2H3C(O)NH2, v=0
  572860.7013  0.0116 -3.5980 3  843.5397163  71510 303811468      801367        syn-C2H3C(O)NH2, v=0
  572864.8184  0.0023 -4.8908 3  252.6551 83  71510 303411625      411328        syn-C2H3C(O)NH2, v=0
  572883.1496  0.0760 -4.7919 3 1048.8217199  71510 30399 396      99 297        syn-C2H3C(O)NH2, v=0
  572883.1496  0.0760 -4.7919 3 1048.8217199  71510 30399 496      99 397        syn-C2H3C(O)NH2, v=0
  572968.0281  0.0015 -3.0868 3  356.1014101  71510 303501634      491535        syn-C2H3C(O)NH2, v=0
  572991.9478  0.0015 -2.6484 3  253.4969 67  71510 3033324 9      322310        syn-C2H3C(O)NH2, v=0
  572991.9478  0.0015 -2.6484 3  253.4969 67  71510 303332410      3223 9        syn-C2H3C(O)NH2, v=0
  573006.3232  0.0047 -4.6998 3  397.0187109  71510 303541441      541144        syn-C2H3C(O)NH2, v=0
  573015.3329  0.0607 -5.6056 3 1854.9953217  71510 303A84365      A84266        syn-C2H3C(O)NH2, v=0
  573015.3329  0.0607 -5.6056 3 1854.9953217  71510 303A84366      A84267        syn-C2H3C(O)NH2, v=0
  573023.9399  0.0036 -4.0990 3  142.6922 71  71510 30335 530      34 431        syn-C2H3C(O)NH2, v=0
  573073.2851  0.0036 -4.0989 3  142.6922 71  71510 30335 630      34 331        syn-C2H3C(O)NH2, v=0
  573228.1662  0.0290 -4.6967 3 1351.4591177  71510 303884246      884147        syn-C2H3C(O)NH2, v=0
  573228.1662  0.0290 -4.6967 3 1351.4591177  71510 303884247      884148        syn-C2H3C(O)NH2, v=0
  573245.3854  0.0013 -2.8400 3  297.6625 87  71510 303431925      421824        syn-C2H3C(O)NH2, v=0
  573245.3968  0.0013 -2.8400 3  297.6625 87  71510 303431924      421825        syn-C2H3C(O)NH2, v=0
  573343.5235  0.0015 -2.6778 3  259.2806 71  71510 303352312      342213        syn-C2H3C(O)NH2, v=0
  573343.5235  0.0015 -2.6778 3  259.2806 71  71510 303352313      342212        syn-C2H3C(O)NH2, v=0
  573362.9610  0.0031 -4.6223 3  116.3395 59  71510 303291119      28 820        syn-C2H3C(O)NH2, v=0
  573382.3661  0.0032 -3.8419 3  170.2086 75  71510 30337 830      36 531        syn-C2H3C(O)NH2, v=0
  573436.7144  0.0081 -5.4846 3  784.4410151  71510 303752056      742055        syn-C2H3C(O)NH2, v=0
  573481.6379  0.0829 -5.0611 3  950.0531193  71510 30396 195      96 096        syn-C2H3C(O)NH2, v=0
  573481.6379  0.0829 -5.0611 3  950.0531193  71510 30396 295      96 196        syn-C2H3C(O)NH2, v=0
  573487.9337  0.0109 -3.6246 3  835.6475161  71510 303801466      791565        syn-C2H3C(O)NH2, v=0
  573489.2159  0.0109 -5.5570 3  835.6475161  71510 303801566      791565        syn-C2H3C(O)NH2, v=0
  573490.1928  0.0109 -5.5570 3  835.6474161  71510 303801466      791465        syn-C2H3C(O)NH2, v=0
  573491.4750  0.0109 -3.6246 3  835.6474161  71510 303801566      791465        syn-C2H3C(O)NH2, v=0
  573524.2683  0.0099 -5.7495 3  903.0489155  71510 303772850      762849        syn-C2H3C(O)NH2, v=0
  573524.2747  0.0099 -5.7495 3  903.0489155  71510 303772849      762848        syn-C2H3C(O)NH2, v=0
  573615.0589  0.0014 -2.7109 3  266.5653 75  71510 303372215      362116        syn-C2H3C(O)NH2, v=0
  573615.0589  0.0014 -2.7109 3  266.5653 75  71510 303372216      362115        syn-C2H3C(O)NH2, v=0
  573632.4207  0.1011 -5.3841 3 1637.8996233  71510 303B613A3      B612A4        syn-C2H3C(O)NH2, v=0
  573632.4207  0.1011 -5.3841 3 1637.8996233  71510 303B614A3      B613A4        syn-C2H3C(O)NH2, v=0
  573641.0000  0.0036 -3.3661 3  451.6916115  71510 303571642      561541        syn-C2H3C(O)NH2, v=0
  573670.7726  0.0056 -3.5839 3  583.3314131  71510 303651749      641648        syn-C2H3C(O)NH2, v=0
  573676.0157  0.0034 -3.9544 3  156.3329 73  71510 30336 630      35 531        syn-C2H3C(O)NH2, v=0
  573677.6224  0.0013 -2.7908 3  285.7234 83  71510 303412022      401921        syn-C2H3C(O)NH2, v=0
  573677.6225  0.0013 -2.7908 3  285.7234 83  71510 303412021      401922        syn-C2H3C(O)NH2, v=0
  573754.3874  0.0013 -2.7482 3  275.3705 79  71510 303392118      382019        syn-C2H3C(O)NH2, v=0
  573754.3874  0.0013 -2.7482 3  275.3705 79  71510 303392119      382018        syn-C2H3C(O)NH2, v=0
  573789.9242  0.0282 -4.6595 3 1329.8745175  71510 303874245      874146        syn-C2H3C(O)NH2, v=0
  573789.9242  0.0282 -4.6595 3 1329.8745175  71510 303874246      874147        syn-C2H3C(O)NH2, v=0
  573915.4585  0.0787 -5.0190 3 1386.4254219  71510 303A9 9A0      A9 8A1        syn-C2H3C(O)NH2, v=0
  573915.4585  0.0787 -5.0190 3 1386.4254219  71510 303A910A0      A9 9A1        syn-C2H3C(O)NH2, v=0
  573967.0369  0.0094 -3.7689 3  807.1906155  71510 303771760      761859        syn-C2H3C(O)NH2, v=0
  573998.9856  0.0345 -4.9147 3  826.3361155  71510 303772057      771760        syn-C2H3C(O)NH2, v=0
  574008.4162  0.0585 -5.5551 3 1828.3551215  71510 303A74364      A74265        syn-C2H3C(O)NH2, v=0
  574008.4162  0.0585 -5.5551 3 1828.3551215  71510 303A74365      A74266        syn-C2H3C(O)NH2, v=0
  574016.5317  0.0034 -3.9540 3  156.3328 73  71510 30336 730      35 431        syn-C2H3C(O)NH2, v=0
  574024.1418  0.0735 -4.8340 3 1213.5782209  71510 303A4 698      A4 599        syn-C2H3C(O)NH2, v=0
  574024.1418  0.0735 -4.8340 3 1213.5782209  71510 303A4 798      A4 699        syn-C2H3C(O)NH2, v=0
  574029.7313  0.0025 -4.7799 3  102.1594 55  71510 303271117      26 818        syn-C2H3C(O)NH2, v=0
  574270.5734  0.0541 -5.0936 3 1037.6586173  71510 303862363      862066        syn-C2H3C(O)NH2, v=0
  574274.6287  0.2278 -5.3445 3 1400.9414201  71510 303A02674      992773        syn-C2H3C(O)NH2, v=0
  574305.8101  0.0033 -4.7395 3  350.6274 99  71510 303491732      491435        syn-C2H3C(O)NH2, v=0
  574333.0510  0.0275 -4.6231 3 1308.5416173  71510 303864244      864145        syn-C2H3C(O)NH2, v=0
  574333.0510  0.0275 -4.6231 3 1308.5416173  71510 303864245      864146        syn-C2H3C(O)NH2, v=0
  574365.3309  0.0255 -4.9878 3  929.2340163  71510 303812358      812061        syn-C2H3C(O)NH2, v=0
  574398.2004  0.0102 -3.6572 3  827.0137159  71510 303791564      781663        syn-C2H3C(O)NH2, v=0
  574408.9830  0.0022 -4.8890 3  252.6035 83  71510 303411626      411329        syn-C2H3C(O)NH2, v=0
  574414.0925  0.0351 -4.2390 3  931.4958165  71510 303822062      812161        syn-C2H3C(O)NH2, v=0
  574420.8641  0.0102 -5.5443 3  827.0137159  71510 303791664      781663        syn-C2H3C(O)NH2, v=0
  574436.7983  0.0102 -5.5443 3  827.0124159  71510 303791564      781563        syn-C2H3C(O)NH2, v=0
  574457.3924  0.0081 -5.4813 3  787.8476153  71510 303761759      751758        syn-C2H3C(O)NH2, v=0
  574459.4619  0.0102 -3.6571 3  827.0124159  71510 303791664      781563        syn-C2H3C(O)NH2, v=0
  574460.1762  0.0028 -4.7011 3  109.0935 57  71510 303281118      27 819        syn-C2H3C(O)NH2, v=0
  574666.4384  0.1111 -5.5001 3 1709.8081237  71510 303B814A4      B813A5        syn-C2H3C(O)NH2, v=0
  574666.4384  0.1111 -5.5001 3 1709.8081237  71510 303B815A4      B814A5        syn-C2H3C(O)NH2, v=0
  574675.0796  0.0067 -5.3887 3  736.7485147  71510 303731855      721854        syn-C2H3C(O)NH2, v=0
  574759.5332  0.0016 -3.1187 3  368.8632103  71510 303511636      501535        syn-C2H3C(O)NH2, v=0
  574853.3517  0.0047 -4.6432 3  466.3959117  71510 303581643      581346        syn-C2H3C(O)NH2, v=0
  574858.0601  0.0268 -4.5873 3 1287.4601171  71510 303854243      854144        syn-C2H3C(O)NH2, v=0
  574858.0601  0.0268 -4.5873 3 1287.4601171  71510 303854244      854145        syn-C2H3C(O)NH2, v=0
  574891.3550  0.0099 -5.7174 3  890.8494155  71510 303772751      762750        syn-C2H3C(O)NH2, v=0
  574891.4293  0.0099 -5.7174 3  890.8494155  71510 303772750      762749        syn-C2H3C(O)NH2, v=0
  574926.7140  0.0091 -5.5785 3  828.8874153  71510 303762354      752353        syn-C2H3C(O)NH2, v=0
  574971.2622  0.0564 -5.5053 3 1801.9714213  71510 303A64363      A64264        syn-C2H3C(O)NH2, v=0
  574971.2622  0.0564 -5.5053 3 1801.9714213  71510 303A64364      A64265        syn-C2H3C(O)NH2, v=0
  575161.1009  0.0026 -5.8945 3   56.5161 37  71510 3031812 7      17 9 8        syn-C2H3C(O)NH2, v=0
  575161.5900  0.0026 -5.8945 3   56.5161 37  71510 3031812 6      17 9 9        syn-C2H3C(O)NH2, v=0
  575166.3525  0.0092 -5.5782 3  828.8988153  71510 303762353      752352        syn-C2H3C(O)NH2, v=0
  575365.4500  0.0261 -4.5523 3 1266.6299169  71510 303844242      844143        syn-C2H3C(O)NH2, v=0
  575365.4500  0.0261 -4.5523 3 1266.6299169  71510 303844243      844144        syn-C2H3C(O)NH2, v=0
  575393.4085  0.0229 -5.1216 3 1067.6140175  71510 303872463      872166        syn-C2H3C(O)NH2, v=0
  575397.0833  0.0760 -4.7910 3 1109.8812203  71510 303A1 497      A1 398        syn-C2H3C(O)NH2, v=0
  575397.0833  0.0760 -4.7910 3 1109.8812203  71510 303A1 597      A1 498        syn-C2H3C(O)NH2, v=0
  575458.8409  0.0304 -5.1457 3 1090.3322177  71510 303882464      882167        syn-C2H3C(O)NH2, v=0
  575474.3182  0.0095 -3.7002 3  817.5578157  71510 303781662      771761        syn-C2H3C(O)NH2, v=0
  575531.0097  0.1225 -5.6211 3 1782.9542241  71510 303C015A5      C014A6        syn-C2H3C(O)NH2, v=0
  575531.0097  0.1225 -5.6211 3 1782.9542241  71510 303C016A5      C015A6        syn-C2H3C(O)NH2, v=0
  575591.2713  0.0840 -5.1116 3 1453.9332223  71510 303B110A1      B1 9A2        syn-C2H3C(O)NH2, v=0
  575591.2713  0.0840 -5.1116 3 1453.9332223  71510 303B111A1      B110A2        syn-C2H3C(O)NH2, v=0
  575796.1986  0.0095 -5.5292 3  817.5578157  71510 303781762      771761        syn-C2H3C(O)NH2, v=0
  575855.7056  0.0255 -4.5180 3 1246.0505167  71510 303834241      834142        syn-C2H3C(O)NH2, v=0
  575855.7056  0.0255 -4.5180 3 1246.0505167  71510 303834242      834143        syn-C2H3C(O)NH2, v=0
  575904.7684  0.0545 -5.4562 3 1775.8439211  71510 303A54362      A54263        syn-C2H3C(O)NH2, v=0
  575904.7684  0.0545 -5.4562 3 1775.8439211  71510 303A54363      A54264        syn-C2H3C(O)NH2, v=0
  576000.1849  0.0095 -5.5289 3  817.5403157  71510 303781662      771661        syn-C2H3C(O)NH2, v=0
  576031.6719  0.0047 -4.7151 3  437.0469111  71510 303551837      551540        syn-C2H3C(O)NH2, v=0
  576083.0147  0.0042 -4.6293 3  487.8684119  71510 303591743      591446        syn-C2H3C(O)NH2, v=0
  576083.9132  0.0079 -5.3980 3  741.5945147  71510 303731954      721953        syn-C2H3C(O)NH2, v=0
  576135.5025  0.0759 -4.8982 3 1277.8832213  71510 303A6 799      A6 6A0        syn-C2H3C(O)NH2, v=0
  576135.5025  0.0759 -4.8982 3 1277.8832213  71510 303A6 899      A6 7A0        syn-C2H3C(O)NH2, v=0
  576220.9422  0.1354 -5.7469 3 1857.3325245  71510 303C216A6      C215A7        syn-C2H3C(O)NH2, v=0
  576220.9422  0.1354 -5.7469 3 1857.3325245  71510 303C217A6      C216A7        syn-C2H3C(O)NH2, v=0
  576247.5258  0.0817 -4.8797 3 1009.1265197  71510 30398 296      98 197        syn-C2H3C(O)NH2, v=0
  576247.5258  0.0817 -4.8797 3 1009.1265197  71510 30398 396      98 297        syn-C2H3C(O)NH2, v=0
  576322.0653  0.0095 -3.6988 3  817.5403157  71510 303781762      771661        syn-C2H3C(O)NH2, v=0
  576329.2983  0.0250 -4.4845 3 1225.7220165  71510 303824240      824141        syn-C2H3C(O)NH2, v=0
  576329.2983  0.0250 -4.4845 3 1225.7220165  71510 303824241      824142        syn-C2H3C(O)NH2, v=0
  576478.3691  0.0099 -5.6864 3  879.2231155  71510 303772652      762651        syn-C2H3C(O)NH2, v=0
  576479.1419  0.0099 -5.6864 3  879.2231155  71510 303772651      762650        syn-C2H3C(O)NH2, v=0
  576518.7662  0.0014 -2.9879 3  338.3155 97  71510 303481732      471631        syn-C2H3C(O)NH2, v=0
  576618.1390  0.0014 -2.9878 3  338.3127 97  71510 303481731      471632        syn-C2H3C(O)NH2, v=0
  576672.6587  0.0091 -5.4475 3  766.4305149  71510 303742054      732053        syn-C2H3C(O)NH2, v=0
  576702.1355  0.0093 -5.4995 3  792.5725151  71510 303752154      742153        syn-C2H3C(O)NH2, v=0
  576730.5773  0.1501 -5.8771 3 1932.9377249  71510 303C417A7      C416A8        syn-C2H3C(O)NH2, v=0
  576730.5773  0.1501 -5.8771 3 1932.9377249  71510 303C418A7      C417A8        syn-C2H3C(O)NH2, v=0
  576758.5219  0.0021 -4.8587 3   95.3796 53  71510 303261115      25 818        syn-C2H3C(O)NH2, v=0
  576765.2470  0.0044 -4.7530 3  364.1086105  71510 303521340      521043        syn-C2H3C(O)NH2, v=0
  576786.6867  0.0244 -4.4517 3 1205.6439163  71510 303814239      814140        syn-C2H3C(O)NH2, v=0
  576786.6867  0.0244 -4.4517 3 1205.6439163  71510 303814240      814141        syn-C2H3C(O)NH2, v=0
  576809.7968  0.0526 -5.4077 3 1749.9722209  71510 303A44361      A44262        syn-C2H3C(O)NH2, v=0
  576809.7968  0.0526 -5.4077 3 1749.9722209  71510 303A44362      A44263        syn-C2H3C(O)NH2, v=0
  577021.4369  0.0028 -5.6169 3   73.6368 49  71510 30324 916      23 419        syn-C2H3C(O)NH2, v=0
  577116.4611  0.0904 -5.2114 3 1522.6989227  71510 303B311A2      B310A3        syn-C2H3C(O)NH2, v=0
  577116.4611  0.0904 -5.2114 3 1522.6989227  71510 303B312A2      B311A3        syn-C2H3C(O)NH2, v=0
  577116.8000  0.0029 -4.6808 3  375.8102103  71510 303511735      511438        syn-C2H3C(O)NH2, v=0
  577173.3488  0.0115 -5.9095 3  976.2704157  71510 303783246      773245        syn-C2H3C(O)NH2, v=0
  577173.3488  0.0115 -5.9095 3  976.2704157  71510 303783247      773246        syn-C2H3C(O)NH2, v=0
  577228.3171  0.0240 -4.4197 3 1185.8162161  71510 303804238      804139        syn-C2H3C(O)NH2, v=0
  577228.3171  0.0240 -4.4197 3 1185.8162161  71510 303804239      804140        syn-C2H3C(O)NH2, v=0
  577488.3611  0.0089 -5.5115 3  807.1906155  71510 303771860      761859        syn-C2H3C(O)NH2, v=0
  577634.7872  0.0189 -5.6257 3  903.4801181  71510 30390 585      89 584        syn-C2H3C(O)NH2, v=0
  577634.7872  0.0189 -3.4817 3  903.4801181  71510 30390 585      89 684        syn-C2H3C(O)NH2, v=0
  577634.7872  0.0189 -3.4817 3  903.4801181  71510 30390 685      89 584        syn-C2H3C(O)NH2, v=0
  577634.7872  0.0189 -5.6257 3  903.4801181  71510 30390 685      89 684        syn-C2H3C(O)NH2, v=0
  577635.6174  0.0199 -5.6245 3  906.0826183  71510 30391 487      90 486        syn-C2H3C(O)NH2, v=0
  577635.6174  0.0199 -3.4668 3  906.0826183  71510 30391 487      90 586        syn-C2H3C(O)NH2, v=0
  577635.6174  0.0199 -3.4668 3  906.0826183  71510 30391 587      90 486        syn-C2H3C(O)NH2, v=0
  577635.6174  0.0199 -5.6245 3  906.0826183  71510 30391 587      90 586        syn-C2H3C(O)NH2, v=0
  577643.5501  0.0214 -5.6223 3  908.1619185  71510 30392 389      91 388        syn-C2H3C(O)NH2, v=0
  577643.5501  0.0214 -3.4519 3  908.1619185  71510 30392 389      91 488        syn-C2H3C(O)NH2, v=0
  577643.5501  0.0214 -3.4519 3  908.1619185  71510 30392 489      91 388        syn-C2H3C(O)NH2, v=0
  577643.5501  0.0214 -5.6223 3  908.1619185  71510 30392 489      91 488        syn-C2H3C(O)NH2, v=0
  577645.2576  0.0180 -5.6258 3  900.3477179  71510 30389 683      88 682        syn-C2H3C(O)NH2, v=0
  577645.2576  0.0180 -3.4965 3  900.3477179  71510 30389 683      88 782        syn-C2H3C(O)NH2, v=0
  577645.2576  0.0180 -3.4965 3  900.3477179  71510 30389 783      88 682        syn-C2H3C(O)NH2, v=0
  577645.2576  0.0180 -5.6258 3  900.3477179  71510 30389 783      88 782        syn-C2H3C(O)NH2, v=0
  577654.6242  0.0235 -4.3885 3 1166.2385159  71510 303794237      794138        syn-C2H3C(O)NH2, v=0
  577654.6242  0.0235 -4.3885 3 1166.2385159  71510 303794238      794139        syn-C2H3C(O)NH2, v=0
  577655.2862  0.0233 -5.6190 3  909.7236187  71510 30393 291      92 290        syn-C2H3C(O)NH2, v=0
  577655.2862  0.0233 -3.4368 3  909.7236187  71510 30393 291      92 390        syn-C2H3C(O)NH2, v=0
  577655.2862  0.0233 -3.4368 3  909.7236187  71510 30393 391      92 290        syn-C2H3C(O)NH2, v=0
  577655.2862  0.0233 -5.6190 3  909.7236187  71510 30393 391      92 390        syn-C2H3C(O)NH2, v=0
  577668.2048  0.0260 -5.6147 3  910.7728189  71510 30394 193      93 192        syn-C2H3C(O)NH2, v=0
  577668.2048  0.0260 -3.4215 3  910.7728189  71510 30394 193      93 292        syn-C2H3C(O)NH2, v=0
  577668.2048  0.0260 -3.4215 3  910.7728189  71510 30394 293      93 192        syn-C2H3C(O)NH2, v=0
  577668.2048  0.0260 -5.6147 3  910.7728189  71510 30394 293      93 292        syn-C2H3C(O)NH2, v=0
  577672.4354  0.0172 -5.6248 3  896.6773177  71510 30388 781      87 780        syn-C2H3C(O)NH2, v=0
  577672.4354  0.0172 -3.5115 3  896.6773177  71510 30388 781      87 880        syn-C2H3C(O)NH2, v=0
  577672.4354  0.0172 -3.5115 3  896.6773177  71510 30388 881      87 780        syn-C2H3C(O)NH2, v=0
  577672.4354  0.0172 -5.6248 3  896.6773177  71510 30388 881      87 880        syn-C2H3C(O)NH2, v=0
  577680.2036  0.0295 -5.6094 3  911.3135191  71510 30395 095      94 094        syn-C2H3C(O)NH2, v=0
  577680.2036  0.0295 -3.4058 3  911.3135191  71510 30395 095      94 194        syn-C2H3C(O)NH2, v=0
  577680.2036  0.0295 -3.4058 3  911.3135191  71510 30395 195      94 094        syn-C2H3C(O)NH2, v=0
  577680.2036  0.0295 -5.6094 3  911.3135191  71510 30395 195      94 194        syn-C2H3C(O)NH2, v=0
  577683.5228  0.0067 -5.0188 3  104.6268 59  71510 30329 821      28 524        syn-C2H3C(O)NH2, v=0
  577687.1763  0.0508 -5.3598 3 1724.3560207  71510 303A34360      A34261        syn-C2H3C(O)NH2, v=0
  577687.1763  0.0508 -5.3598 3 1724.3560207  71510 303A34361      A34262        syn-C2H3C(O)NH2, v=0
  577713.2112  0.0128 -3.8926 3  834.7330157  71510 303781860      771959        syn-C2H3C(O)NH2, v=0
  577723.3838  0.0165 -5.6227 3  892.4595175  71510 30387 879      86 878        syn-C2H3C(O)NH2, v=0
  577723.3838  0.0165 -3.5269 3  892.4595175  71510 30387 879      86 978        syn-C2H3C(O)NH2, v=0
  577723.3838  0.0165 -3.5269 3  892.4595175  71510 30387 979      86 878        syn-C2H3C(O)NH2, v=0
  577723.3838  0.0165 -5.6227 3  892.4595175  71510 30387 979      86 978        syn-C2H3C(O)NH2, v=0
  577724.4465  0.0071 -3.7285 3  749.9830149  71510 303741857      731756        syn-C2H3C(O)NH2, v=0
  577740.1702  0.0022 -4.9317 3  242.3208 81  71510 303401624      401327        syn-C2H3C(O)NH2, v=0
  577780.0439  0.0768 -4.8210 3 1172.2277207  71510 303A3 598      A3 499        syn-C2H3C(O)NH2, v=0
  577780.0439  0.0768 -4.8210 3 1172.2277207  71510 303A3 698      A3 599        syn-C2H3C(O)NH2, v=0
  577807.4823  0.0157 -5.6194 3  887.6828173  71510 30386 977      85 976        syn-C2H3C(O)NH2, v=0
  577807.4823  0.0157 -3.5428 3  887.6828173  71510 30386 977      851076        syn-C2H3C(O)NH2, v=0
  577807.4823  0.0157 -3.5428 3  887.6828173  71510 303861077      85 976        syn-C2H3C(O)NH2, v=0
  577807.4823  0.0157 -5.6194 3  887.6828173  71510 303861077      851076        syn-C2H3C(O)NH2, v=0
  577836.9663  0.0085 -5.4942 3  795.9718153  71510 303761958      751957        syn-C2H3C(O)NH2, v=0
  577870.1890  0.0092 -5.5514 3  819.7767153  71510 303762255      752254        syn-C2H3C(O)NH2, v=0
  577937.4369  0.0150 -5.6149 3  882.3332171  71510 303851075      841074        syn-C2H3C(O)NH2, v=0
  577937.4369  0.0150 -3.5594 3  882.3332171  71510 303851075      841174        syn-C2H3C(O)NH2, v=0
  577937.4369  0.0150 -3.5594 3  882.3332171  71510 303851175      841074        syn-C2H3C(O)NH2, v=0
  577937.4369  0.0150 -5.6149 3  882.3332171  71510 303851175      841174        syn-C2H3C(O)NH2, v=0
  578037.2220  0.0075 -3.7360 3  768.8419151  71510 303751858      741757        syn-C2H3C(O)NH2, v=0
  578055.2458  0.0113 -5.8730 3  961.9504157  71510 303783147      773146        syn-C2H3C(O)NH2, v=0
  578055.2458  0.0113 -5.8730 3  961.9504157  71510 303783148      773147        syn-C2H3C(O)NH2, v=0
  578066.0313  0.0231 -4.3581 3 1146.9108157  71510 303784236      784137        syn-C2H3C(O)NH2, v=0
  578066.0313  0.0231 -4.3581 3 1146.9108157  71510 303784237      784138        syn-C2H3C(O)NH2, v=0
  578107.1826  0.0793 -4.9742 3 1343.4609217  71510 303A8 8A0      A8 7A1        syn-C2H3C(O)NH2, v=0
  578107.1826  0.0793 -4.9742 3 1343.4609217  71510 303A8 9A0      A8 8A1        syn-C2H3C(O)NH2, v=0
  578130.8820  0.0142 -3.5773 3  876.3932169  71510 303841173      831272        syn-C2H3C(O)NH2, v=0
  578130.8821  0.0142 -5.6090 3  876.3932169  71510 303841173      831172        syn-C2H3C(O)NH2, v=0
  578130.8821  0.0142 -3.5773 3  876.3932169  71510 303841273      831172        syn-C2H3C(O)NH2, v=0
  578130.8821  0.0142 -5.6090 3  876.3932169  71510 303841273      831272        syn-C2H3C(O)NH2, v=0
  578352.5382  0.0099 -5.6564 3  868.1936155  71510 303772553      762552        syn-C2H3C(O)NH2, v=0
  578359.6634  0.0099 -5.6564 3  868.1939155  71510 303772552      762551        syn-C2H3C(O)NH2, v=0
  578413.0481  0.0134 -3.5968 3  869.8411167  71510 303831271      821370        syn-C2H3C(O)NH2, v=0
  578413.0493  0.0134 -5.6018 3  869.8411167  71510 303831371      821370        syn-C2H3C(O)NH2, v=0
  578413.0504  0.0134 -5.6018 3  869.8411167  71510 303831271      821270        syn-C2H3C(O)NH2, v=0
  578413.0516  0.0134 -3.5968 3  869.8411167  71510 303831371      821270        syn-C2H3C(O)NH2, v=0
  578462.9512  0.0227 -4.3285 3 1127.8327155  71510 303774235      774136        syn-C2H3C(O)NH2, v=0
  578462.9512  0.0227 -4.3285 3 1127.8327155  71510 303774236      774137        syn-C2H3C(O)NH2, v=0
  578487.3854  0.0981 -5.3175 3 1592.7178231  71510 303B512A3      B511A4        syn-C2H3C(O)NH2, v=0
  578487.3854  0.0981 -5.3175 3 1592.7178231  71510 303B513A3      B512A4        syn-C2H3C(O)NH2, v=0
  578496.9071  0.0017 -3.1505 3  381.8516105  71510 303521637      511536        syn-C2H3C(O)NH2, v=0
  578537.7045  0.0491 -5.3126 3 1698.9951205  71510 303A24359      A24260        syn-C2H3C(O)NH2, v=0
  578537.7045  0.0491 -5.3126 3 1698.9951205  71510 303A24360      A24261        syn-C2H3C(O)NH2, v=0
  578593.7703  0.0031 -3.3177 3  437.0469113  71510 303561641      551540        syn-C2H3C(O)NH2, v=0
  578609.9106  0.0022 -4.9306 3  242.2917 81  71510 303401625      401328        syn-C2H3C(O)NH2, v=0
  578800.5542  0.0256 -4.8779 3  761.0227149  71510 303741955      741658        syn-C2H3C(O)NH2, v=0
  578805.8089  0.1860 -5.1560 3 1316.1318195  71510 303972572      962671        syn-C2H3C(O)NH2, v=0
  578821.4490  0.0127 -3.6187 3  862.6483165  71510 303821369      811468        syn-C2H3C(O)NH2, v=0
  578821.4817  0.0127 -5.5930 3  862.6483165  71510 303821469      811468        syn-C2H3C(O)NH2, v=0
  578821.5085  0.0127 -5.5930 3  862.6483165  71510 303821369      811368        syn-C2H3C(O)NH2, v=0
  578821.5412  0.0127 -3.6187 3  862.6483165  71510 303821469      811368        syn-C2H3C(O)NH2, v=0
  578845.7860  0.0223 -4.2997 3 1109.0042153  71510 303764234      764135        syn-C2H3C(O)NH2, v=0
  578845.7860  0.0223 -4.2997 3 1109.0042153  71510 303764235      764136        syn-C2H3C(O)NH2, v=0
  578887.6857  0.0810 -4.8262 3 1069.4962201  71510 303A0 397      A0 298        syn-C2H3C(O)NH2, v=0
  578887.6857  0.0810 -4.8262 3 1069.4962201  71510 303A0 497      A0 398        syn-C2H3C(O)NH2, v=0
  579000.8574  0.0014 -2.9130 3  322.4254 93  71510 303461829      451728        syn-C2H3C(O)NH2, v=0
  579002.9541  0.0014 -2.9130 3  322.4254 93  71510 303461828      451729        syn-C2H3C(O)NH2, v=0
  579004.3723  0.0020 -2.5803 3  251.5913 57  71510 3032827 1      2726 2        syn-C2H3C(O)NH2, v=0
  579004.3723  0.0020 -2.5803 3  251.5913 57  71510 3032827 2      2726 1        syn-C2H3C(O)NH2, v=0
  579038.2719  0.0112 -5.8376 3  948.1552157  71510 303783049      773048        syn-C2H3C(O)NH2, v=0
  579038.2720  0.0112 -5.8376 3  948.1552157  71510 303783048      773047        syn-C2H3C(O)NH2, v=0
  579214.9281  0.0220 -4.2718 3 1090.4249151  71510 303754233      754134        syn-C2H3C(O)NH2, v=0
  579214.9281  0.0220 -4.2718 3 1090.4249151  71510 303754234      754135        syn-C2H3C(O)NH2, v=0
  579302.2092  0.0096 -5.5495 3  819.8541153  71510 303762254      752253        syn-C2H3C(O)NH2, v=0
  579313.8857  0.0071 -3.7216 3  731.2627147  71510 303731856      721755        syn-C2H3C(O)NH2, v=0
  579362.1493  0.0474 -5.2661 3 1673.8890203  71510 303A14358      A14259        syn-C2H3C(O)NH2, v=0
  579362.1493  0.0474 -5.2661 3 1673.8890203  71510 303A14359      A14260        syn-C2H3C(O)NH2, v=0
  579400.6926  0.0089 -5.5082 3  807.0094155  71510 303771760      761759        syn-C2H3C(O)NH2, v=0
  579414.1593  0.0119 -3.6441 3  854.7771163  71510 303811467      801566        syn-C2H3C(O)NH2, v=0
  579414.8835  0.0119 -5.5825 3  854.7771163  71510 303811567      801566        syn-C2H3C(O)NH2, v=0
  579415.4415  0.0119 -5.5825 3  854.7770163  71510 303811467      801466        syn-C2H3C(O)NH2, v=0
  579416.1656  0.0119 -3.6441 3  854.7770163  71510 303811567      801466        syn-C2H3C(O)NH2, v=0
  579439.0142  0.0018 -2.6026 3  253.4390 61  71510 3033026 4      2925 5        syn-C2H3C(O)NH2, v=0
  579439.0142  0.0018 -2.6026 3  253.4390 61  71510 3033026 5      2925 4        syn-C2H3C(O)NH2, v=0
  579467.2690  0.0015 -3.1131 3  368.7368103  71510 303511635      501536        syn-C2H3C(O)NH2, v=0
  579491.7936  0.0881 -5.0932 3  969.7243195  71510 30397 196      97 097        syn-C2H3C(O)NH2, v=0
  579491.7936  0.0881 -5.0932 3  969.7243195  71510 30397 296      97 197        syn-C2H3C(O)NH2, v=0
  579570.7601  0.0217 -4.2447 3 1072.0947149  71510 303744232      744133        syn-C2H3C(O)NH2, v=0
  579570.7601  0.0217 -4.2447 3 1072.0947149  71510 303744233      744134        syn-C2H3C(O)NH2, v=0
  579700.1104  0.1070 -5.4295 3 1663.9846235  71510 303B713A4      B712A5        syn-C2H3C(O)NH2, v=0
  579700.1104  0.1070 -5.4295 3 1663.9846235  71510 303B714A4      B713A5        syn-C2H3C(O)NH2, v=0
  579778.1506  0.0072 -5.4160 3  755.9176149  71510 303741856      731855        syn-C2H3C(O)NH2, v=0
  579857.4539  0.0016 -2.6271 3  256.7564 65  71510 3033225 7      3124 8        syn-C2H3C(O)NH2, v=0
  579857.4539  0.0016 -2.6271 3  256.7564 65  71510 3033225 8      3124 7        syn-C2H3C(O)NH2, v=0
  579888.9253  0.0021 -3.2429 3  375.8102105  71510 303521537      511438        syn-C2H3C(O)NH2, v=0
  579891.0481  0.0080 -3.7446 3  787.8476153  71510 303761859      751758        syn-C2H3C(O)NH2, v=0
  579913.6554  0.0215 -4.2185 3 1054.0134147  71510 303734231      734132        syn-C2H3C(O)NH2, v=0
  579913.6554  0.0215 -4.2185 3 1054.0134147  71510 303734232      734133        syn-C2H3C(O)NH2, v=0
  579936.3431  0.0837 -5.0599 3 1410.3066221  71510 303B0 9A1      B0 8A2        syn-C2H3C(O)NH2, v=0
  579936.3431  0.0837 -5.0599 3 1410.3066221  71510 303B010A1      B0 9A2        syn-C2H3C(O)NH2, v=0
  580029.7780  0.0784 -4.8715 3 1235.8564211  71510 303A5 699      A5 5A0        syn-C2H3C(O)NH2, v=0
  580029.7780  0.0784 -4.8715 3 1235.8564211  71510 303A5 799      A5 6A0        syn-C2H3C(O)NH2, v=0
  580142.9220  0.0111 -5.8035 3  934.8944157  71510 303782950      772949        syn-C2H3C(O)NH2, v=0
  580142.9230  0.0111 -5.8035 3  934.8944157  71510 303782949      772948        syn-C2H3C(O)NH2, v=0
  580161.2511  0.0459 -5.2202 3 1649.0375201  71510 303A04357      A04258        syn-C2H3C(O)NH2, v=0
  580161.2511  0.0459 -5.2202 3 1649.0375201  71510 303A04358      A04259        syn-C2H3C(O)NH2, v=0
  580218.8038  0.0014 -2.8525 3  308.2942 89  71510 303441926      431825        syn-C2H3C(O)NH2, v=0
  580218.8309  0.0014 -2.8525 3  308.2942 89  71510 303441925      431826        syn-C2H3C(O)NH2, v=0
  580243.9788  0.0212 -4.1932 3 1036.1808145  71510 303724230      724131        syn-C2H3C(O)NH2, v=0
  580243.9788  0.0212 -4.1932 3 1036.1808145  71510 303724231      724132        syn-C2H3C(O)NH2, v=0
  580244.7977  0.0015 -2.6543 3  261.5521 69  71510 303342410      332311        syn-C2H3C(O)NH2, v=0
  580244.7977  0.0015 -2.6543 3  261.5521 69  71510 303342411      332310        syn-C2H3C(O)NH2, v=0
  580275.9192  0.0111 -3.6748 3  846.1743161  71510 303801565      791664        syn-C2H3C(O)NH2, v=0
  580289.1450  0.0111 -5.5700 3  846.1743161  71510 303801665      791664        syn-C2H3C(O)NH2, v=0
  580298.5828  0.0111 -5.5699 3  846.1736161  71510 303801565      791564        syn-C2H3C(O)NH2, v=0
  580311.8087  0.0111 -3.6747 3  846.1736161  71510 303801665      791564        syn-C2H3C(O)NH2, v=0
  580435.4562  0.0048 -5.0173 3  109.9470 67  71510 30333 231      32 132        syn-C2H3C(O)NH2, v=0
  580435.4726  0.0048 -5.0173 3  109.9470 67  71510 30333 331      32 032        syn-C2H3C(O)NH2, v=0
  580475.4614  0.0092 -5.5267 3  811.3811153  71510 303762156      752155        syn-C2H3C(O)NH2, v=0
  580562.0861  0.0210 -4.1689 3 1018.5967143  71510 303714229      714130        syn-C2H3C(O)NH2, v=0
  580562.0861  0.0210 -4.1689 3 1018.5967143  71510 303714230      714131        syn-C2H3C(O)NH2, v=0
  580577.6626  0.0015 -2.6846 3  267.8379 73  71510 303362313      352214        syn-C2H3C(O)NH2, v=0
  580577.6626  0.0015 -2.6846 3  267.8379 73  71510 303362314      352213        syn-C2H3C(O)NH2, v=0
  580605.9505  0.0100 -5.6274 3  857.7932155  71510 303772454      762453        syn-C2H3C(O)NH2, v=0
  580641.9404  0.0026 -4.4734 3  126.8078 63  71510 303311021      30 724        syn-C2H3C(O)NH2, v=0
  580663.3311  0.0100 -5.6274 3  857.7957155  71510 303772453      762452        syn-C2H3C(O)NH2, v=0
  580750.3801  0.1172 -5.5468 3 1736.4942239  71510 303B914A5      B913A6        syn-C2H3C(O)NH2, v=0
  580750.3801  0.1172 -5.5468 3 1736.4942239  71510 303B915A5      B914A6        syn-C2H3C(O)NH2, v=0
  580763.9492  0.0013 -2.8014 3  295.8222 85  71510 303422023      411922        syn-C2H3C(O)NH2, v=0
  580763.9494  0.0013 -2.8014 3  295.8222 85  71510 303422022      411923        syn-C2H3C(O)NH2, v=0
  580819.4636  0.0014 -2.7187 3  275.6295 77  71510 303382216      372117        syn-C2H3C(O)NH2, v=0
  580819.4636  0.0014 -2.7187 3  275.6295 77  71510 303382217      372116        syn-C2H3C(O)NH2, v=0
  580868.3251  0.0209 -4.1455 3 1001.2610141  71510 303704228      704129        syn-C2H3C(O)NH2, v=0
  580868.3251  0.0209 -4.1455 3 1001.2610141  71510 303704229      704130        syn-C2H3C(O)NH2, v=0
  580912.5067  0.0014 -2.7573 3  284.9478 81  71510 303402119      392020        syn-C2H3C(O)NH2, v=0
  580912.5067  0.0014 -2.7573 3  284.9478 81  71510 303402120      392019        syn-C2H3C(O)NH2, v=0
  580928.7059  0.0537 -4.4109 3 1003.1791171  71510 303852164      842263        syn-C2H3C(O)NH2, v=0
  580935.7238  0.0444 -5.1751 3 1624.4404199  71510 303994356      994257        syn-C2H3C(O)NH2, v=0
  580935.7238  0.0444 -5.1751 3 1624.4404199  71510 303994357      994258        syn-C2H3C(O)NH2, v=0
  580976.8577  0.0089 -5.5069 3  803.5688153  71510 303762057      752056        syn-C2H3C(O)NH2, v=0
  581040.0903  0.0101 -3.7749 3  826.4536157  71510 303781761      771860        syn-C2H3C(O)NH2, v=0
  581088.7271  0.0019 -3.1861 3  395.1532107  71510 303531638      521537        syn-C2H3C(O)NH2, v=0
  581163.0353  0.0207 -4.1231 3  984.1735139  71510 303694227      694128        syn-C2H3C(O)NH2, v=0
  581163.0353  0.0207 -4.1231 3  984.1735139  71510 303694228      694129        syn-C2H3C(O)NH2, v=0
  581176.8125  0.0055 -4.7969 3  376.7746107  71510 303531241      53 944        syn-C2H3C(O)NH2, v=0
  581202.6607  0.0042 -3.4513 3  326.9804 99  71510 303491336      481237        syn-C2H3C(O)NH2, v=0
  581258.5237  0.0041 -4.8211 3  332.4033101  71510 303501239      50 942        syn-C2H3C(O)NH2, v=0
  581260.7356  0.0041 -4.9098 3  301.9169 97  71510 303481038      48 741        syn-C2H3C(O)NH2, v=0
  581319.2164  0.0030 -5.4055 3  203.0959 77  71510 303381325      38 830        syn-C2H3C(O)NH2, v=0
  581389.4989  0.0105 -3.7146 3  836.7643159  71510 303791663      781762        syn-C2H3C(O)NH2, v=0
  581396.2260  0.0110 -5.7704 3  922.1796157  71510 303782851      772850        syn-C2H3C(O)NH2, v=0
  581396.2388  0.0110 -5.7704 3  922.1796157  71510 303782850      772849        syn-C2H3C(O)NH2, v=0
  581400.1824  0.0810 -4.8266 3 1131.1573205  71510 303A2 498      A2 399        syn-C2H3C(O)NH2, v=0
  581400.1824  0.0810 -4.8266 3 1131.1573205  71510 303A2 598      A2 499        syn-C2H3C(O)NH2, v=0
  581429.1771  0.0026 -3.2703 3  422.7424111  71510 303551640      541539        syn-C2H3C(O)NH2, v=0
  581446.5488  0.0206 -4.1017 3  967.3339137  71510 303684226      684127        syn-C2H3C(O)NH2, v=0
  581446.5488  0.0206 -4.1017 3  967.3339137  71510 303684227      684128        syn-C2H3C(O)NH2, v=0
  581527.4105  0.0058 -5.7526 3  168.2170 77  71510 30338 533      38 236        syn-C2H3C(O)NH2, v=0
  581535.3654  0.0058 -5.7525 3  168.2170 77  71510 30338 633      38 336        syn-C2H3C(O)NH2, v=0
  581584.9081  0.0104 -5.5550 3  836.7643159  71510 303791763      781762        syn-C2H3C(O)NH2, v=0
  581619.9348  0.0893 -5.1538 3 1478.4152225  71510 303B210A2      B2 9A3        syn-C2H3C(O)NH2, v=0
  581619.9348  0.0893 -5.1538 3 1478.4152225  71510 303B211A2      B210A3        syn-C2H3C(O)NH2, v=0
  581632.5298  0.0210 -4.0481 3  882.5109161  71510 303801961      792060        syn-C2H3C(O)NH2, v=0
  581633.5816  0.1290 -5.6691 3 1810.2415243  71510 303C115A6      C114A7        syn-C2H3C(O)NH2, v=0
  581633.5816  0.1290 -5.6691 3 1810.2415243  71510 303C116A6      C115A7        syn-C2H3C(O)NH2, v=0
  581686.2566  0.0430 -5.1305 3 1600.0973197  71510 303984355      984256        syn-C2H3C(O)NH2, v=0
  581686.2566  0.0430 -5.1305 3 1600.0973197  71510 303984356      984257        syn-C2H3C(O)NH2, v=0
  581711.3793  0.0104 -5.5548 3  836.7536159  71510 303791663      781662        syn-C2H3C(O)NH2, v=0
  581719.1899  0.0205 -4.0814 3  950.7422135  71510 303674225      674126        syn-C2H3C(O)NH2, v=0
  581719.1899  0.0205 -4.0814 3  950.7422135  71510 303674226      674127        syn-C2H3C(O)NH2, v=0
  581728.4674  0.0021 -4.7771 3  101.9030 55  71510 303271116      26 819        syn-C2H3C(O)NH2, v=0
  581782.4059  0.0025 -5.7471 3   60.9439 39  71510 3031912 8      18 9 9        syn-C2H3C(O)NH2, v=0
  581783.8469  0.0025 -5.7471 3   60.9439 39  71510 3031912 7      18 910        syn-C2H3C(O)NH2, v=0
  581897.3873  0.0019 -3.6920 3  212.8381 81  71510 303401130      39 831        syn-C2H3C(O)NH2, v=0
  581906.7885  0.0104 -3.7138 3  836.7536159  71510 303791763      781662        syn-C2H3C(O)NH2, v=0
  581981.2758  0.0204 -4.0621 3  934.3982133  71510 303664224      664125        syn-C2H3C(O)NH2, v=0
  581981.2758  0.0204 -4.0621 3  934.3982133  71510 303664225      664126        syn-C2H3C(O)NH2, v=0
  582015.2751  0.0021 -4.9754 3  232.2662 79  71510 303391623      391326        syn-C2H3C(O)NH2, v=0
  582100.3712  0.0060 -5.5572 3  193.3111 77  71510 303381127      38 632        syn-C2H3C(O)NH2, v=0
  582143.8769  0.0809 -4.9371 3 1300.7626215  71510 303A7 7A0      A7 6A1        syn-C2H3C(O)NH2, v=0
  582143.8769  0.0809 -4.9371 3 1300.7626215  71510 303A7 8A0      A7 7A1        syn-C2H3C(O)NH2, v=0
  582180.9402  0.0022 -3.2261 3  408.7799109  71510 303541639      531538        syn-C2H3C(O)NH2, v=0
  582219.7162  0.0028 -4.7027 3  362.8668101  71510 303501734      501437        syn-C2H3C(O)NH2, v=0
  582225.6829  0.0291 -5.1136 3 1045.0186173  71510 303862462      862165        syn-C2H3C(O)NH2, v=0
  582233.1166  0.0203 -4.0441 3  918.3016131  71510 303654223      654124        syn-C2H3C(O)NH2, v=0
  582233.1166  0.0203 -4.0441 3  918.3016131  71510 303654224      654125        syn-C2H3C(O)NH2, v=0
  582253.7897  0.0869 -4.9132 3 1029.3998199  71510 30399 297      99 198        syn-C2H3C(O)NH2, v=0
  582253.7897  0.0869 -4.9132 3 1029.3998199  71510 30399 397      99 298        syn-C2H3C(O)NH2, v=0
  582344.7052  0.1424 -5.7960 3 1885.2212247  71510 303C316A7      C315A8        syn-C2H3C(O)NH2, v=0
  582344.7052  0.1424 -5.7960 3 1885.2212247  71510 303C317A7      C316A8        syn-C2H3C(O)NH2, v=0
  582413.5152  0.0416 -5.0867 3 1576.0080195  71510 303974354      974255        syn-C2H3C(O)NH2, v=0
  582413.5152  0.0416 -5.0867 3 1576.0080195  71510 303974355      974256        syn-C2H3C(O)NH2, v=0
  582440.7376  0.0031 -5.3362 3  212.8381 79  71510 303391326      39 831        syn-C2H3C(O)NH2, v=0
  582475.0154  0.0203 -4.0272 3  902.4524129  71510 303644222      644123        syn-C2H3C(O)NH2, v=0
  582475.0154  0.0203 -4.0272 3  902.4524129  71510 303644223      644124        syn-C2H3C(O)NH2, v=0
  582478.2820  0.1458 -4.9666 3 1233.9538189  71510 303942470      932569        syn-C2H3C(O)NH2, v=0
  582492.4977  0.0021 -4.9749 3  232.2503 79  71510 303391624      391327        syn-C2H3C(O)NH2, v=0
  582526.0086  0.0034 -3.3593 3  357.3541103  71510 303511437      501338        syn-C2H3C(O)NH2, v=0
  582707.2689  0.0203 -4.0116 3  886.8503127  71510 303634221      634122        syn-C2H3C(O)NH2, v=0
  582707.2689  0.0203 -4.0116 3  886.8503127  71510 303634222      634123        syn-C2H3C(O)NH2, v=0
  582789.8603  0.0047 -5.6139 3   75.9398 51  71510 30325 818      24 321        syn-C2H3C(O)NH2, v=0
  582803.2261  0.0512 -5.1873 3 1113.1730179  71510 303892465      892168        syn-C2H3C(O)NH2, v=0
  582834.9484  0.0109 -5.7385 3  910.0258157  71510 303782752      772751        syn-C2H3C(O)NH2, v=0
  582835.0917  0.0109 -5.7385 3  910.0258157  71510 303782751      772750        syn-C2H3C(O)NH2, v=0
  582840.3749  0.0015 -3.0077 3  350.3417 99  71510 303491733      481632        syn-C2H3C(O)NH2, v=0
  582922.0168  0.0088 -3.7545 3  807.0094155  71510 303771860      761759        syn-C2H3C(O)NH2, v=0
  582930.1671  0.0203 -3.9974 3  871.4952125  71510 303624220      624121        syn-C2H3C(O)NH2, v=0
  582930.1671  0.0203 -3.9974 3  871.4952125  71510 303624221      624122        syn-C2H3C(O)NH2, v=0
  583027.9737  0.0015 -3.0074 3  350.3364 99  71510 303491732      481633        syn-C2H3C(O)NH2, v=0
  583075.6999  0.0072 -3.7142 3  712.6769145  71510 303721855      711754        syn-C2H3C(O)NH2, v=0
  583118.1429  0.0404 -5.0435 3 1552.1721193  71510 303964353      964254        syn-C2H3C(O)NH2, v=0
  583118.1429  0.0404 -5.0435 3 1552.1721193  71510 303964354      964255        syn-C2H3C(O)NH2, v=0
  583143.9937  0.0203 -3.9846 3  856.3870123  71510 303614219      614120        syn-C2H3C(O)NH2, v=0
  583143.9937  0.0203 -3.9846 3  856.3870123  71510 303614220      614121        syn-C2H3C(O)NH2, v=0
  583154.6781  0.0960 -5.2548 3 1547.7818229  71510 303B411A3      B410A4        syn-C2H3C(O)NH2, v=0
  583154.6781  0.0960 -5.2548 3 1547.7818229  71510 303B412A3      B411A4        syn-C2H3C(O)NH2, v=0
  583254.4839  0.0031 -5.4999 3  193.5230 75  71510 303371324      37 829        syn-C2H3C(O)NH2, v=0
  583292.9453  0.0098 -5.5374 3  826.4536157  71510 303781861      771860        syn-C2H3C(O)NH2, v=0
  583317.0699  0.0102 -5.5994 3  848.0649155  71510 303772355      762354        syn-C2H3C(O)NH2, v=0
  583349.0266  0.0204 -3.9734 3  841.5255121  71510 303604218      604119        syn-C2H3C(O)NH2, v=0
  583349.0266  0.0204 -3.9734 3  841.5255121  71510 303604219      604120        syn-C2H3C(O)NH2, v=0
  583505.7080  0.0055 -3.5576 3  566.4701129  71510 303641748      631647        syn-C2H3C(O)NH2, v=0
  583545.5372  0.0204 -3.9637 3  826.9106119  71510 303594217      594118        syn-C2H3C(O)NH2, v=0
  583545.5372  0.0204 -3.9637 3  826.9106119  71510 303594218      594119        syn-C2H3C(O)NH2, v=0
  583646.1193  0.0765 -5.8896 3 2010.9875227  71510 303B34469      B34370        syn-C2H3C(O)NH2, v=0
  583646.1193  0.0765 -5.8896 3 2010.9875227  71510 303B34470      B34371        syn-C2H3C(O)NH2, v=0
  583657.0493  0.0204 -5.6521 3  922.7479183  71510 30391 586      90 585        syn-C2H3C(O)NH2, v=0
  583657.0493  0.0204 -3.5073 3  922.7479183  71510 30391 586      90 685        syn-C2H3C(O)NH2, v=0
  583657.0493  0.0204 -3.5073 3  922.7479183  71510 30391 686      90 585        syn-C2H3C(O)NH2, v=0
  583657.0493  0.0204 -5.6521 3  922.7479183  71510 30391 686      90 685        syn-C2H3C(O)NH2, v=0
  583658.6138  0.0216 -5.6510 3  925.3504185  71510 30392 488      91 487        syn-C2H3C(O)NH2, v=0
  583658.6138  0.0216 -3.4927 3  925.3504185  71510 30392 488      91 587        syn-C2H3C(O)NH2, v=0
  583658.6138  0.0216 -3.4927 3  925.3504185  71510 30392 588      91 487        syn-C2H3C(O)NH2, v=0
  583658.6138  0.0216 -5.6510 3  925.3504185  71510 30392 588      91 587        syn-C2H3C(O)NH2, v=0
  583666.3512  0.0195 -5.6522 3  919.6158181  71510 30390 684      89 683        syn-C2H3C(O)NH2, v=0
  583666.3512  0.0195 -3.5219 3  919.6158181  71510 30390 684      89 783        syn-C2H3C(O)NH2, v=0
  583666.3512  0.0195 -3.5219 3  919.6158181  71510 30390 784      89 683        syn-C2H3C(O)NH2, v=0
  583666.3512  0.0195 -5.6522 3  919.6158181  71510 30390 784      89 783        syn-C2H3C(O)NH2, v=0
  583666.9821  0.0231 -5.6488 3  927.4300187  71510 30393 390      92 389        syn-C2H3C(O)NH2, v=0
  583666.9821  0.0231 -3.4781 3  927.4300187  71510 30393 390      92 489        syn-C2H3C(O)NH2, v=0
  583666.9821  0.0231 -3.4781 3  927.4300187  71510 30393 490      92 389        syn-C2H3C(O)NH2, v=0
  583666.9821  0.0231 -5.6488 3  927.4300187  71510 30393 490      92 489        syn-C2H3C(O)NH2, v=0
  583678.9508  0.0252 -5.6456 3  928.9921189  71510 30394 292      93 291        syn-C2H3C(O)NH2, v=0
  583678.9508  0.0252 -3.4632 3  928.9921189  71510 30394 292      93 391        syn-C2H3C(O)NH2, v=0
  583678.9508  0.0252 -3.4632 3  928.9921189  71510 30394 392      93 291        syn-C2H3C(O)NH2, v=0
  583678.9508  0.0252 -5.6456 3  928.9921189  71510 30394 392      93 391        syn-C2H3C(O)NH2, v=0
  583691.7327  0.0186 -5.6511 3  915.9464179  71510 30389 782      88 781        syn-C2H3C(O)NH2, v=0
  583691.7327  0.0186 -3.5365 3  915.9464179  71510 30389 782      88 881        syn-C2H3C(O)NH2, v=0
  583691.7327  0.0186 -3.5365 3  915.9464179  71510 30389 882      88 781        syn-C2H3C(O)NH2, v=0
  583691.7327  0.0186 -5.6511 3  915.9464179  71510 30389 882      88 881        syn-C2H3C(O)NH2, v=0
  583691.9669  0.0280 -5.6414 3  930.0417191  71510 30395 194      94 193        syn-C2H3C(O)NH2, v=0
  583691.9669  0.0280 -3.4480 3  930.0417191  71510 30395 194      94 293        syn-C2H3C(O)NH2, v=0
  583691.9669  0.0280 -3.4480 3  930.0417191  71510 30395 294      94 193        syn-C2H3C(O)NH2, v=0
  583691.9669  0.0280 -5.6414 3  930.0417191  71510 30395 294      94 293        syn-C2H3C(O)NH2, v=0
  583703.9760  0.0318 -5.6362 3  930.5828193  71510 30396 096      95 095        syn-C2H3C(O)NH2, v=0
  583703.9760  0.0318 -3.4326 3  930.5828193  71510 30396 096      95 195        syn-C2H3C(O)NH2, v=0
  583703.9760  0.0318 -3.4326 3  930.5828193  71510 30396 196      95 095        syn-C2H3C(O)NH2, v=0
  583703.9760  0.0318 -5.6362 3  930.5828193  71510 30396 196      95 195        syn-C2H3C(O)NH2, v=0
  583711.4610  0.0103 -5.5988 3  848.0842155  71510 303772354      762353        syn-C2H3C(O)NH2, v=0
  583733.7913  0.0205 -3.9559 3  812.5420117  71510 303584216      584117        syn-C2H3C(O)NH2, v=0
  583733.7913  0.0205 -3.9559 3  812.5420117  71510 303584217      584118        syn-C2H3C(O)NH2, v=0
  583739.9763  0.0179 -5.6489 3  911.7303177  71510 30388 880      87 879        syn-C2H3C(O)NH2, v=0
  583739.9763  0.0179 -3.5515 3  911.7303177  71510 30388 880      87 979        syn-C2H3C(O)NH2, v=0
  583739.9763  0.0179 -3.5515 3  911.7303177  71510 30388 980      87 879        syn-C2H3C(O)NH2, v=0
  583739.9763  0.0179 -5.6489 3  911.7303177  71510 30388 980      87 979        syn-C2H3C(O)NH2, v=0
  583782.9541  0.0819 -4.8578 3 1194.1053209  71510 303A4 599      A4 4A0        syn-C2H3C(O)NH2, v=0
  583782.9541  0.0819 -4.8578 3 1194.1053209  71510 303A4 699      A4 5A0        syn-C2H3C(O)NH2, v=0
  583800.7623  0.0391 -5.0010 3 1528.5895191  71510 303954352      954253        syn-C2H3C(O)NH2, v=0
  583800.7623  0.0391 -5.0010 3 1528.5895191  71510 303954353      954254        syn-C2H3C(O)NH2, v=0
  583820.0483  0.0171 -5.6456 3  906.9564175  71510 30387 978      86 977        syn-C2H3C(O)NH2, v=0
  583820.0483  0.0171 -3.5669 3  906.9564175  71510 30387 978      861077        syn-C2H3C(O)NH2, v=0
  583820.0483  0.0171 -3.5669 3  906.9564175  71510 303871078      86 977        syn-C2H3C(O)NH2, v=0
  583820.0483  0.0171 -5.6456 3  906.9564175  71510 303871078      861077        syn-C2H3C(O)NH2, v=0
  583914.0490  0.0206 -3.9500 3  798.4197115  71510 303574215      574116        syn-C2H3C(O)NH2, v=0
  583914.0490  0.0206 -3.9500 3  798.4197115  71510 303574216      574117        syn-C2H3C(O)NH2, v=0
  583944.0309  0.0163 -5.6410 3  901.6111173  71510 303861076      851075        syn-C2H3C(O)NH2, v=0
  583944.0309  0.0163 -3.5831 3  901.6111173  71510 303861076      851175        syn-C2H3C(O)NH2, v=0
  583944.0309  0.0163 -3.5831 3  901.6111173  71510 303861176      851075        syn-C2H3C(O)NH2, v=0
  583944.0309  0.0163 -5.6410 3  901.6111173  71510 303861176      851175        syn-C2H3C(O)NH2, v=0
  584086.5648  0.0207 -3.9462 3  784.5436113  71510 303564214      564115        syn-C2H3C(O)NH2, v=0
  584086.5648  0.0207 -3.9462 3  784.5436113  71510 303564215      564116        syn-C2H3C(O)NH2, v=0
  584119.7626  0.0845 -5.0144 3 1366.9413219  71510 303A9 8A1      A9 7A2        syn-C2H3C(O)NH2, v=0
  584119.7626  0.0845 -5.0144 3 1366.9413219  71510 303A9 9A1      A9 8A2        syn-C2H3C(O)NH2, v=0
  584128.5886  0.0155 -5.6351 3  895.6776171  71510 303851174      841173        syn-C2H3C(O)NH2, v=0
  584128.5886  0.0155 -3.6004 3  895.6776171  71510 303851174      841273        syn-C2H3C(O)NH2, v=0
  584128.5886  0.0155 -3.6004 3  895.6776171  71510 303851274      841173        syn-C2H3C(O)NH2, v=0
  584128.5886  0.0155 -5.6351 3  895.6776171  71510 303851274      841273        syn-C2H3C(O)NH2, v=0
  584134.0184  0.0046 -4.6447 3  502.8399121  71510 303601744      601447        syn-C2H3C(O)NH2, v=0
  584154.4988  0.0183 -4.8473 3  698.2953143  71510 303711853      711556        syn-C2H3C(O)NH2, v=0
  584173.2165  0.0785 -4.5915 3 1077.4808177  71510 303882266      872365        syn-C2H3C(O)NH2, v=0
  584186.6073  0.0078 -5.4449 3  775.2569151  71510 303751857      741856        syn-C2H3C(O)NH2, v=0
  584192.8278  0.0093 -5.5191 3  815.2464155  71510 303771959      761958        syn-C2H3C(O)NH2, v=0
  584251.5876  0.0208 -3.9448 3  770.9134111  71510 303554213      554114        syn-C2H3C(O)NH2, v=0
  584251.5876  0.0208 -3.9448 3  770.9134111  71510 303554214      554115        syn-C2H3C(O)NH2, v=0
  584397.3841  0.0146 -3.6192 3  889.1348169  71510 303841272      831371        syn-C2H3C(O)NH2, v=0
  584397.3847  0.0146 -5.6278 3  889.1348169  71510 303841372      831371        syn-C2H3C(O)NH2, v=0
  584397.3853  0.0146 -5.6278 3  889.1348169  71510 303841272      831271        syn-C2H3C(O)NH2, v=0
  584397.3860  0.0146 -3.6192 3  889.1348169  71510 303841372      831271        syn-C2H3C(O)NH2, v=0
  584409.3610  0.0210 -3.9460 3  757.5291109  71510 303544212      544113        syn-C2H3C(O)NH2, v=0
  584409.3610  0.0210 -3.9460 3  757.5291109  71510 303544213      544114        syn-C2H3C(O)NH2, v=0
  584461.9756  0.0380 -4.9591 3 1505.2598189  71510 303944351      944252        syn-C2H3C(O)NH2, v=0
  584461.9756  0.0380 -4.9591 3 1505.2598189  71510 303944352      944253        syn-C2H3C(O)NH2, v=0
  584503.1621  0.1094 -4.7777 3 1154.4046183  71510 303912368      902467        syn-C2H3C(O)NH2, v=0
  584510.8473  0.0110 -5.7077 3  898.4524157  71510 303782653      772652        syn-C2H3C(O)NH2, v=0
  584512.2823  0.0110 -5.7077 3  898.4524157  71510 303782652      772651        syn-C2H3C(O)NH2, v=0
  584537.0405  0.1039 -5.3622 3 1618.4015233  71510 303B612A4      B611A5        syn-C2H3C(O)NH2, v=0
  584537.0405  0.1039 -5.3622 3 1618.4015233  71510 303B613A4      B612A5        syn-C2H3C(O)NH2, v=0
  584543.8933  0.0030 -4.7614 3  338.0483 97  71510 303481731      481434        syn-C2H3C(O)NH2, v=0
  584560.1233  0.0211 -3.9503 3  744.3905107  71510 303534211      534112        syn-C2H3C(O)NH2, v=0
  584560.1233  0.0211 -3.9503 3  744.3905107  71510 303534212      534113        syn-C2H3C(O)NH2, v=0
  584561.4145  0.0098 -5.5353 3  826.3361157  71510 303781761      771760        syn-C2H3C(O)NH2, v=0
  584704.1077  0.0213 -3.9579 3  731.4975105  71510 303524210      524111        syn-C2H3C(O)NH2, v=0
  584704.1077  0.0213 -3.9579 3  731.4975105  71510 303524211      524112        syn-C2H3C(O)NH2, v=0
  584718.9902  0.0739 -5.8361 3 1983.0983225  71510 303B24468      B24369        syn-C2H3C(O)NH2, v=0
  584718.9902  0.0739 -5.8361 3 1983.0983225  71510 303B24469      B24370        syn-C2H3C(O)NH2, v=0
  584785.2758  0.0138 -3.6401 3  881.9557167  71510 303831370      821469        syn-C2H3C(O)NH2, v=0
  584785.2937  0.0138 -5.6190 3  881.9557167  71510 303831470      821469        syn-C2H3C(O)NH2, v=0
  584785.3085  0.0138 -5.6190 3  881.9557167  71510 303831370      821369        syn-C2H3C(O)NH2, v=0
  584785.3264  0.0138 -3.6401 3  881.9557167  71510 303831470      821369        syn-C2H3C(O)NH2, v=0
  584841.5422  0.0215 -3.9696 3  718.8499103  71510 3035142 9      514110        syn-C2H3C(O)NH2, v=0
  584841.5422  0.0215 -3.9696 3  718.8499103  71510 303514210      514111        syn-C2H3C(O)NH2, v=0
  584891.1850  0.0862 -4.8609 3 1090.3714203  71510 303A1 398      A1 299        syn-C2H3C(O)NH2, v=0
  584891.1850  0.0862 -4.8609 3 1090.3714203  71510 303A1 498      A1 399        syn-C2H3C(O)NH2, v=0
  584972.6499  0.0216 -3.9860 3  706.4477101  71510 3035042 8      5041 9        syn-C2H3C(O)NH2, v=0
  584972.6499  0.0216 -3.9860 3  706.4477101  71510 3035042 9      504110        syn-C2H3C(O)NH2, v=0
  585097.6490  0.0218 -4.0082 3  694.2907 99  71510 3034942 7      4941 8        syn-C2H3C(O)NH2, v=0
  585097.6490  0.0218 -4.0082 3  694.2907 99  71510 3034942 8      4941 9        syn-C2H3C(O)NH2, v=0
  585102.3662  0.0369 -4.9180 3 1482.1828187  71510 303934350      934251        syn-C2H3C(O)NH2, v=0
  585102.3662  0.0369 -4.9180 3 1482.1828187  71510 303934351      934252        syn-C2H3C(O)NH2, v=0
  585103.4197  0.0060 -4.7369 3  517.4781121  71510 303601941      601644        syn-C2H3C(O)NH2, v=0
  585158.7548  0.0086 -5.4177 3  760.8106149  71510 303741955      731954        syn-C2H3C(O)NH2, v=0
  585188.3941  0.0039 -4.9053 3  301.9171 97  71510 303481138      48 841        syn-C2H3C(O)NH2, v=0
  585205.5986  0.0044 -4.5668 3  123.1718 69  71510 30334 331      33 232        syn-C2H3C(O)NH2, v=0
  585205.8585  0.0044 -4.5668 3  123.1718 69  71510 30334 431      33 132        syn-C2H3C(O)NH2, v=0
  585216.7527  0.0220 -4.0376 3  682.3787 97  71510 3034842 6      4841 7        syn-C2H3C(O)NH2, v=0
  585216.7527  0.0220 -4.0376 3  682.3787 97  71510 3034842 7      4841 8        syn-C2H3C(O)NH2, v=0
  585292.2252  0.0034 -3.7629 3  193.3148 79  71510 30339 831      38 732        syn-C2H3C(O)NH2, v=0
  585330.1694  0.0223 -4.0764 3  670.7118 95  71510 3034742 5      4741 6        syn-C2H3C(O)NH2, v=0
  585330.1694  0.0223 -4.0764 3  670.7118 95  71510 3034742 6      4741 7        syn-C2H3C(O)NH2, v=0
  585345.8149  0.0130 -3.6643 3  874.1043165  71510 303821468      811567        syn-C2H3C(O)NH2, v=0
  585346.2220  0.0130 -5.6086 3  874.1043165  71510 303821568      811567        syn-C2H3C(O)NH2, v=0
  585346.5390  0.0130 -5.6086 3  874.1042165  71510 303821468      811467        syn-C2H3C(O)NH2, v=0
  585346.9461  0.0130 -3.6643 3  874.1042165  71510 303821568      811467        syn-C2H3C(O)NH2, v=0
  585438.1030  0.0225 -4.1278 3  659.2896 93  71510 3034642 4      4641 5        syn-C2H3C(O)NH2, v=0
  585438.1030  0.0225 -4.1278 3  659.2896 93  71510 3034642 5      4641 6        syn-C2H3C(O)NH2, v=0
  585441.3439  0.0051 -5.4925 3  192.4204 81  71510 30340 634      40 337        syn-C2H3C(O)NH2, v=0
  585475.9279  0.0051 -5.4925 3  192.4204 81  71510 30340 734      40 437        syn-C2H3C(O)NH2, v=0
  585501.1344  0.0935 -5.1259 3  989.5963197  71510 30398 197      98 098        syn-C2H3C(O)NH2, v=0
  585501.1344  0.0935 -5.1259 3  989.5963197  71510 30398 297      98 198        syn-C2H3C(O)NH2, v=0
  585540.7526  0.0227 -4.1972 3  648.1123 91  71510 3034542 3      4541 4        syn-C2H3C(O)NH2, v=0
  585540.7526  0.0227 -4.1972 3  648.1123 91  71510 3034542 4      4541 5        syn-C2H3C(O)NH2, v=0
  585638.3126  0.0229 -4.2951 3  637.1795 89  71510 3034442 2      4441 3        syn-C2H3C(O)NH2, v=0
  585638.3126  0.0229 -4.2951 3  637.1795 89  71510 3034442 3      4441 4        syn-C2H3C(O)NH2, v=0
  585722.4994  0.0359 -4.8775 3 1459.3583185  71510 303924349      924250        syn-C2H3C(O)NH2, v=0
  585722.4994  0.0359 -4.8775 3 1459.3583185  71510 303924350      924251        syn-C2H3C(O)NH2, v=0
  585730.9730  0.0232 -4.4444 3  626.4913 87  71510 3034342 1      4341 2        syn-C2H3C(O)NH2, v=0
  585730.9730  0.0232 -4.4444 3  626.4913 87  71510 3034342 2      4341 3        syn-C2H3C(O)NH2, v=0
  585734.0545  0.0014 -2.9289 3  333.8686 95  71510 303471830      461729        syn-C2H3C(O)NH2, v=0
  585738.4370  0.0014 -2.9289 3  333.8685 95  71510 303471829      461730        syn-C2H3C(O)NH2, v=0
  585760.0613  0.0713 -5.7833 3 1955.4662223  71510 303B14467      B14368        syn-C2H3C(O)NH2, v=0
  585760.0613  0.0713 -5.7833 3 1955.4662223  71510 303B14468      B14369        syn-C2H3C(O)NH2, v=0
  585763.2108  0.1131 -5.4754 3 1690.2692237  71510 303B813A5      B812A6        syn-C2H3C(O)NH2, v=0
  585763.2108  0.1131 -5.4754 3 1690.2692237  71510 303B814A5      B813A6        syn-C2H3C(O)NH2, v=0
  585789.3720  0.0124 -5.8943 3  981.2322159  71510 303793149      783148        syn-C2H3C(O)NH2, v=0
  585789.3721  0.0124 -5.8943 3  981.2322159  71510 303793148      783147        syn-C2H3C(O)NH2, v=0
  585801.5526  0.0021 -5.0221 3  222.4866 77  71510 303381622      381325        syn-C2H3C(O)NH2, v=0
  585818.9191  0.0234 -4.7190 3  616.0475 85  71510 3034242 0      4241 1        syn-C2H3C(O)NH2, v=0
  585818.9191  0.0234 -4.7190 3  616.0475 85  71510 3034242 1      4241 2        syn-C2H3C(O)NH2, v=0
  585954.6725  0.0891 -5.1013 3 1434.3878223  71510 303B1 9A2      B1 8A3        syn-C2H3C(O)NH2, v=0
  585954.6725  0.0891 -5.1013 3 1434.3878223  71510 303B110A2      B1 9A3        syn-C2H3C(O)NH2, v=0
  586033.8016  0.0836 -4.9096 3 1258.3352213  71510 303A6 6A0      A6 5A1        syn-C2H3C(O)NH2, v=0
  586033.8016  0.0836 -4.9096 3 1258.3352213  71510 303A6 7A0      A6 6A1        syn-C2H3C(O)NH2, v=0
  586056.6624  0.0021 -5.0218 3  222.4781 77  71510 303381623      381326        syn-C2H3C(O)NH2, v=0
  586159.9971  0.0122 -3.6934 3  865.5307163  71510 303811566      801665        syn-C2H3C(O)NH2, v=0
  586167.6703  0.0122 -5.5961 3  865.5307163  71510 303811666      801665        syn-C2H3C(O)NH2, v=0
  586173.2229  0.0122 -5.5961 3  865.5303163  71510 303811566      801565        syn-C2H3C(O)NH2, v=0
  586180.8962  0.0122 -3.6933 3  865.5303163  71510 303811666      801565        syn-C2H3C(O)NH2, v=0
  586266.5781  0.0016 -3.1416 3  381.6453105  71510 303521636      511537        syn-C2H3C(O)NH2, v=0
  586276.3022  0.0019 -2.5849 3  258.4046 59  71510 3032927 2      2826 3        syn-C2H3C(O)NH2, v=0
  586276.3022  0.0019 -2.5849 3  258.4046 59  71510 3032927 3      2826 2        syn-C2H3C(O)NH2, v=0
  586315.9248  0.0103 -5.5726 3  839.0524155  71510 303772256      762255        syn-C2H3C(O)NH2, v=0
  586322.9235  0.0349 -4.8378 3 1436.7860183  71510 303914348      914249        syn-C2H3C(O)NH2, v=0
  586322.9235  0.0349 -4.8378 3 1436.7860183  71510 303914349      914250        syn-C2H3C(O)NH2, v=0
  586362.9258  0.0045 -3.5429 3  297.8430 95  71510 303471235      461136        syn-C2H3C(O)NH2, v=0
  586377.1197  0.0039 -5.0103 3  272.6634 93  71510 30346 937      46 640        syn-C2H3C(O)NH2, v=0
  586498.1146  0.0110 -5.6778 3  887.4854157  71510 303782554      772553        syn-C2H3C(O)NH2, v=0
  586510.8209  0.0110 -5.6778 3  887.4859157  71510 303782553      772552        syn-C2H3C(O)NH2, v=0
  586561.4247  0.0033 -5.2899 3  222.7552 81  71510 303401327      40 832        syn-C2H3C(O)NH2, v=0
  586707.1781  0.0018 -2.6076 3  260.7461 63  71510 3033126 5      3025 6        syn-C2H3C(O)NH2, v=0
  586707.1781  0.0018 -2.6076 3  260.7461 63  71510 3033126 6      3025 5        syn-C2H3C(O)NH2, v=0
  586770.2777  0.0688 -5.7311 3 1928.0908221  71510 303B04466      B04367        syn-C2H3C(O)NH2, v=0
  586770.2777  0.0688 -5.7311 3 1928.0908221  71510 303B04467      B04368        syn-C2H3C(O)NH2, v=0
  586814.2695  0.0096 -3.7658 3  826.3361157  71510 303781861      771760        syn-C2H3C(O)NH2, v=0
  586814.4676  0.0021 -4.7002 3  108.6824 57  71510 303281117      27 820        syn-C2H3C(O)NH2, v=0
  586817.3655  0.0123 -5.8591 3  967.4699159  71510 303793050      783049        syn-C2H3C(O)NH2, v=0
  586817.3657  0.0123 -5.8591 3  967.4699159  71510 303793049      783048        syn-C2H3C(O)NH2, v=0
  586829.0706  0.1237 -5.5939 3 1763.3797241  71510 303C014A6      C013A7        syn-C2H3C(O)NH2, v=0
  586829.0706  0.1237 -5.5939 3 1763.3797241  71510 303C015A6      C014A7        syn-C2H3C(O)NH2, v=0
  586871.4864  0.0076 -5.8563 3  170.2086 73  71510 303361026      36 531        syn-C2H3C(O)NH2, v=0
  586901.4320  0.0108 -5.5178 3  811.8092153  71510 303762155      752154        syn-C2H3C(O)NH2, v=0
  586904.1701  0.0340 -4.7987 3 1414.4657181  71510 303904347      904248        syn-C2H3C(O)NH2, v=0
  586904.1701  0.0340 -4.7987 3 1414.4657181  71510 303904348      904249        syn-C2H3C(O)NH2, v=0
  587118.1139  0.0016 -2.6328 3  264.5597 67  71510 3033325 8      3224 9        syn-C2H3C(O)NH2, v=0
  587118.1139  0.0016 -2.6328 3  264.5597 67  71510 3033325 9      3224 8        syn-C2H3C(O)NH2, v=0
  587157.5259  0.0014 -2.8658 3  319.1835 91  71510 303451927      441826        syn-C2H3C(O)NH2, v=0
  587157.5888  0.0014 -2.8658 3  319.1835 91  71510 303451926      441827        syn-C2H3C(O)NH2, v=0
  587267.2706  0.0114 -3.7304 3  856.1639161  71510 303801664      791763        syn-C2H3C(O)NH2, v=0
  587384.9946  0.0114 -5.5814 3  856.1639161  71510 303801764      791763        syn-C2H3C(O)NH2, v=0
  587402.0871  0.0863 -4.8626 3 1152.6341207  71510 303A3 499      A3 3A0        syn-C2H3C(O)NH2, v=0
  587402.0871  0.0863 -4.8626 3 1152.6341207  71510 303A3 599      A3 4A0        syn-C2H3C(O)NH2, v=0
  587445.8081  0.0104 -5.4644 3  785.6662151  71510 303752055      742054        syn-C2H3C(O)NH2, v=0
  587462.6798  0.0114 -5.5812 3  856.1574161  71510 303801664      791663        syn-C2H3C(O)NH2, v=0
  587466.7557  0.0331 -4.7603 3 1392.3971179  71510 303894346      894247        syn-C2H3C(O)NH2, v=0
  587466.7557  0.0331 -4.7603 3 1392.3971179  71510 303894347      894248        syn-C2H3C(O)NH2, v=0
  587492.4325  0.0015 -2.6608 3  269.8548 71  71510 303352411      342312        syn-C2H3C(O)NH2, v=0
  587492.4325  0.0015 -2.6608 3  269.8548 71  71510 303352412      342311        syn-C2H3C(O)NH2, v=0
  587580.4037  0.0114 -3.7299 3  856.1574161  71510 303801764      791663        syn-C2H3C(O)NH2, v=0
  587601.2338  0.0027 -4.7267 3  350.1829 99  71510 303491733      491436        syn-C2H3C(O)NH2, v=0
  587639.9262  0.0109 -3.7842 3  845.9101159  71510 303791762      781861        syn-C2H3C(O)NH2, v=0
  587645.6424  0.0948 -5.1964 3 1503.0972227  71510 303B310A3      B3 9A4        syn-C2H3C(O)NH2, v=0
  587645.6424  0.0948 -5.1964 3 1503.0972227  71510 303B311A3      B310A4        syn-C2H3C(O)NH2, v=0
  587649.2769  0.0048 -5.3622 3  217.6297 81  71510 303401228      40 733        syn-C2H3C(O)NH2, v=0
  587730.1610  0.1358 -5.7175 3 1837.7280245  71510 303C215A7      C214A8        syn-C2H3C(O)NH2, v=0
  587730.1610  0.1358 -5.7175 3 1837.7280245  71510 303C216A7      C215A8        syn-C2H3C(O)NH2, v=0
  587750.5461  0.0665 -5.6796 3 1900.9718219  71510 303A94465      A94366        syn-C2H3C(O)NH2, v=0
  587750.5461  0.0665 -5.6796 3 1900.9718219  71510 303A94466      A94367        syn-C2H3C(O)NH2, v=0
  587775.7131  0.0045 -5.2934 3  217.9034 85  71510 30342 735      42 438        syn-C2H3C(O)NH2, v=0
  587781.4800  0.0038 -5.0086 3  272.6634 93  71510 303461037      46 740        syn-C2H3C(O)NH2, v=0
  587804.1536  0.0015 -2.6921 3  276.6439 75  71510 303372314      362215        syn-C2H3C(O)NH2, v=0
  587804.1536  0.0015 -2.6921 3  276.6439 75  71510 303372315      362214        syn-C2H3C(O)NH2, v=0
  587827.0656  0.0014 -2.8128 3  306.1755 87  71510 303432024      421923        syn-C2H3C(O)NH2, v=0
  587827.0661  0.0014 -2.8128 3  306.1755 87  71510 303432023      421924        syn-C2H3C(O)NH2, v=0
  587908.2304  0.0045 -5.2932 3  217.9034 85  71510 30342 835      42 538        syn-C2H3C(O)NH2, v=0
  587909.6634  0.0129 -3.8861 3  854.4255159  71510 303791861      781960        syn-C2H3C(O)NH2, v=0
  587974.5502  0.0122 -5.8251 3  954.2458159  71510 303792951      782950        syn-C2H3C(O)NH2, v=0
  587974.5523  0.0122 -5.8251 3  954.2458159  71510 303792950      782949        syn-C2H3C(O)NH2, v=0
  588011.1815  0.0323 -4.7227 3 1370.5800177  71510 303884345      884246        syn-C2H3C(O)NH2, v=0
  588011.1815  0.0323 -4.7227 3 1370.5800177  71510 303884346      884247        syn-C2H3C(O)NH2, v=0
  588012.8088  0.0014 -2.7273 3  284.9439 79  71510 303392217      382118        syn-C2H3C(O)NH2, v=0
  588012.8088  0.0014 -2.7273 3  284.9439 79  71510 303392218      382117        syn-C2H3C(O)NH2, v=0
  588054.6798  0.0014 -2.7672 3  294.7772 83  71510 303412120      402021        syn-C2H3C(O)NH2, v=0
  588054.6798  0.0014 -2.7672 3  294.7772 83  71510 303412121      402020        syn-C2H3C(O)NH2, v=0
  588150.3761  0.0862 -4.9764 3 1323.8423217  71510 303A8 7A1      A8 6A2        syn-C2H3C(O)NH2, v=0
  588150.3761  0.0862 -4.9764 3 1323.8423217  71510 303A8 8A1      A8 7A2        syn-C2H3C(O)NH2, v=0
  588207.1876  0.0084 -5.4747 3  794.7433153  71510 303761858      751857        syn-C2H3C(O)NH2, v=0
  588250.8743  0.0040 -5.1361 3  244.6548 89  71510 30344 836      44 539        syn-C2H3C(O)NH2, v=0
  588253.5605  0.0034 -5.6204 3  184.1164 73  71510 303361323      36 828        syn-C2H3C(O)NH2, v=0
  588258.7116  0.0063 -4.7796 3  423.7915113  71510 303561343      561046        syn-C2H3C(O)NH2, v=0
  588259.1390  0.0923 -4.9471 3 1049.8740201  71510 303A0 298      A0 199        syn-C2H3C(O)NH2, v=0
  588259.1390  0.0923 -4.9471 3 1049.8740201  71510 303A0 398      A0 299        syn-C2H3C(O)NH2, v=0
  588268.0971  0.0098 -5.5305 3  822.9481155  71510 303772058      762057        syn-C2H3C(O)NH2, v=0
  588271.0349  0.0025 -5.6132 3   65.6254 41  71510 3032012 9      19 910        syn-C2H3C(O)NH2, v=0
  588274.9839  0.0025 -5.6132 3   65.6252 41  71510 3032012 8      19 911        syn-C2H3C(O)NH2, v=0
  588461.6456  0.1496 -5.8457 3 1913.3087249  71510 303C416A8      C415A9        syn-C2H3C(O)NH2, v=0
  588461.6456  0.1496 -5.8457 3 1913.3087249  71510 303C417A8      C416A9        syn-C2H3C(O)NH2, v=0
  588487.1286  0.0049 -4.6917 3  445.0329115  71510 303571543      571246        syn-C2H3C(O)NH2, v=0
  588524.6650  0.0110 -5.5696 3  839.1776155  71510 303772255      762254        syn-C2H3C(O)NH2, v=0
  588537.9348  0.0315 -4.6858 3 1349.0141175  71510 303874344      874245        syn-C2H3C(O)NH2, v=0
  588537.9348  0.0315 -4.6858 3 1349.0141175  71510 303874345      874246        syn-C2H3C(O)NH2, v=0
  588605.8556  0.0102 -5.5487 3  830.7437155  71510 303772157      762156        syn-C2H3C(O)NH2, v=0
  588701.7370  0.0642 -5.6287 3 1874.1090217  71510 303A84464      A84365        syn-C2H3C(O)NH2, v=0
  588701.7370  0.0642 -5.6287 3 1874.1090217  71510 303A84465      A84366        syn-C2H3C(O)NH2, v=0
  588705.0576  0.0040 -5.1356 3  244.6548 89  71510 30344 936      44 639        syn-C2H3C(O)NH2, v=0
  588716.1050  0.0049 -4.6691 3  480.9380119  71510 303591644      591347        syn-C2H3C(O)NH2, v=0
  588893.3578  0.0112 -5.6489 3  877.1602157  71510 303782455      772454        syn-C2H3C(O)NH2, v=0
  588989.6865  0.0040 -4.2937 3  136.6862 71  71510 30335 431      34 332        syn-C2H3C(O)NH2, v=0
  588991.2387  0.0112 -5.6488 3  877.1646157  71510 303782454      772453        syn-C2H3C(O)NH2, v=0
  588992.6992  0.0040 -4.2937 3  136.6862 71  71510 30335 531      34 232        syn-C2H3C(O)NH2, v=0
  589010.1141  0.0130 -4.8213 3  638.1648137  71510 303681751      681454        syn-C2H3C(O)NH2, v=0
  589015.9633  0.0015 -3.0289 3  362.6401101  71510 303501734      491633        syn-C2H3C(O)NH2, v=0
  589047.4894  0.0308 -4.6495 3 1327.6993173  71510 303864343      864244        syn-C2H3C(O)NH2, v=0
  589047.4894  0.0308 -4.6495 3 1327.6993173  71510 303864344      864245        syn-C2H3C(O)NH2, v=0
  589064.8542  0.0107 -5.5639 3  845.9101159  71510 303791862      781861        syn-C2H3C(O)NH2, v=0
  589083.9908  0.0073 -3.7047 3  694.2291143  71510 303711854      701753        syn-C2H3C(O)NH2, v=0
  589180.0214  0.0021 -5.0719 3  212.9783 75  71510 303371621      371324        syn-C2H3C(O)NH2, v=0
  589189.4872  0.1017 -5.2987 3 1573.0645231  71510 303B511A4      B510A5        syn-C2H3C(O)NH2, v=0
  589189.4872  0.1017 -5.2987 3 1573.0645231  71510 303B512A4      B511A5        syn-C2H3C(O)NH2, v=0
  589290.3269  0.0121 -5.7922 3  941.5729159  71510 303792852      782851        syn-C2H3C(O)NH2, v=0
  589290.3522  0.0121 -5.7922 3  941.5729159  71510 303792851      782850        syn-C2H3C(O)NH2, v=0
  589312.8540  0.0021 -5.0717 3  212.9739 75  71510 303371622      371325        syn-C2H3C(O)NH2, v=0
  589362.9584  0.0015 -3.0285 3  362.6304101  71510 303501733      491634        syn-C2H3C(O)NH2, v=0
  589540.3059  0.0301 -4.6141 3 1306.6353171  71510 303854342      854243        syn-C2H3C(O)NH2, v=0
  589540.3059  0.0301 -4.6141 3 1306.6353171  71510 303854343      854244        syn-C2H3C(O)NH2, v=0
  589624.6875  0.0621 -5.5785 3 1847.5020215  71510 303A74463      A74364        syn-C2H3C(O)NH2, v=0
  589624.6875  0.0621 -5.5785 3 1847.5020215  71510 303A74464      A74365        syn-C2H3C(O)NH2, v=0
  589668.6649  0.0031 -5.5248 3   79.4475 51  71510 30325 917      24 420        syn-C2H3C(O)NH2, v=0
  589678.5654  0.0221 -5.6791 3  942.2166185  71510 30392 587      91 586        syn-C2H3C(O)NH2, v=0
  589678.5654  0.0221 -3.5335 3  942.2166185  71510 30392 587      91 686        syn-C2H3C(O)NH2, v=0
  589678.5654  0.0221 -3.5335 3  942.2166185  71510 30392 687      91 586        syn-C2H3C(O)NH2, v=0
  589678.5654  0.0221 -5.6791 3  942.2166185  71510 30392 687      91 686        syn-C2H3C(O)NH2, v=0
  589680.8413  0.0234 -5.6781 3  944.8192187  71510 30393 489      92 488        syn-C2H3C(O)NH2, v=0
  589680.8413  0.0234 -3.5192 3  944.8192187  71510 30393 489      92 588        syn-C2H3C(O)NH2, v=0
  589680.8413  0.0234 -3.5192 3  944.8192187  71510 30393 589      92 488        syn-C2H3C(O)NH2, v=0
  589680.8413  0.0234 -5.6781 3  944.8192187  71510 30393 589      92 588        syn-C2H3C(O)NH2, v=0
  589686.7389  0.0211 -5.6791 3  939.0848183  71510 30391 685      90 684        syn-C2H3C(O)NH2, v=0
  589686.7389  0.0211 -3.5478 3  939.0848183  71510 30391 685      90 784        syn-C2H3C(O)NH2, v=0
  589686.7389  0.0211 -3.5478 3  939.0848183  71510 30391 785      90 684        syn-C2H3C(O)NH2, v=0
  589686.7389  0.0211 -5.6791 3  939.0848183  71510 30391 785      90 784        syn-C2H3C(O)NH2, v=0
  589689.6330  0.0250 -5.6760 3  946.8990189  71510 30394 391      93 390        syn-C2H3C(O)NH2, v=0
  589689.6330  0.0250 -3.5048 3  946.8990189  71510 30394 391      93 490        syn-C2H3C(O)NH2, v=0
  589689.6330  0.0250 -3.5048 3  946.8990189  71510 30394 491      93 390        syn-C2H3C(O)NH2, v=0
  589689.6330  0.0250 -5.6760 3  946.8990189  71510 30394 491      93 490        syn-C2H3C(O)NH2, v=0
  589701.8282  0.0272 -5.6728 3  948.4616191  71510 30395 293      94 292        syn-C2H3C(O)NH2, v=0
  589701.8282  0.0272 -3.4901 3  948.4616191  71510 30395 293      94 392        syn-C2H3C(O)NH2, v=0
  589701.8282  0.0272 -3.4901 3  948.4616191  71510 30395 393      94 292        syn-C2H3C(O)NH2, v=0
  589701.8282  0.0272 -5.6728 3  948.4616191  71510 30395 393      94 392        syn-C2H3C(O)NH2, v=0
  589710.3916  0.0202 -5.6780 3  935.4162181  71510 30390 783      89 782        syn-C2H3C(O)NH2, v=0
  589710.3916  0.0202 -3.5621 3  935.4162181  71510 30390 783      89 882        syn-C2H3C(O)NH2, v=0
  589710.3916  0.0202 -3.5621 3  935.4162181  71510 30390 883      89 782        syn-C2H3C(O)NH2, v=0
  589710.3916  0.0202 -5.6780 3  935.4162181  71510 30390 883      89 882        syn-C2H3C(O)NH2, v=0
  589714.9391  0.0302 -5.6687 3  949.5116193  71510 30396 195      95 194        syn-C2H3C(O)NH2, v=0
  589714.9391  0.0302 -3.4751 3  949.5116193  71510 30396 195      95 294        syn-C2H3C(O)NH2, v=0
  589714.9391  0.0302 -3.4751 3  949.5116193  71510 30396 295      95 194        syn-C2H3C(O)NH2, v=0
  589714.9391  0.0302 -5.6687 3  949.5116193  71510 30396 295      95 294        syn-C2H3C(O)NH2, v=0
  589726.9576  0.0341 -5.6635 3  950.0531195  71510 30397 097      96 096        syn-C2H3C(O)NH2, v=0
  589726.9576  0.0341 -3.4599 3  950.0531195  71510 30397 097      96 196        syn-C2H3C(O)NH2, v=0
  589726.9576  0.0341 -3.4599 3  950.0531195  71510 30397 197      96 096        syn-C2H3C(O)NH2, v=0
  589726.9576  0.0341 -5.6635 3  950.0531195  71510 30397 197      96 196        syn-C2H3C(O)NH2, v=0
  589756.0417  0.0193 -5.6757 3  931.2018179  71510 30389 881      88 880        syn-C2H3C(O)NH2, v=0
  589756.0417  0.0193 -3.5767 3  931.2018179  71510 30389 881      88 980        syn-C2H3C(O)NH2, v=0
  589756.0417  0.0193 -3.5767 3  931.2018179  71510 30389 981      88 880        syn-C2H3C(O)NH2, v=0
  589756.0417  0.0193 -5.6757 3  931.2018179  71510 30389 981      88 980        syn-C2H3C(O)NH2, v=0
  589784.4816  0.0872 -4.8951 3 1216.1833211  71510 303A5 5A0      A5 4A1        syn-C2H3C(O)NH2, v=0
  589784.4816  0.0872 -4.8951 3 1216.1833211  71510 303A5 6A0      A5 5A1        syn-C2H3C(O)NH2, v=0
  589822.6144  0.0026 -3.6953 3  207.9842 81  71510 303401031      39 732        syn-C2H3C(O)NH2, v=0
  589832.2680  0.0185 -5.6723 3  926.4305177  71510 30388 979      87 978        syn-C2H3C(O)NH2, v=0
  589832.2680  0.0185 -3.5918 3  926.4305177  71510 30388 979      871078        syn-C2H3C(O)NH2, v=0
  589832.2680  0.0185 -3.5918 3  926.4305177  71510 303881079      87 978        syn-C2H3C(O)NH2, v=0
  589832.2680  0.0185 -5.6723 3  926.4305177  71510 303881079      871078        syn-C2H3C(O)NH2, v=0
  589892.7811  0.0107 -5.5625 3  845.8350159  71510 303791762      781761        syn-C2H3C(O)NH2, v=0
  589924.7258  0.0078 -4.7790 3  604.8214131  71510 303652045      651748        syn-C2H3C(O)NH2, v=0
  589950.5717  0.0176 -5.6677 3  921.0893175  71510 303871077      861076        syn-C2H3C(O)NH2, v=0
  589950.5717  0.0176 -3.6075 3  921.0893175  71510 303871077      861176        syn-C2H3C(O)NH2, v=0
  589950.5717  0.0176 -3.6075 3  921.0893175  71510 303871177      861076        syn-C2H3C(O)NH2, v=0
  589950.5717  0.0176 -5.6677 3  921.0893175  71510 303871177      861176        syn-C2H3C(O)NH2, v=0
  590016.8328  0.0295 -4.5793 3 1285.8220169  71510 303844341      844242        syn-C2H3C(O)NH2, v=0
  590016.8328  0.0295 -4.5793 3 1285.8220169  71510 303844342      844243        syn-C2H3C(O)NH2, v=0
  590126.7220  0.0168 -5.6617 3  915.1620173  71510 303861175      851174        syn-C2H3C(O)NH2, v=0
  590126.7220  0.0168 -3.6241 3  915.1620173  71510 303861175      851274        syn-C2H3C(O)NH2, v=0
  590126.7220  0.0168 -3.6241 3  915.1620173  71510 303861275      851174        syn-C2H3C(O)NH2, v=0
  590126.7220  0.0168 -5.6617 3  915.1620173  71510 303861275      851274        syn-C2H3C(O)NH2, v=0
  590130.1660  0.0899 -5.0550 3 1390.6219221  71510 303B0 8A2      B0 7A3        syn-C2H3C(O)NH2, v=0
  590130.1660  0.0899 -5.0550 3 1390.6219221  71510 303B0 9A2      B0 8A3        syn-C2H3C(O)NH2, v=0
  590366.4837  0.0102 -5.5450 3  834.7330157  71510 303781960      771959        syn-C2H3C(O)NH2, v=0
  590382.9475  0.0159 -3.6422 3  908.6282171  71510 303851273      841372        syn-C2H3C(O)NH2, v=0
  590382.9479  0.0159 -5.6544 3  908.6282171  71510 303851373      841372        syn-C2H3C(O)NH2, v=0
  590382.9482  0.0159 -5.6544 3  908.6282171  71510 303851273      841272        syn-C2H3C(O)NH2, v=0
  590382.9486  0.0159 -3.6422 3  908.6282171  71510 303851373      841272        syn-C2H3C(O)NH2, v=0
  590477.5066  0.0289 -4.5453 3 1265.2590167  71510 303834340      834241        syn-C2H3C(O)NH2, v=0
  590477.5066  0.0289 -4.5453 3 1265.2590167  71510 303834341      834242        syn-C2H3C(O)NH2, v=0
  590520.2026  0.0600 -5.5289 3 1821.1504213  71510 303A64462      A64363        syn-C2H3C(O)NH2, v=0
  590520.2026  0.0600 -5.5289 3 1821.1504213  71510 303A64463      A64364        syn-C2H3C(O)NH2, v=0
  590582.7793  0.1099 -5.4074 3 1644.2849235  71510 303B712A5      B711A6        syn-C2H3C(O)NH2, v=0
  590582.7793  0.1099 -5.4074 3 1644.2849235  71510 303B713A5      B712A6        syn-C2H3C(O)NH2, v=0
  590691.1556  0.0029 -3.7580 3  193.3111 79  71510 30339 931      38 632        syn-C2H3C(O)NH2, v=0
  590751.7035  0.0150 -3.6624 3  901.4621169  71510 303841371      831470        syn-C2H3C(O)NH2, v=0
  590751.7133  0.0150 -5.6456 3  901.4621169  71510 303841471      831470        syn-C2H3C(O)NH2, v=0
  590751.7214  0.0150 -5.6456 3  901.4621169  71510 303841371      831370        syn-C2H3C(O)NH2, v=0
  590751.7312  0.0150 -3.6624 3  901.4621169  71510 303841471      831370        syn-C2H3C(O)NH2, v=0
  590805.0305  0.0121 -5.7605 3  929.4670159  71510 303792753      782752        syn-C2H3C(O)NH2, v=0
  590805.3034  0.0121 -5.7605 3  929.4670159  71510 303792752      782751        syn-C2H3C(O)NH2, v=0
  590893.6432  0.0917 -4.8961 3 1111.4472205  71510 303A2 399      A2 2A0        syn-C2H3C(O)NH2, v=0
  590893.6432  0.0917 -4.8961 3 1111.4472205  71510 303A2 499      A2 3A0        syn-C2H3C(O)NH2, v=0
  590922.7524  0.0283 -4.5121 3 1244.9462165  71510 303824339      824240        syn-C2H3C(O)NH2, v=0
  590922.7524  0.0283 -4.5121 3 1244.9462165  71510 303824340      824241        syn-C2H3C(O)NH2, v=0
  591044.9538  0.0052 -4.6979 3  122.8095 63  71510 30331 922      30 625        syn-C2H3C(O)NH2, v=0
  591214.4470  0.0032 -3.8462 3  178.8118 77  71510 30338 731      37 632        syn-C2H3C(O)NH2, v=0
  591282.4101  0.0141 -3.6854 3  893.6293167  71510 303831469      821568        syn-C2H3C(O)NH2, v=0
  591282.6379  0.0141 -5.6352 3  893.6293167  71510 303831569      821568        syn-C2H3C(O)NH2, v=0
  591282.8172  0.0141 -5.6352 3  893.6293167  71510 303831469      821468        syn-C2H3C(O)NH2, v=0
  591283.0450  0.0141 -3.6854 3  893.6293167  71510 303831569      821468        syn-C2H3C(O)NH2, v=0
  591317.7092  0.0106 -3.7785 3  845.8350159  71510 303791862      781761        syn-C2H3C(O)NH2, v=0
  591318.7103  0.0042 -4.7288 3  422.7424109  71510 303541836      541539        syn-C2H3C(O)NH2, v=0
  591352.9847  0.0278 -4.4796 3 1224.8834163  71510 303814338      814239        syn-C2H3C(O)NH2, v=0
  591352.9847  0.0278 -4.4796 3 1224.8834163  71510 303814339      814240        syn-C2H3C(O)NH2, v=0
  591389.0572  0.0580 -5.4800 3 1795.0540211  71510 303A54461      A54362        syn-C2H3C(O)NH2, v=0
  591389.0572  0.0580 -5.4800 3 1795.0540211  71510 303A54462      A54363        syn-C2H3C(O)NH2, v=0
  591509.6531  0.0992 -5.1591 3 1009.6692199  71510 30399 198      99 099        syn-C2H3C(O)NH2, v=0
  591509.6531  0.0992 -5.1591 3 1009.6692199  71510 30399 298      99 199        syn-C2H3C(O)NH2, v=0
  591572.4085  0.0036 -4.1015 3  150.4759 73  71510 30336 531      35 432        syn-C2H3C(O)NH2, v=0
  591597.1030  0.0115 -4.8376 3  699.0489141  71510 303702149      701852        syn-C2H3C(O)NH2, v=0
  591599.5265  0.0036 -4.1014 3  150.4759 73  71510 30336 631      35 332        syn-C2H3C(O)NH2, v=0
  591706.1604  0.0187 -4.9117 3  800.1169151  71510 303752253      751956        syn-C2H3C(O)NH2, v=0
  591721.0292  0.0048 -4.7302 3  410.3074111  71510 303551442      551145        syn-C2H3C(O)NH2, v=0
  591746.6231  0.0114 -5.6210 3  867.5223157  71510 303782356      772355        syn-C2H3C(O)NH2, v=0
  591768.6071  0.0273 -4.4479 3 1205.0704161  71510 303804337      804238        syn-C2H3C(O)NH2, v=0
  591768.6071  0.0273 -4.4479 3 1205.0704161  71510 303804338      804239        syn-C2H3C(O)NH2, v=0
  591821.8248  0.1194 -5.5218 3 1716.7532239  71510 303B913A6      B912A7        syn-C2H3C(O)NH2, v=0
  591821.8248  0.1194 -5.5218 3 1716.7532239  71510 303B914A6      B913A7        syn-C2H3C(O)NH2, v=0
  591970.4821  0.0947 -5.1432 3 1458.6692225  71510 303B2 9A3      B2 8A4        syn-C2H3C(O)NH2, v=0
  591970.4821  0.0947 -5.1432 3 1458.6692225  71510 303B210A3      B2 9A4        syn-C2H3C(O)NH2, v=0
  592036.2215  0.0890 -4.9482 3 1281.0144215  71510 303A7 6A1      A7 5A2        syn-C2H3C(O)NH2, v=0
  592036.2215  0.0890 -4.9482 3 1281.0144215  71510 303A7 7A1      A7 6A2        syn-C2H3C(O)NH2, v=0
  592051.1227  0.0133 -3.7129 3  885.0832165  71510 303821567      811666        syn-C2H3C(O)NH2, v=0
  592055.5499  0.0133 -5.6229 3  885.0832165  71510 303821667      811666        syn-C2H3C(O)NH2, v=0
  592058.7960  0.0133 -5.6228 3  885.0829165  71510 303821567      811566        syn-C2H3C(O)NH2, v=0
  592063.2231  0.0133 -3.7129 3  885.0829165  71510 303821667      811566        syn-C2H3C(O)NH2, v=0
  592143.6729  0.0092 -5.5047 3  814.3638155  71510 303771859      761858        syn-C2H3C(O)NH2, v=0
  592170.0134  0.0269 -4.4170 3 1185.5070159  71510 303794336      794237        syn-C2H3C(O)NH2, v=0
  592170.0134  0.0269 -4.4170 3 1185.5070159  71510 303794337      794238        syn-C2H3C(O)NH2, v=0
  592195.2697  0.0285 -5.0035 3  907.9721161  71510 303802357      802060        syn-C2H3C(O)NH2, v=0
  592199.2487  0.0020 -4.6285 3  115.7134 59  71510 303291118      28 821        syn-C2H3C(O)NH2, v=0
  592210.2951  0.0021 -5.1249 3  203.7384 73  71510 303361620      361323        syn-C2H3C(O)NH2, v=0
  592231.9983  0.0562 -5.4317 3 1769.2125209  71510 303A44460      A44361        syn-C2H3C(O)NH2, v=0
  592231.9983  0.0562 -5.4317 3 1769.2125209  71510 303A44461      A44362        syn-C2H3C(O)NH2, v=0
  592277.6289  0.0021 -5.1248 3  203.7362 73  71510 303361621      361324        syn-C2H3C(O)NH2, v=0
  592359.1117  0.0031 -3.8450 3  178.8114 77  71510 30338 831      37 532        syn-C2H3C(O)NH2, v=0
  592385.2247  0.0116 -5.6201 3  867.5548157  71510 303782355      772354        syn-C2H3C(O)NH2, v=0
  592405.7884  0.0015 -2.9459 3  345.5752 97  71510 303481831      471730        syn-C2H3C(O)NH2, v=0
  592414.7549  0.0015 -2.9459 3  345.5750 97  71510 303481830      471731        syn-C2H3C(O)NH2, v=0
  592452.1572  0.0073 -4.7763 3  473.4464119  71510 303591445      591148        syn-C2H3C(O)NH2, v=0
  592456.3670  0.0100 -4.7997 3  580.6408131  71510 303651649      651352        syn-C2H3C(O)NH2, v=0
  592557.5878  0.0265 -4.3869 3 1166.1930157  71510 303784335      784236        syn-C2H3C(O)NH2, v=0
  592557.5878  0.0265 -4.3869 3 1166.1930157  71510 303784336      784237        syn-C2H3C(O)NH2, v=0
  592575.8770  0.0121 -5.7297 3  917.9495159  71510 303792654      782653        syn-C2H3C(O)NH2, v=0
  592578.5080  0.0121 -5.7297 3  917.9496159  71510 303792653      782652        syn-C2H3C(O)NH2, v=0
  592586.3651  0.0034 -3.9572 3  164.5243 75  71510 30337 631      36 532        syn-C2H3C(O)NH2, v=0
  592775.6508  0.0026 -3.2889 3  389.0070107  71510 303531538      521439        syn-C2H3C(O)NH2, v=0
  592781.9158  0.0033 -3.9569 3  164.5243 75  71510 30337 731      36 432        syn-C2H3C(O)NH2, v=0
  592902.6364  0.1304 -5.6416 3 1790.4644243  71510 303C114A7      C113A8        syn-C2H3C(O)NH2, v=0
  592902.6364  0.1304 -5.6416 3 1790.4644243  71510 303C115A7      C114A8        syn-C2H3C(O)NH2, v=0
  592931.7052  0.0261 -4.3577 3 1147.1282155  71510 303774334      774235        syn-C2H3C(O)NH2, v=0
  592931.7052  0.0261 -4.3577 3 1147.1282155  71510 303774335      774236        syn-C2H3C(O)NH2, v=0
  593049.7457  0.0544 -5.3841 3 1743.6256207  71510 303A34459      A34360        syn-C2H3C(O)NH2, v=0
  593049.7457  0.0544 -5.3841 3 1743.6256207  71510 303A34460      A34361        syn-C2H3C(O)NH2, v=0
  593067.7645  0.0026 -4.7525 3  337.7635 97  71510 303481732      481435        syn-C2H3C(O)NH2, v=0
  593108.4163  0.0022 -2.5686 3  264.0939 57  71510 3032828 0      2727 1        syn-C2H3C(O)NH2, v=0
  593108.4163  0.0022 -2.5686 3  264.0939 57  71510 3032828 1      2727 0        syn-C2H3C(O)NH2, v=0
  593127.3124  0.0125 -3.7475 3  875.7570163  71510 303811665      801764        syn-C2H3C(O)NH2, v=0
  593166.9815  0.0027 -4.7861 3  325.7893 95  71510 303471730      471433        syn-C2H3C(O)NH2, v=0
  593197.7266  0.0125 -5.6083 3  875.7570163  71510 303811765      801764        syn-C2H3C(O)NH2, v=0
  593215.8896  0.0092 -5.4403 3  780.3294151  71510 303751956      741955        syn-C2H3C(O)NH2, v=0
  593245.0363  0.0125 -5.6082 3  875.7530163  71510 303811665      801664        syn-C2H3C(O)NH2, v=0
  593261.7742  0.0044 -3.6130 3  269.9133 91  71510 303451134      441035        syn-C2H3C(O)NH2, v=0
  593292.7313  0.0258 -4.3293 3 1128.3124153  71510 303764333      764234        syn-C2H3C(O)NH2, v=0
  593292.7313  0.0258 -4.3293 3 1128.3124153  71510 303764334      764235        syn-C2H3C(O)NH2, v=0
  593315.4505  0.0125 -3.7472 3  875.7530163  71510 303811765      801664        syn-C2H3C(O)NH2, v=0
  593377.7911  0.0053 -3.5224 3  549.8527127  71510 303631747      621646        syn-C2H3C(O)NH2, v=0
  593402.7962  0.0918 -4.8991 3 1174.3115209  71510 303A4 4A0      A4 3A1        syn-C2H3C(O)NH2, v=0
  593402.7962  0.0918 -4.8991 3 1174.3115209  71510 303A4 5A0      A4 4A1        syn-C2H3C(O)NH2, v=0
  593546.6772  0.0019 -2.5899 3  265.4631 61  71510 3033027 3      2926 4        syn-C2H3C(O)NH2, v=0
  593546.6772  0.0019 -2.5899 3  265.4631 61  71510 3033027 4      2926 3        syn-C2H3C(O)NH2, v=0
  593589.5860  0.0017 -3.1728 3  394.8256107  71510 303531637      521538        syn-C2H3C(O)NH2, v=0
  593641.0234  0.0255 -4.3017 3 1109.7454151  71510 303754332      754233        syn-C2H3C(O)NH2, v=0
  593641.0234  0.0255 -4.3017 3 1109.7454151  71510 303754333      754234        syn-C2H3C(O)NH2, v=0
  593647.4960  0.0036 -5.2647 3  232.8531 83  71510 303411328      41 833        syn-C2H3C(O)NH2, v=0
  593668.4417  0.1006 -5.2396 3 1527.9792229  71510 303B410A4      B4 9A5        syn-C2H3C(O)NH2, v=0
  593668.4417  0.1006 -5.2396 3 1527.9792229  71510 303B411A4      B410A5        syn-C2H3C(O)NH2, v=0
  593769.1592  0.0083 -4.7840 3  525.7320125  71510 303621547      621250        syn-C2H3C(O)NH2, v=0
  593820.9019  0.1429 -5.7664 3 1865.4135247  71510 303C315A8      C314A9        syn-C2H3C(O)NH2, v=0
  593820.9019  0.1429 -5.7664 3 1865.4135247  71510 303C316A8      C315A9        syn-C2H3C(O)NH2, v=0
  593842.9945  0.0527 -5.3372 3 1718.2930205  71510 303A24458      A24359        syn-C2H3C(O)NH2, v=0
  593842.9945  0.0527 -5.3372 3 1718.2930205  71510 303A24459      A24360        syn-C2H3C(O)NH2, v=0
  593928.9317  0.0119 -3.7960 3  865.5592161  71510 303801763      791862        syn-C2H3C(O)NH2, v=0
  593972.8032  0.0017 -2.6132 3  268.2992 65  71510 3033226 6      3125 7        syn-C2H3C(O)NH2, v=0
  593972.8032  0.0017 -2.6132 3  268.2992 65  71510 3033226 7      3125 6        syn-C2H3C(O)NH2, v=0
  593976.9305  0.0252 -4.2750 3 1091.4271149  71510 303744331      744232        syn-C2H3C(O)NH2, v=0
  593976.9305  0.0252 -4.2750 3 1091.4271149  71510 303744332      744233        syn-C2H3C(O)NH2, v=0
  594058.4762  0.0014 -2.8801 3  330.3315 93  71510 303461928      451827        syn-C2H3C(O)NH2, v=0
  594058.6188  0.0014 -2.8801 3  330.3315 93  71510 303461927      451828        syn-C2H3C(O)NH2, v=0
  594155.0158  0.0918 -5.0163 3 1347.1224219  71510 303A9 7A2      A9 6A3        syn-C2H3C(O)NH2, v=0
  594155.0158  0.0918 -5.0163 3 1347.1224219  71510 303A9 8A2      A9 7A3        syn-C2H3C(O)NH2, v=0
  594263.5675  0.0980 -4.9816 3 1070.5489203  71510 303A1 299      A1 1A0        syn-C2H3C(O)NH2, v=0
  594263.5675  0.0980 -4.9816 3 1070.5489203  71510 303A1 399      A1 2A0        syn-C2H3C(O)NH2, v=0
  594300.7934  0.0250 -4.2493 3 1073.3572147  71510 303734330      734231        syn-C2H3C(O)NH2, v=0
  594300.7934  0.0250 -4.2493 3 1073.3572147  71510 303734331      734232        syn-C2H3C(O)NH2, v=0
  594312.4089  0.0049 -4.6652 3  518.0106123  71510 303611745      611448        syn-C2H3C(O)NH2, v=0
  594350.1438  0.0036 -3.7048 3  217.6430 83  71510 30341 932      40 833        syn-C2H3C(O)NH2, v=0
  594374.8710  0.0016 -2.6390 3  272.6098 69  71510 3033425 9      332410        syn-C2H3C(O)NH2, v=0
  594374.8710  0.0016 -2.6390 3  272.6098 69  71510 303342510      3324 9        syn-C2H3C(O)NH2, v=0
  594571.9494  0.1572 -5.8959 3 1941.5951251  71510 303C516A9      C515B0        syn-C2H3C(O)NH2, v=0
  594571.9494  0.1572 -5.8959 3 1941.5951251  71510 303C517A9      C516B0        syn-C2H3C(O)NH2, v=0
  594606.7236  0.0024 -5.4905 3   70.5618 43  71510 303211210      20 911        syn-C2H3C(O)NH2, v=0
  594612.4154  0.0510 -5.2909 3 1693.2144203  71510 303A14457      A14358        syn-C2H3C(O)NH2, v=0
  594612.4154  0.0510 -5.2909 3 1693.2144203  71510 303A14458      A14359        syn-C2H3C(O)NH2, v=0
  594612.9454  0.0248 -4.2244 3 1055.5356145  71510 303724329      724230        syn-C2H3C(O)NH2, v=0
  594612.9454  0.0248 -4.2244 3 1055.5356145  71510 303724330      724231        syn-C2H3C(O)NH2, v=0
  594613.5340  0.0135 -5.8814 3  987.0440161  71510 303803051      793050        syn-C2H3C(O)NH2, v=0
  594613.5343  0.0135 -5.8814 3  987.0440161  71510 303803050      793049        syn-C2H3C(O)NH2, v=0
  594616.8743  0.0024 -5.4905 3   70.5615 43  71510 3032112 9      20 912        syn-C2H3C(O)NH2, v=0
  594644.0625  0.0335 -4.2030 3  952.3812167  71510 303832063      822162        syn-C2H3C(O)NH2, v=0
  594684.2971  0.0122 -5.7000 3  907.0488159  71510 303792555      782554        syn-C2H3C(O)NH2, v=0
  594706.6592  0.0123 -5.7000 3  907.0498159  71510 303792554      782553        syn-C2H3C(O)NH2, v=0
  594734.2828  0.0016 -2.6679 3  278.4053 73  71510 303362412      352313        syn-C2H3C(O)NH2, v=0
  594734.2828  0.0016 -2.6679 3  278.4053 73  71510 303362413      352312        syn-C2H3C(O)NH2, v=0
  594736.0804  0.0115 -5.5946 3  858.6098157  71510 303782257      772256        syn-C2H3C(O)NH2, v=0
  594800.6441  0.0755 -5.1617 3 1059.7430175  71510 303872364      872067        syn-C2H3C(O)NH2, v=0
  594820.9438  0.0118 -5.5910 3  865.5592161  71510 303801863      791862        syn-C2H3C(O)NH2, v=0
  594857.1320  0.0045 -4.8566 3  344.4520103  71510 303511140      51 843        syn-C2H3C(O)NH2, v=0
  594865.0210  0.0014 -2.8250 3  316.7839 89  71510 303442025      431924        syn-C2H3C(O)NH2, v=0
  594865.0224  0.0014 -2.8250 3  316.7839 89  71510 303442024      431925        syn-C2H3C(O)NH2, v=0
  594913.7119  0.0246 -4.2005 3 1037.9622143  71510 303714328      714229        syn-C2H3C(O)NH2, v=0
  594913.7119  0.0246 -4.2005 3 1037.9622143  71510 303714329      714230        syn-C2H3C(O)NH2, v=0
  594915.7084  0.0038 -4.6557 3  494.3156119  71510 303591842      591545        syn-C2H3C(O)NH2, v=0
  594937.2908  0.0021 -5.1813 3  194.7647 71  71510 303351619      351322        syn-C2H3C(O)NH2, v=0
  594953.7185  0.0040 -4.6550 3  509.4799121  71510 303601843      601546        syn-C2H3C(O)NH2, v=0
  594970.4945  0.0021 -5.1812 3  194.7635 71  71510 303351620      351323        syn-C2H3C(O)NH2, v=0
  595003.7030  0.0015 -3.0518 3  375.2136103  71510 303511735      501634        syn-C2H3C(O)NH2, v=0
  595022.2544  0.0015 -2.7002 3  285.6990 77  71510 303382315      372216        syn-C2H3C(O)NH2, v=0
  595022.2544  0.0015 -2.7002 3  285.6990 77  71510 303382316      372215        syn-C2H3C(O)NH2, v=0
  595057.3920  0.0021 -3.6717 3  222.7552 83  71510 303411131      40 832        syn-C2H3C(O)NH2, v=0
  595179.5561  0.0014 -2.7778 3  304.8592 85  71510 303422121      412022        syn-C2H3C(O)NH2, v=0
  595179.5561  0.0014 -2.7778 3  304.8592 85  71510 303422122      412021        syn-C2H3C(O)NH2, v=0
  595194.1094  0.0014 -2.7365 3  294.5089 81  71510 303402218      392119        syn-C2H3C(O)NH2, v=0
  595194.1094  0.0014 -2.7365 3  294.5089 81  71510 303402219      392118        syn-C2H3C(O)NH2, v=0
  595203.4115  0.0244 -4.1776 3 1020.6367141  71510 303704327      704228        syn-C2H3C(O)NH2, v=0
  595203.4115  0.0244 -4.1776 3 1020.6367141  71510 303704328      704229        syn-C2H3C(O)NH2, v=0
  595210.8884  0.0373 -5.1179 3 1022.5568171  71510 303852461      852164        syn-C2H3C(O)NH2, v=0
  595220.9499  0.1078 -5.3431 3 1598.5471233  71510 303B611A5      B610A6        syn-C2H3C(O)NH2, v=0
  595220.9499  0.1078 -5.3431 3 1598.5471233  71510 303B612A5      B611A6        syn-C2H3C(O)NH2, v=0
  595301.3019  0.0108 -5.5552 3  842.5706157  71510 303782059      772058        syn-C2H3C(O)NH2, v=0
  595353.8597  0.0117 -5.5901 3  865.5117161  71510 303801763      791762        syn-C2H3C(O)NH2, v=0
  595358.6569  0.0495 -5.2452 3 1668.3896201  71510 303A04456      A04357        syn-C2H3C(O)NH2, v=0
  595358.6569  0.0495 -5.2452 3 1668.3896201  71510 303A04457      A04358        syn-C2H3C(O)NH2, v=0
  595482.3553  0.0243 -4.1558 3 1003.5590139  71510 303694326      694227        syn-C2H3C(O)NH2, v=0
  595482.3553  0.0243 -4.1558 3 1003.5590139  71510 303694327      694228        syn-C2H3C(O)NH2, v=0
  595632.6476  0.0015 -3.0510 3  375.1962103  71510 303511734      501635        syn-C2H3C(O)NH2, v=0
  595699.3251  0.0239 -5.7067 3  961.8862187  71510 30393 588      92 587        syn-C2H3C(O)NH2, v=0
  595699.3251  0.0239 -3.5603 3  961.8862187  71510 30393 588      92 687        syn-C2H3C(O)NH2, v=0
  595699.3251  0.0239 -3.5603 3  961.8862187  71510 30393 688      92 587        syn-C2H3C(O)NH2, v=0
  595699.3251  0.0239 -5.7067 3  961.8862187  71510 30393 688      92 687        syn-C2H3C(O)NH2, v=0
  595702.2907  0.0252 -5.7057 3  964.4888189  71510 30394 490      93 489        syn-C2H3C(O)NH2, v=0
  595702.2907  0.0252 -3.5462 3  964.4888189  71510 30394 490      93 589        syn-C2H3C(O)NH2, v=0
  595702.2907  0.0252 -3.5462 3  964.4888189  71510 30394 590      93 489        syn-C2H3C(O)NH2, v=0
  595702.2907  0.0252 -5.7057 3  964.4888189  71510 30394 590      93 589        syn-C2H3C(O)NH2, v=0
  595706.4083  0.0228 -5.7066 3  958.7547185  71510 30392 686      91 685        syn-C2H3C(O)NH2, v=0
  595706.4083  0.0228 -3.5743 3  958.7547185  71510 30392 686      91 785        syn-C2H3C(O)NH2, v=0
  595706.4083  0.0228 -3.5743 3  958.7547185  71510 30392 786      91 685        syn-C2H3C(O)NH2, v=0
  595706.4083  0.0228 -5.7066 3  958.7547185  71510 30392 786      91 785        syn-C2H3C(O)NH2, v=0
  595711.4939  0.0270 -5.7037 3  966.5689191  71510 30395 392      94 391        syn-C2H3C(O)NH2, v=0
  595711.4939  0.0270 -3.5320 3  966.5689191  71510 30395 392      94 491        syn-C2H3C(O)NH2, v=0
  595711.4939  0.0270 -3.5320 3  966.5689191  71510 30395 492      94 391        syn-C2H3C(O)NH2, v=0
  595711.4939  0.0270 -5.7037 3  966.5689191  71510 30395 492      94 491        syn-C2H3C(O)NH2, v=0
  595723.9100  0.0293 -5.7006 3  968.1319193  71510 30396 294      95 293        syn-C2H3C(O)NH2, v=0
  595723.9100  0.0293 -3.5176 3  968.1319193  71510 30396 294      95 393        syn-C2H3C(O)NH2, v=0
  595723.9100  0.0293 -3.5176 3  968.1319193  71510 30396 394      95 293        syn-C2H3C(O)NH2, v=0
  595723.9100  0.0293 -5.7006 3  968.1319193  71510 30396 394      95 393        syn-C2H3C(O)NH2, v=0
  595728.3960  0.0218 -5.7054 3  955.0869183  71510 30391 784      90 783        syn-C2H3C(O)NH2, v=0
  595728.3960  0.0218 -3.5883 3  955.0869183  71510 30391 784      90 883        syn-C2H3C(O)NH2, v=0
  595728.3960  0.0218 -3.5883 3  955.0869183  71510 30391 884      90 783        syn-C2H3C(O)NH2, v=0
  595728.3960  0.0218 -5.7054 3  955.0869183  71510 30391 884      90 883        syn-C2H3C(O)NH2, v=0
  595737.1132  0.0325 -5.6965 3  969.1824195  71510 30397 196      96 195        syn-C2H3C(O)NH2, v=0
  595737.1132  0.0325 -3.5028 3  969.1824195  71510 30397 196      96 295        syn-C2H3C(O)NH2, v=0
  595737.1132  0.0325 -3.5028 3  969.1824195  71510 30397 296      96 195        syn-C2H3C(O)NH2, v=0
  595737.1132  0.0325 -5.6965 3  969.1824195  71510 30397 296      96 295        syn-C2H3C(O)NH2, v=0
  595749.1402  0.0366 -5.6914 3  969.7243197  71510 30398 098      97 097        syn-C2H3C(O)NH2, v=0
  595749.1402  0.0366 -3.4877 3  969.7243197  71510 30398 098      97 197        syn-C2H3C(O)NH2, v=0
  595749.1402  0.0366 -3.4877 3  969.7243197  71510 30398 198      97 097        syn-C2H3C(O)NH2, v=0
  595749.1402  0.0366 -5.6914 3  969.7243197  71510 30398 198      97 197        syn-C2H3C(O)NH2, v=0
  595750.8479  0.0242 -4.1350 3  986.7289137  71510 303684325      684226        syn-C2H3C(O)NH2, v=0
  595750.8479  0.0242 -4.1350 3  986.7289137  71510 303684326      684227        syn-C2H3C(O)NH2, v=0
  595753.1862  0.0031 -4.4692 3  134.4091 65  71510 303321022      31 725        syn-C2H3C(O)NH2, v=0
  595771.5571  0.0209 -5.7031 3  950.8739181  71510 30390 882      89 881        syn-C2H3C(O)NH2, v=0
  595771.5571  0.0209 -3.6026 3  950.8739181  71510 30390 882      89 981        syn-C2H3C(O)NH2, v=0
  595771.5571  0.0209 -3.6026 3  950.8739181  71510 30390 982      89 881        syn-C2H3C(O)NH2, v=0
  595771.5571  0.0209 -5.7031 3  950.8739181  71510 30390 982      89 981        syn-C2H3C(O)NH2, v=0
  595784.6293  0.0928 -4.9329 3 1238.4619213  71510 303A6 5A1      A6 4A2        syn-C2H3C(O)NH2, v=0
  595784.6293  0.0928 -4.9329 3 1238.4619213  71510 303A6 6A1      A6 5A2        syn-C2H3C(O)NH2, v=0
  595825.8825  0.0134 -5.8476 3  973.8586161  71510 303802952      792951        syn-C2H3C(O)NH2, v=0
  595825.8868  0.0134 -5.8476 3  973.8586161  71510 303802951      792950        syn-C2H3C(O)NH2, v=0
  595844.1067  0.0200 -5.6996 3  946.1052179  71510 30389 980      88 979        syn-C2H3C(O)NH2, v=0
  595844.1067  0.0200 -3.6172 3  946.1052179  71510 30389 980      881079        syn-C2H3C(O)NH2, v=0
  595844.1067  0.0200 -3.6172 3  946.1052179  71510 303891080      88 979        syn-C2H3C(O)NH2, v=0
  595844.1067  0.0200 -5.6996 3  946.1052179  71510 303891080      881079        syn-C2H3C(O)NH2, v=0
  595957.0048  0.0191 -5.6949 3  940.7680177  71510 303881078      871077        syn-C2H3C(O)NH2, v=0
  595957.0048  0.0191 -3.6324 3  940.7680177  71510 303881078      871177        syn-C2H3C(O)NH2, v=0
  595957.0048  0.0191 -3.6324 3  940.7680177  71510 303881178      871077        syn-C2H3C(O)NH2, v=0
  595957.0048  0.0191 -5.6949 3  940.7680177  71510 303881178      871177        syn-C2H3C(O)NH2, v=0
  596009.1871  0.0241 -4.1153 3  970.1463135  71510 303674324      674225        syn-C2H3C(O)NH2, v=0
  596009.1871  0.0241 -4.1153 3  970.1463135  71510 303674325      674226        syn-C2H3C(O)NH2, v=0
  596052.9279  0.0200 -4.0279 3  902.8123163  71510 303811962      802061        syn-C2H3C(O)NH2, v=0
  596082.3460  0.0480 -5.2003 3 1643.8183199  71510 303994455      994356        syn-C2H3C(O)NH2, v=0
  596082.3460  0.0480 -5.2003 3 1643.8183199  71510 303994456      994357        syn-C2H3C(O)NH2, v=0
  596095.8389  0.3546 -5.7219 3 1605.4973215  71510 303A72879      A62978        syn-C2H3C(O)NH2, v=0
  596125.1916  0.0182 -5.6890 3  934.8465175  71510 303871176      861175        syn-C2H3C(O)NH2, v=0
  596125.1916  0.0182 -3.6486 3  934.8465175  71510 303871176      861275        syn-C2H3C(O)NH2, v=0
  596125.1916  0.0182 -3.6486 3  934.8465175  71510 303871276      861175        syn-C2H3C(O)NH2, v=0
  596125.1916  0.0182 -5.6890 3  934.8465175  71510 303871276      861275        syn-C2H3C(O)NH2, v=0
  596138.4166  0.0956 -5.0961 3 1414.5028223  71510 303B1 8A3      B1 7A4        syn-C2H3C(O)NH2, v=0
  596138.4166  0.0956 -5.0961 3 1414.5028223  71510 303B1 9A3      B1 8A4        syn-C2H3C(O)NH2, v=0
  596165.2388  0.0664 -5.0934 3  985.8812169  71510 303842262      841965        syn-C2H3C(O)NH2, v=0
  596180.2231  0.0038 -5.7654 3  174.8782 71  71510 303351322      35 827        syn-C2H3C(O)NH2, v=0
  596222.4494  0.0100 -5.5347 3  834.1156157  71510 303781860      771859        syn-C2H3C(O)NH2, v=0
  596245.8719  0.0116 -3.7925 3  865.5117161  71510 303801863      791762        syn-C2H3C(O)NH2, v=0
  596257.6644  0.0241 -4.0967 3  953.8110133  71510 303664323      664224        syn-C2H3C(O)NH2, v=0
  596257.6644  0.0241 -4.0967 3  953.8110133  71510 303664324      664225        syn-C2H3C(O)NH2, v=0
  596364.7487  0.0303 -5.2731 3 1167.4457183  71510 303912566      912269        syn-C2H3C(O)NH2, v=0
  596369.5818  0.0172 -3.6660 3  928.3213173  71510 303861274      851373        syn-C2H3C(O)NH2, v=0
  596369.5820  0.0172 -5.6816 3  928.3213173  71510 303861374      851373        syn-C2H3C(O)NH2, v=0
  596369.5821  0.0172 -5.6816 3  928.3213173  71510 303861274      851273        syn-C2H3C(O)NH2, v=0
  596369.5823  0.0172 -3.6660 3  928.3213173  71510 303861374      851273        syn-C2H3C(O)NH2, v=0
  596392.3844  0.0112 -5.5717 3  854.4255159  71510 303791961      781960        syn-C2H3C(O)NH2, v=0
  596496.5650  0.0240 -4.0794 3  937.7228131  71510 303654322      654223        syn-C2H3C(O)NH2, v=0
  596496.5650  0.0240 -4.0794 3  937.7228131  71510 303654323      654224        syn-C2H3C(O)NH2, v=0
  596505.4340  0.0036 -4.6606 3  479.3740117  71510 303581841      581544        syn-C2H3C(O)NH2, v=0
  596527.8189  0.0044 -4.7829 3  376.7757107  71510 303531341      531044        syn-C2H3C(O)NH2, v=0
  596568.7149  0.0113 -5.5718 3  850.3775157  71510 303782158      772157        syn-C2H3C(O)NH2, v=0
  596624.6799  0.1162 -5.4531 3 1670.3679237  71510 303B812A6      B811A7        syn-C2H3C(O)NH2, v=0
  596624.6799  0.1162 -5.4531 3 1670.3679237  71510 303B813A6      B812A7        syn-C2H3C(O)NH2, v=0
  596712.0395  0.0133 -3.8862 3  874.3190161  71510 303801862      791961        syn-C2H3C(O)NH2, v=0
  596720.4513  0.0163 -3.6853 3  921.1674171  71510 303851372      841471        syn-C2H3C(O)NH2, v=0
  596720.4566  0.0163 -5.6728 3  921.1674171  71510 303851472      841471        syn-C2H3C(O)NH2, v=0
  596720.4611  0.0163 -5.6728 3  921.1674171  71510 303851372      841371        syn-C2H3C(O)NH2, v=0
  596720.4664  0.0163 -3.6853 3  921.1674171  71510 303851472      841371        syn-C2H3C(O)NH2, v=0
  596726.1679  0.0240 -4.0633 3  921.8816129  71510 303644321      644222        syn-C2H3C(O)NH2, v=0
  596726.1679  0.0240 -4.0633 3  921.8816129  71510 303644322      644223        syn-C2H3C(O)NH2, v=0
  596784.0891  0.0466 -5.1560 3 1619.5003197  71510 303984454      984355        syn-C2H3C(O)NH2, v=0
  596784.0891  0.0466 -5.1560 3 1619.5003197  71510 303984455      984356        syn-C2H3C(O)NH2, v=0
  596841.7959  0.0042 -4.6590 3  524.8601123  71510 303611844      611547        syn-C2H3C(O)NH2, v=0
  596895.0562  0.0974 -4.9319 3 1132.7238207  71510 303A3 3A0      A3 2A1        syn-C2H3C(O)NH2, v=0
  596895.0562  0.0974 -4.9319 3 1132.7238207  71510 303A3 4A0      A3 3A1        syn-C2H3C(O)NH2, v=0
  596946.7462  0.0240 -4.0486 3  906.2873127  71510 303634320      634221        syn-C2H3C(O)NH2, v=0
  596946.7462  0.0240 -4.0486 3  906.2873127  71510 303634321      634222        syn-C2H3C(O)NH2, v=0
  596951.5698  0.0422 -5.3016 3 1191.1944185  71510 303922567      922270        syn-C2H3C(O)NH2, v=0
  596961.3417  0.0040 -3.6610 3  243.1793 87  71510 303431033      42 934        syn-C2H3C(O)NH2, v=0
  597142.4163  0.0074 -3.6911 3  675.9330141  71510 303701853      691752        syn-C2H3C(O)NH2, v=0
  597158.5674  0.0241 -4.0354 3  890.9397125  71510 303624319      624220        syn-C2H3C(O)NH2, v=0
  597158.5674  0.0241 -4.0354 3  890.9397125  71510 303624320      624221        syn-C2H3C(O)NH2, v=0
  597207.6000  0.0133 -5.8148 3  961.2295161  71510 303802853      792852        syn-C2H3C(O)NH2, v=0
  597207.6493  0.0133 -5.8148 3  961.2295161  71510 303802852      792851        syn-C2H3C(O)NH2, v=0
  597223.4724  0.0154 -3.7074 3  913.3524169  71510 303841470      831569        syn-C2H3C(O)NH2, v=0
  597223.5993  0.0154 -5.6624 3  913.3524169  71510 303841570      831569        syn-C2H3C(O)NH2, v=0
  597223.7002  0.0154 -5.6624 3  913.3524169  71510 303841470      831469        syn-C2H3C(O)NH2, v=0
  597223.8271  0.0154 -3.7074 3  913.3524169  71510 303841570      831469        syn-C2H3C(O)NH2, v=0
  597227.6719  0.0124 -5.6712 3  896.8035159  71510 303792456      782455        syn-C2H3C(O)NH2, v=0
  597361.8932  0.0241 -4.0236 3  875.8386123  71510 303614318      614219        syn-C2H3C(O)NH2, v=0
  597361.8932  0.0241 -4.0236 3  875.8386123  71510 303614319      614220        syn-C2H3C(O)NH2, v=0
  597392.2662  0.0125 -5.6710 3  896.8112159  71510 303792455      782454        syn-C2H3C(O)NH2, v=0
  597395.9234  0.0021 -5.2413 3  186.0549 69  71510 303341618      341321        syn-C2H3C(O)NH2, v=0
  597411.8360  0.0021 -5.2413 3  186.0544 69  71510 303341619      341322        syn-C2H3C(O)NH2, v=0
  597424.2725  0.0786 -5.2453 3 1136.1429181  71510 303902466      902169        syn-C2H3C(O)NH2, v=0
  597464.4738  0.0453 -5.1123 3 1595.4352195  71510 303974453      974354        syn-C2H3C(O)NH2, v=0
  597464.4738  0.0453 -5.1123 3 1595.4352195  71510 303974454      974355        syn-C2H3C(O)NH2, v=0
  597481.3806  0.0125 -5.5365 3  831.3861155  71510 303772156      762155        syn-C2H3C(O)NH2, v=0
  597517.3422  0.1052 -5.1927 3 1029.9429201  71510 303A0 199      A0 0A0        syn-C2H3C(O)NH2, v=0
  597517.3422  0.1052 -5.1927 3 1029.9429201  71510 303A0 299      A0 1A0        syn-C2H3C(O)NH2, v=0
  597556.9798  0.0242 -4.0136 3  860.9839121  71510 303604317      604218        syn-C2H3C(O)NH2, v=0
  597556.9798  0.0242 -4.0136 3  860.9839121  71510 303604318      604219        syn-C2H3C(O)NH2, v=0
  597744.0780  0.0243 -4.0052 3  846.3755119  71510 303594316      594217        syn-C2H3C(O)NH2, v=0
  597744.0780  0.0243 -4.0052 3  846.3755119  71510 303594317      594218        syn-C2H3C(O)NH2, v=0
  597876.0500  0.1261 -5.5688 3 1743.4367241  71510 303C013A7      C012A8        syn-C2H3C(O)NH2, v=0
  597876.0500  0.1261 -5.5688 3 1743.4367241  71510 303C014A7      C013A8        syn-C2H3C(O)NH2, v=0
  597923.4335  0.0244 -3.9989 3  832.0133117  71510 303584315      584216        syn-C2H3C(O)NH2, v=0
  597923.4335  0.0244 -3.9989 3  832.0133117  71510 303584316      584217        syn-C2H3C(O)NH2, v=0
  597949.3634  0.0145 -3.7334 3  904.8320167  71510 303831568      821667        syn-C2H3C(O)NH2, v=0
  597951.8041  0.0115 -5.4828 3  805.2613153  71510 303762056      752055        syn-C2H3C(O)NH2, v=0
  597951.9041  0.0145 -5.6501 3  904.8320167  71510 303831668      821667        syn-C2H3C(O)NH2, v=0
  597953.7905  0.0145 -5.6501 3  904.8319167  71510 303831568      821567        syn-C2H3C(O)NH2, v=0
  597956.3313  0.0145 -3.7334 3  904.8319167  71510 303831668      821567        syn-C2H3C(O)NH2, v=0
  597983.8053  0.1006 -5.1856 3 1483.1506227  71510 303B3 9A4      B3 8A5        syn-C2H3C(O)NH2, v=0
  597983.8053  0.1006 -5.1856 3 1483.1506227  71510 303B310A4      B3 9A5        syn-C2H3C(O)NH2, v=0
  598037.0459  0.0947 -4.9873 3 1303.8940217  71510 303A8 6A2      A8 5A3        syn-C2H3C(O)NH2, v=0
  598037.0459  0.0947 -4.9873 3 1303.8940217  71510 303A8 7A2      A8 6A3        syn-C2H3C(O)NH2, v=0
  598064.6108  0.0126 -5.5902 3  858.8087157  71510 303782256      772255        syn-C2H3C(O)NH2, v=0
  598095.2866  0.0245 -3.9946 3  817.8970115  71510 303574314      574215        syn-C2H3C(O)NH2, v=0
  598095.2866  0.0245 -3.9946 3  817.8970115  71510 303574315      574216        syn-C2H3C(O)NH2, v=0
  598106.2200  0.0020 -4.5626 3  122.9906 61  71510 303301119      29 822        syn-C2H3C(O)NH2, v=0
  598124.0689  0.0440 -5.0694 3 1571.6228193  71510 303964452      964353        syn-C2H3C(O)NH2, v=0
  598124.0689  0.0440 -5.0694 3 1571.6228193  71510 303964453      964354        syn-C2H3C(O)NH2, v=0
  598259.8726  0.0246 -3.9928 3  804.0266113  71510 303564313      564214        syn-C2H3C(O)NH2, v=0
  598259.8726  0.0246 -3.9928 3  804.0266113  71510 303564314      564215        syn-C2H3C(O)NH2, v=0
  598417.4221  0.0248 -3.9935 3  790.4019111  71510 303554312      554213        syn-C2H3C(O)NH2, v=0
  598417.4221  0.0248 -3.9935 3  790.4019111  71510 303554313      554214        syn-C2H3C(O)NH2, v=0
  598465.7172  0.0025 -4.7802 3  325.6123 95  71510 303471731      471434        syn-C2H3C(O)NH2, v=0
  598568.1605  0.0249 -3.9973 3  777.0229109  71510 303544311      544212        syn-C2H3C(O)NH2, v=0
  598568.1605  0.0249 -3.9973 3  777.0229109  71510 303544312      544213        syn-C2H3C(O)NH2, v=0
  598615.6051  0.0049 -5.0185 3  116.7185 69  71510 30334 232      33 133        syn-C2H3C(O)NH2, v=0
  598615.6132  0.0049 -5.0185 3  116.7185 69  71510 30334 332      33 033        syn-C2H3C(O)NH2, v=0
  598712.3086  0.0251 -4.0045 3  763.8893107  71510 303534310      534211        syn-C2H3C(O)NH2, v=0
  598712.3086  0.0251 -4.0045 3  763.8893107  71510 303534311      534212        syn-C2H3C(O)NH2, v=0
  598763.4261  0.0428 -5.0271 3 1548.0630191  71510 303954451      954352        syn-C2H3C(O)NH2, v=0
  598763.4261  0.0428 -5.0271 3 1548.0630191  71510 303954452      954353        syn-C2H3C(O)NH2, v=0
  598803.0307  0.0133 -5.7832 3  949.1742161  71510 303802754      792753        syn-C2H3C(O)NH2, v=0
  598803.5442  0.0133 -5.7832 3  949.1742161  71510 303802753      792752        syn-C2H3C(O)NH2, v=0
  598850.0823  0.0253 -4.0157 3  751.0011105  71510 3035243 9      524210        syn-C2H3C(O)NH2, v=0
  598850.0823  0.0253 -4.0157 3  751.0011105  71510 303524310      524211        syn-C2H3C(O)NH2, v=0
  598971.1974  0.1374 -5.6898 3 1817.7484245  71510 303C214A8      C213A9        syn-C2H3C(O)NH2, v=0
  598971.1974  0.1374 -5.6898 3 1817.7484245  71510 303C215A8      C214A9        syn-C2H3C(O)NH2, v=0
  598981.5296  0.0136 -3.7658 3  895.5439165  71510 303821666      811765        syn-C2H3C(O)NH2, v=0
  598981.6932  0.0255 -4.0317 3  738.3581103  71510 3035143 8      5142 9        syn-C2H3C(O)NH2, v=0
  598981.6932  0.0255 -4.0317 3  738.3581103  71510 3035143 9      514210        syn-C2H3C(O)NH2, v=0
  599008.7005  0.0015 -2.9639 3  357.5466 99  71510 303491832      481731        syn-C2H3C(O)NH2, v=0
  599023.3621  0.0136 -5.6357 3  895.5439165  71510 303821766      811765        syn-C2H3C(O)NH2, v=0
  599026.6687  0.0015 -2.9639 3  357.5461 99  71510 303491831      481732        syn-C2H3C(O)NH2, v=0
  599051.9438  0.0136 -5.6356 3  895.5416165  71510 303821666      811665        syn-C2H3C(O)NH2, v=0
  599093.7764  0.0136 -3.7657 3  895.5416165  71510 303821766      811665        syn-C2H3C(O)NH2, v=0
  599107.3481  0.0257 -4.0534 3  725.9603101  71510 3035043 7      5042 8        syn-C2H3C(O)NH2, v=0
  599107.3481  0.0257 -4.0534 3  725.9603101  71510 3035043 8      5042 9        syn-C2H3C(O)NH2, v=0
  599227.2493  0.0259 -4.0824 3  713.8074 99  71510 3034943 6      4942 7        syn-C2H3C(O)NH2, v=0
  599227.2493  0.0259 -4.0824 3  713.8074 99  71510 3034943 7      4942 8        syn-C2H3C(O)NH2, v=0
  599341.5947  0.0261 -4.1208 3  701.8994 97  71510 3034843 5      4842 6        syn-C2H3C(O)NH2, v=0
  599341.5947  0.0261 -4.1208 3  701.8994 97  71510 3034843 6      4842 7        syn-C2H3C(O)NH2, v=0
  599383.0804  0.0416 -4.9855 3 1524.7554189  71510 303944450      944351        syn-C2H3C(O)NH2, v=0
  599383.0804  0.0416 -4.9855 3 1524.7554189  71510 303944451      944352        syn-C2H3C(O)NH2, v=0
  599402.3084  0.0976 -4.9362 3 1196.1894211  71510 303A5 4A1      A5 3A2        syn-C2H3C(O)NH2, v=0
  599402.3084  0.0976 -4.9362 3 1196.1894211  71510 303A5 5A1      A5 4A2        syn-C2H3C(O)NH2, v=0
  599450.5778  0.0264 -4.1717 3  690.2363 95  71510 3034743 4      4742 5        syn-C2H3C(O)NH2, v=0
  599450.5778  0.0264 -4.1717 3  690.2363 95  71510 3034743 5      4742 6        syn-C2H3C(O)NH2, v=0
  599466.4065  0.0035 -4.6691 3  464.6628115  71510 303571840      571543        syn-C2H3C(O)NH2, v=0
  599554.3880  0.0266 -4.2407 3  678.8178 93  71510 3034643 3      4642 4        syn-C2H3C(O)NH2, v=0
  599554.3880  0.0266 -4.2407 3  678.8178 93  71510 3034643 4      4642 5        syn-C2H3C(O)NH2, v=0
  599614.2672  0.0021 -5.3053 3  177.6076 67  71510 303331617      331320        syn-C2H3C(O)NH2, v=0
  599621.6696  0.0021 -5.3053 3  177.6074 67  71510 303331618      331321        syn-C2H3C(O)NH2, v=0
  599653.2099  0.0269 -4.3382 3  667.6438 91  71510 3034543 2      4542 3        syn-C2H3C(O)NH2, v=0
  599653.2099  0.0269 -4.3382 3  667.6438 91  71510 3034543 3      4542 4        syn-C2H3C(O)NH2, v=0
  599688.3773  0.1067 -5.2833 3 1553.0611231  71510 303B510A5      B5 9A6        syn-C2H3C(O)NH2, v=0
  599688.3773  0.1067 -5.2833 3 1553.0611231  71510 303B511A5      B510A6        syn-C2H3C(O)NH2, v=0
  599747.2245  0.0271 -4.4871 3  656.7143 89  71510 3034443 1      4442 2        syn-C2H3C(O)NH2, v=0
  599747.2245  0.0271 -4.4871 3  656.7143 89  71510 3034443 2      4442 3        syn-C2H3C(O)NH2, v=0
  599836.6080  0.0274 -4.7613 3  646.0292 87  71510 3034343 0      4342 1        syn-C2H3C(O)NH2, v=0
  599836.6080  0.0274 -4.7613 3  646.0292 87  71510 3034343 1      4342 2        syn-C2H3C(O)NH2, v=0
  599905.9499  0.1503 -5.8159 3 1893.2980249  71510 303C415A9      C414B0        syn-C2H3C(O)NH2, v=0
  599905.9499  0.1503 -5.8159 3 1893.2980249  71510 303C416A9      C415B0        syn-C2H3C(O)NH2, v=0
  599983.5511  0.0406 -4.9446 3 1501.6998187  71510 303934449      934350        syn-C2H3C(O)NH2, v=0
  599983.5511  0.0406 -4.9446 3 1501.6998187  71510 303934450      934351        syn-C2H3C(O)NH2, v=0
  600013.9397  0.0057 -5.7718 3  176.6045 79  71510 30339 534      39 237        syn-C2H3C(O)NH2, v=0
  600018.2104  0.0057 -5.7718 3  176.6045 79  71510 30339 634      39 337        syn-C2H3C(O)NH2, v=0
  600020.1286  0.0129 -3.8100 3  885.4003163  71510 303811764      801863        syn-C2H3C(O)NH2, v=0
  600157.8104  0.0976 -5.0567 3 1370.6028221  71510 303B0 7A3      B0 6A4        syn-C2H3C(O)NH2, v=0
  600157.8104  0.0976 -5.0567 3 1370.6028221  71510 303B0 8A3      B0 7A4        syn-C2H3C(O)NH2, v=0
  600175.5465  0.0097 -5.4659 3  800.1169153  71510 303761957      751956        syn-C2H3C(O)NH2, v=0
  600206.3521  0.0126 -5.6435 3  887.2608159  71510 303792357      782356        syn-C2H3C(O)NH2, v=0
  600267.0689  0.1040 -5.0166 3 1091.4245205  71510 303A2 2A0      A2 1A1        syn-C2H3C(O)NH2, v=0
  600267.0689  0.1040 -5.0166 3 1091.4245205  71510 303A2 3A0      A2 2A1        syn-C2H3C(O)NH2, v=0
  600379.6947  0.0021 -2.5736 3  270.9048 59  71510 3032928 1      2827 2        syn-C2H3C(O)NH2, v=0
  600379.6947  0.0021 -2.5736 3  270.9048 59  71510 3032928 2      2827 1        syn-C2H3C(O)NH2, v=0
  600396.7511  0.0542 -5.0368 3  914.5737163  71510 303812160      811863        syn-C2H3C(O)NH2, v=0
  600479.4018  0.0026 -4.8134 3  313.8388 93  71510 303461729      461432        syn-C2H3C(O)NH2, v=0
  600500.0209  0.0778 -5.8602 3 2002.6024225  71510 303B24567      B24468        syn-C2H3C(O)NH2, v=0
  600500.0209  0.0778 -5.8602 3 2002.6024225  71510 303B24568      B24469        syn-C2H3C(O)NH2, v=0
  600562.9359  0.0110 -5.5646 3  854.0034159  71510 303791861      781860        syn-C2H3C(O)NH2, v=0
  600565.3423  0.0395 -4.9043 3 1478.8959185  71510 303924448      924349        syn-C2H3C(O)NH2, v=0
  600565.3423  0.0395 -4.9043 3 1478.8959185  71510 303924449      924350        syn-C2H3C(O)NH2, v=0
  600573.2958  0.0128 -5.6186 3  885.4003163  71510 303811864      801863        syn-C2H3C(O)NH2, v=0
  600675.4465  0.0134 -5.7526 3  937.7157161  71510 303802655      792654        syn-C2H3C(O)NH2, v=0
  600680.2097  0.0134 -5.7526 3  937.7159161  71510 303802654      792653        syn-C2H3C(O)NH2, v=0
  600741.7259  0.0016 -3.0764 3  388.0657105  71510 303521736      511635        syn-C2H3C(O)NH2, v=0
  600753.9833  0.0046 -4.6679 3  540.4500125  71510 303621845      621548        syn-C2H3C(O)NH2, v=0
  600765.4169  0.0024 -5.3770 3   75.7548 45  71510 303221211      21 912        syn-C2H3C(O)NH2, v=0
  600790.0512  0.0023 -5.3770 3   75.7540 45  71510 303221210      21 913        syn-C2H3C(O)NH2, v=0
  600815.2169  0.0019 -2.5953 3  272.7670 63  71510 3033127 4      3026 5        syn-C2H3C(O)NH2, v=0
  600815.2169  0.0019 -2.5953 3  272.7670 63  71510 3033127 5      3026 4        syn-C2H3C(O)NH2, v=0
  600912.1407  0.0128 -5.6181 3  885.3706163  71510 303811764      801763        syn-C2H3C(O)NH2, v=0
  600918.2697  0.0015 -2.8952 3  341.7388 95  71510 303471929      461828        syn-C2H3C(O)NH2, v=0
  600918.5856  0.0015 -2.8952 3  341.7388 95  71510 303471928      461829        syn-C2H3C(O)NH2, v=0
  601128.9438  0.0386 -4.8648 3 1456.3437183  71510 303914447      914348        syn-C2H3C(O)NH2, v=0
  601128.9438  0.0386 -4.8648 3 1456.3437183  71510 303914448      914349        syn-C2H3C(O)NH2, v=0
  601222.7402  0.0131 -5.6421 3  887.3146159  71510 303792356      782355        syn-C2H3C(O)NH2, v=0
  601235.5279  0.0017 -2.6193 3  276.0983 67  71510 3033326 7      3225 8        syn-C2H3C(O)NH2, v=0
  601235.5279  0.0017 -2.6193 3  276.0983 67  71510 3033326 8      3225 7        syn-C2H3C(O)NH2, v=0
  601249.1246  0.1141 -5.3881 3 1624.2294235  71510 303B711A6      B710A7        syn-C2H3C(O)NH2, v=0
  601249.1246  0.1141 -5.3881 3 1624.2294235  71510 303B712A6      B711A7        syn-C2H3C(O)NH2, v=0
  601359.8941  0.0041 -4.8497 3  344.4523103  71510 303511240      51 943        syn-C2H3C(O)NH2, v=0
  601393.3218  0.3041 -5.5261 3 1514.6739209  71510 303A42777      A32876        syn-C2H3C(O)NH2, v=0
  601465.3080  0.0127 -3.8078 3  885.3706163  71510 303811864      801763        syn-C2H3C(O)NH2, v=0
  601468.5433  0.0752 -5.8076 3 1975.0050223  71510 303B14566      B14467        syn-C2H3C(O)NH2, v=0
  601468.5433  0.0752 -5.8076 3 1975.0050223  71510 303B14567      B14468        syn-C2H3C(O)NH2, v=0
  601615.6369  0.0022 -5.3737 3  169.4211 65  71510 303321616      321319        syn-C2H3C(O)NH2, v=0
  601618.9747  0.0022 -5.3737 3  169.4210 65  71510 303321617      321320        syn-C2H3C(O)NH2, v=0
  601627.2609  0.0016 -2.6459 3  280.9070 71  71510 303352510      342411        syn-C2H3C(O)NH2, v=0
  601627.2609  0.0016 -2.6459 3  280.9070 71  71510 303352511      342410        syn-C2H3C(O)NH2, v=0
  601674.8317  0.0377 -4.8260 3 1434.0427181  71510 303904446      904347        syn-C2H3C(O)NH2, v=0
  601674.8317  0.0377 -4.8260 3 1434.0427181  71510 303904447      904348        syn-C2H3C(O)NH2, v=0
  601719.3182  0.0258 -5.7348 3  981.7566189  71510 30394 589      93 588        syn-C2H3C(O)NH2, v=0
  601719.3182  0.0258 -3.5877 3  981.7566189  71510 30394 589      93 688        syn-C2H3C(O)NH2, v=0
  601719.3182  0.0258 -3.5877 3  981.7566189  71510 30394 689      93 588        syn-C2H3C(O)NH2, v=0
  601719.3182  0.0258 -5.7348 3  981.7566189  71510 30394 689      93 688        syn-C2H3C(O)NH2, v=0
  601722.9527  0.0272 -5.7339 3  984.3593191  71510 30395 491      94 490        syn-C2H3C(O)NH2, v=0
  601722.9527  0.0272 -3.5738 3  984.3593191  71510 30395 491      94 590        syn-C2H3C(O)NH2, v=0
  601722.9527  0.0272 -3.5738 3  984.3593191  71510 30395 591      94 490        syn-C2H3C(O)NH2, v=0
  601722.9527  0.0272 -5.7339 3  984.3593191  71510 30395 591      94 590        syn-C2H3C(O)NH2, v=0
  601725.3470  0.0246 -5.7346 3  978.6253187  71510 30393 687      92 686        syn-C2H3C(O)NH2, v=0
  601725.3470  0.0246 -3.6014 3  978.6253187  71510 30393 687      92 786        syn-C2H3C(O)NH2, v=0
  601725.3470  0.0246 -3.6014 3  978.6253187  71510 30393 787      92 686        syn-C2H3C(O)NH2, v=0
  601725.3470  0.0246 -5.7346 3  978.6253187  71510 30393 787      92 786        syn-C2H3C(O)NH2, v=0
  601732.5564  0.0291 -5.7319 3  986.4397193  71510 30396 393      95 392        syn-C2H3C(O)NH2, v=0
  601732.5564  0.0291 -3.5598 3  986.4397193  71510 30396 393      95 492        syn-C2H3C(O)NH2, v=0
  601732.5564  0.0291 -3.5598 3  986.4397193  71510 30396 493      95 392        syn-C2H3C(O)NH2, v=0
  601732.5564  0.0291 -5.7319 3  986.4397193  71510 30396 493      95 492        syn-C2H3C(O)NH2, v=0
  601745.1878  0.0316 -5.7289 3  988.0031195  71510 30397 295      96 294        syn-C2H3C(O)NH2, v=0
  601745.1878  0.0316 -3.5456 3  988.0031195  71510 30397 295      96 394        syn-C2H3C(O)NH2, v=0
  601745.1878  0.0316 -3.5456 3  988.0031195  71510 30397 395      96 294        syn-C2H3C(O)NH2, v=0
  601745.1878  0.0316 -5.7289 3  988.0031195  71510 30397 395      96 394        syn-C2H3C(O)NH2, v=0
  601745.7300  0.0235 -5.7334 3  974.9582185  71510 30392 785      91 784        syn-C2H3C(O)NH2, v=0
  601745.7300  0.0235 -3.6151 3  974.9582185  71510 30392 785      91 884        syn-C2H3C(O)NH2, v=0
  601745.7300  0.0235 -3.6151 3  974.9582185  71510 30392 885      91 784        syn-C2H3C(O)NH2, v=0
  601745.7300  0.0235 -5.7334 3  974.9582185  71510 30392 885      91 884        syn-C2H3C(O)NH2, v=0
  601746.8188  0.0018 -3.2073 3  408.2748109  71510 303541638      531539        syn-C2H3C(O)NH2, v=0
  601758.4811  0.0349 -5.7249 3  989.0540197  71510 30398 197      97 196        syn-C2H3C(O)NH2, v=0
  601758.4811  0.0349 -3.5310 3  989.0540197  71510 30398 197      97 296        syn-C2H3C(O)NH2, v=0
  601758.4811  0.0349 -3.5310 3  989.0540197  71510 30398 297      97 196        syn-C2H3C(O)NH2, v=0
  601758.4811  0.0349 -5.7249 3  989.0540197  71510 30398 297      97 296        syn-C2H3C(O)NH2, v=0
  601770.5157  0.0391 -5.7199 3  989.5963199  71510 30399 099      98 098        syn-C2H3C(O)NH2, v=0
  601770.5157  0.0391 -3.5161 3  989.5963199  71510 30399 099      98 198        syn-C2H3C(O)NH2, v=0
  601770.5157  0.0391 -3.5161 3  989.5963199  71510 30399 199      98 098        syn-C2H3C(O)NH2, v=0
  601770.5157  0.0391 -5.7199 3  989.5963199  71510 30399 199      98 198        syn-C2H3C(O)NH2, v=0
  601783.3997  0.0987 -4.9713 3 1260.9410215  71510 303A7 5A2      A7 4A3        syn-C2H3C(O)NH2, v=0
  601783.3997  0.0987 -4.9713 3 1260.9410215  71510 303A7 6A2      A7 5A3        syn-C2H3C(O)NH2, v=0
  601786.5005  0.0225 -5.7310 3  970.7467183  71510 30391 883      90 882        syn-C2H3C(O)NH2, v=0
  601786.5005  0.0225 -3.6290 3  970.7467183  71510 30391 883      90 982        syn-C2H3C(O)NH2, v=0
  601786.5005  0.0225 -3.6290 3  970.7467183  71510 30391 983      90 882        syn-C2H3C(O)NH2, v=0
  601786.5005  0.0225 -5.7310 3  970.7467183  71510 30391 983      90 982        syn-C2H3C(O)NH2, v=0
  601855.5320  0.0216 -5.7275 3  965.9804181  71510 30390 981      89 980        syn-C2H3C(O)NH2, v=0
  601855.5320  0.0216 -3.6433 3  965.9804181  71510 30390 981      891080        syn-C2H3C(O)NH2, v=0
  601855.5320  0.0216 -3.6433 3  965.9804181  71510 303901081      89 980        syn-C2H3C(O)NH2, v=0
  601855.5320  0.0216 -5.7275 3  965.9804181  71510 303901081      891080        syn-C2H3C(O)NH2, v=0
  601858.8354  0.0016 -3.0750 3  388.0351105  71510 303521735      511636        syn-C2H3C(O)NH2, v=0
  601875.7177  0.0014 -2.8381 3  327.6482 91  71510 303452026      441925        syn-C2H3C(O)NH2, v=0
  601875.7212  0.0014 -2.8381 3  327.6482 91  71510 303452025      441926        syn-C2H3C(O)NH2, v=0
  601963.2790  0.0206 -5.7227 3  960.6470179  71510 303891079      881078        syn-C2H3C(O)NH2, v=0
  601963.2790  0.0206 -3.6581 3  960.6470179  71510 303891079      881178        syn-C2H3C(O)NH2, v=0
  601963.2790  0.0206 -3.6581 3  960.6470179  71510 303891179      881078        syn-C2H3C(O)NH2, v=0
  601963.2790  0.0206 -5.7227 3  960.6470179  71510 303891179      881178        syn-C2H3C(O)NH2, v=0
  601969.7498  0.0016 -2.6756 3  287.2039 75  71510 303372413      362314        syn-C2H3C(O)NH2, v=0
  601969.7498  0.0016 -2.6756 3  287.2039 75  71510 303372414      362313        syn-C2H3C(O)NH2, v=0
  602079.9655  0.0117 -5.5811 3  862.4277159  71510 303792060      782059        syn-C2H3C(O)NH2, v=0
  602123.9138  0.0196 -5.7167 3  954.7311177  71510 303881177      871176        syn-C2H3C(O)NH2, v=0
  602123.9138  0.0196 -3.6737 3  954.7311177  71510 303881177      871276        syn-C2H3C(O)NH2, v=0
  602123.9138  0.0196 -3.6737 3  954.7311177  71510 303881277      871176        syn-C2H3C(O)NH2, v=0
  602123.9138  0.0196 -5.7167 3  954.7311177  71510 303881277      871276        syn-C2H3C(O)NH2, v=0
  602144.5366  0.1016 -5.1378 3 1438.5838225  71510 303B2 8A4      B2 7A5        syn-C2H3C(O)NH2, v=0
  602144.5366  0.1016 -5.1378 3 1438.5838225  71510 303B2 9A4      B2 8A5        syn-C2H3C(O)NH2, v=0
  602203.4690  0.0368 -4.7879 3 1411.9929179  71510 303894445      894346        syn-C2H3C(O)NH2, v=0
  602203.4690  0.0368 -4.7879 3 1411.9929179  71510 303894446      894347        syn-C2H3C(O)NH2, v=0
  602231.1842  0.0015 -2.7089 3  295.0035 79  71510 303392316      382217        syn-C2H3C(O)NH2, v=0
  602231.1842  0.0015 -2.7089 3  295.0035 79  71510 303392317      382216        syn-C2H3C(O)NH2, v=0
  602285.7001  0.0014 -2.7891 3  315.1944 87  71510 303432123      422022        syn-C2H3C(O)NH2, v=0
  602285.7002  0.0014 -2.7891 3  315.1944 87  71510 303432122      422023        syn-C2H3C(O)NH2, v=0
  602305.0622  0.0122 -5.5992 3  874.3190161  71510 303801962      791961        syn-C2H3C(O)NH2, v=0
  602357.1440  0.0186 -3.6905 3  948.2140175  71510 303871275      861374        syn-C2H3C(O)NH2, v=0
  602357.1441  0.0186 -5.7094 3  948.2140175  71510 303871375      861374        syn-C2H3C(O)NH2, v=0
  602357.1442  0.0186 -5.7094 3  948.2140175  71510 303871275      861274        syn-C2H3C(O)NH2, v=0
  602357.1443  0.0186 -3.6905 3  948.2140175  71510 303871375      861274        syn-C2H3C(O)NH2, v=0
  602362.3252  0.0015 -2.7465 3  304.3250 83  71510 303412219      402120        syn-C2H3C(O)NH2, v=0
  602362.3252  0.0015 -2.7465 3  304.3250 83  71510 303412220      402119        syn-C2H3C(O)NH2, v=0
  602409.0641  0.0728 -5.7557 3 1947.6633221  71510 303B04565      B04466        syn-C2H3C(O)NH2, v=0
  602409.0641  0.0728 -5.7557 3 1947.6633221  71510 303B04566      B04467        syn-C2H3C(O)NH2, v=0
  602527.5090  0.0048 -3.4793 3  533.5122125  71510 303621746      611645        syn-C2H3C(O)NH2, v=0
  602662.8166  0.1228 -5.4993 3 1696.6505239  71510 303B912A7      B911A8        syn-C2H3C(O)NH2, v=0
  602662.8166  0.1228 -5.4993 3 1696.6505239  71510 303B913A7      B912A8        syn-C2H3C(O)NH2, v=0
  602691.2654  0.0177 -3.7090 3  941.0719173  71510 303861373      851472        syn-C2H3C(O)NH2, v=0
  602691.2683  0.0177 -5.7006 3  941.0719173  71510 303861473      851472        syn-C2H3C(O)NH2, v=0
  602691.2707  0.0177 -5.7006 3  941.0719173  71510 303861373      851372        syn-C2H3C(O)NH2, v=0
  602691.2735  0.0177 -3.7090 3  941.0719173  71510 303861473      851372        syn-C2H3C(O)NH2, v=0
  602709.0685  0.0039 -4.9351 3  313.3509 99  71510 303491039      49 742        syn-C2H3C(O)NH2, v=0
  602715.3062  0.0360 -4.7505 3 1390.1939177  71510 303884444      884345        syn-C2H3C(O)NH2, v=0
  602715.3062  0.0360 -4.7505 3 1390.1939177  71510 303884445      884346        syn-C2H3C(O)NH2, v=0
  602895.4195  0.1034 -4.9682 3 1154.2010209  71510 303A4 3A1      A4 2A2        syn-C2H3C(O)NH2, v=0
  602895.4195  0.1034 -4.9682 3 1154.2010209  71510 303A4 4A1      A4 3A2        syn-C2H3C(O)NH2, v=0
  602904.6333  0.0399 -5.2605 3 1143.8164181  71510 303902565      902268        syn-C2H3C(O)NH2, v=0
  602913.3517  0.0136 -5.7230 3  926.8854161  71510 303802556      792555        syn-C2H3C(O)NH2, v=0
  602952.1893  0.0136 -5.7230 3  926.8871161  71510 303802555      792554        syn-C2H3C(O)NH2, v=0
  603098.8181  0.0127 -5.6176 3  878.4480159  71510 303792258      782257        syn-C2H3C(O)NH2, v=0
  603168.5600  0.0167 -3.7301 3  933.2736171  71510 303851471      841570        syn-C2H3C(O)NH2, v=0
  603168.6305  0.0167 -5.6901 3  933.2736171  71510 303851571      841570        syn-C2H3C(O)NH2, v=0
  603168.6870  0.0167 -5.6901 3  933.2736171  71510 303851471      841470        syn-C2H3C(O)NH2, v=0
  603168.7574  0.0167 -3.7301 3  933.2736171  71510 303851571      841470        syn-C2H3C(O)NH2, v=0
  603210.7817  0.0352 -4.7138 3 1368.6456175  71510 303874443      874344        syn-C2H3C(O)NH2, v=0
  603210.7817  0.0352 -4.7138 3 1368.6456175  71510 303874444      874345        syn-C2H3C(O)NH2, v=0
  603322.3655  0.0704 -5.7044 3 1920.5771219  71510 303A94564      A94465        syn-C2H3C(O)NH2, v=0
  603322.3655  0.0704 -5.7044 3 1920.5771219  71510 303A94565      A94466        syn-C2H3C(O)NH2, v=0
  603419.9422  0.0022 -5.4467 3  161.4941 63  71510 303311615      311318        syn-C2H3C(O)NH2, v=0
  603421.3986  0.0022 -5.4467 3  161.4941 63  71510 303311616      311319        syn-C2H3C(O)NH2, v=0
  603441.4452  0.0044 -4.5688 3  130.3472 71  71510 30335 332      34 233        syn-C2H3C(O)NH2, v=0
  603441.5767  0.0044 -4.5688 3  130.3472 71  71510 30335 432      34 133        syn-C2H3C(O)NH2, v=0
  603523.4137  0.0055 -4.7479 3  501.7733119  71510 303591940      591643        syn-C2H3C(O)NH2, v=0
  603523.9062  0.0034 -4.6806 3  450.1897113  71510 303561839      561542        syn-C2H3C(O)NH2, v=0
  603524.1944  0.1114 -5.2269 3 1050.4175203  71510 303A1 1A0      A1 0A1        syn-C2H3C(O)NH2, v=0
  603524.1944  0.1114 -5.2269 3 1050.4175203  71510 303A1 2A0      A1 1A1        syn-C2H3C(O)NH2, v=0
  603525.0782  0.0041 -3.4193 3  370.2386105  71510 303521438      511339        syn-C2H3C(O)NH2, v=0
  603681.6312  0.0025 -4.8098 3  313.7318 93  71510 303461730      461433        syn-C2H3C(O)NH2, v=0
  603690.3226  0.0345 -4.6778 3 1347.3478173  71510 303864442      864343        syn-C2H3C(O)NH2, v=0
  603690.3226  0.0345 -4.6778 3 1347.3478173  71510 303864443      864344        syn-C2H3C(O)NH2, v=0
  603697.7462  0.0147 -5.8708 3  993.7332163  71510 303812953      802952        syn-C2H3C(O)NH2, v=0
  603697.7547  0.0147 -5.8708 3  993.7332163  71510 303812952      802951        syn-C2H3C(O)NH2, v=0
  603732.9198  0.0040 -5.2594 3  243.1369 85  71510 303421329      42 834        syn-C2H3C(O)NH2, v=0
  603854.4493  0.0157 -3.7548 3  924.7775169  71510 303841569      831668        syn-C2H3C(O)NH2, v=0
  603855.9000  0.0157 -5.6779 3  924.7775169  71510 303841669      831668        syn-C2H3C(O)NH2, v=0
  603856.9900  0.0157 -5.6779 3  924.7775169  71510 303841569      831568        syn-C2H3C(O)NH2, v=0
  603858.4408  0.0157 -3.7548 3  924.7775169  71510 303841669      831568        syn-C2H3C(O)NH2, v=0
  603925.9785  0.1330 -5.6162 3 1770.3196243  71510 303C113A8      C112A9        syn-C2H3C(O)NH2, v=0
  603925.9785  0.1330 -5.6162 3 1770.3196243  71510 303C114A8      C113A9        syn-C2H3C(O)NH2, v=0
  603994.6736  0.1067 -5.2286 3 1507.8321229  71510 303B4 9A5      B4 8A6        syn-C2H3C(O)NH2, v=0
  603994.6736  0.1067 -5.2286 3 1507.8321229  71510 303B410A5      B4 9A6        syn-C2H3C(O)NH2, v=0
  604036.2820  0.1007 -5.0269 3 1326.9740219  71510 303A9 6A3      A9 5A4        syn-C2H3C(O)NH2, v=0
  604036.2820  0.1007 -5.0269 3 1326.9740219  71510 303A9 7A3      A9 6A4        syn-C2H3C(O)NH2, v=0
  604149.6970  0.0050 -5.5133 3  201.4147 83  71510 30341 635      41 338        syn-C2H3C(O)NH2, v=0
  604154.3448  0.0339 -4.6426 3 1326.3003171  71510 303854441      854342        syn-C2H3C(O)NH2, v=0
  604154.3448  0.0339 -4.6426 3 1326.3003171  71510 303854442      854343        syn-C2H3C(O)NH2, v=0
  604168.8157  0.0050 -5.5133 3  201.4147 83  71510 30341 735      41 438        syn-C2H3C(O)NH2, v=0
  604209.2009  0.0682 -5.6537 3 1893.7460217  71510 303A84563      A84464        syn-C2H3C(O)NH2, v=0
  604209.2009  0.0682 -5.6537 3 1893.7460217  71510 303A84564      A84465        syn-C2H3C(O)NH2, v=0
  604285.5359  0.0051 -4.6983 3  495.6762121  71510 303601645      601348        syn-C2H3C(O)NH2, v=0
  604327.1469  0.0124 -5.5960 3  870.2768159  71510 303792159      782158        syn-C2H3C(O)NH2, v=0
  604357.0260  0.0519 -4.3713 3 1024.8594173  71510 303862165      852264        syn-C2H3C(O)NH2, v=0
  604482.8697  0.0037 -4.7428 3  408.7799107  71510 303531835      531538        syn-C2H3C(O)NH2, v=0
  604501.1447  0.0140 -3.8914 3  894.4097163  71510 303811863      801962        syn-C2H3C(O)NH2, v=0
  604512.8780  0.0034 -5.4605 3   85.4481 53  71510 30326 918      25 421        syn-C2H3C(O)NH2, v=0
  604603.2537  0.0332 -4.6081 3 1305.5028169  71510 303844440      844341        syn-C2H3C(O)NH2, v=0
  604603.2537  0.0332 -4.6081 3 1305.5028169  71510 303844441      844342        syn-C2H3C(O)NH2, v=0
  604795.0877  0.0020 -4.5035 3  130.5079 63  71510 303311120      30 823        syn-C2H3C(O)NH2, v=0
  604836.8457  0.0148 -3.7852 3  915.5252167  71510 303831667      821766        syn-C2H3C(O)NH2, v=0
  604861.5395  0.0148 -5.6636 3  915.5252167  71510 303831767      821766        syn-C2H3C(O)NH2, v=0
  604878.6783  0.0148 -5.6636 3  915.5238167  71510 303831667      821666        syn-C2H3C(O)NH2, v=0
  604903.3721  0.0148 -3.7851 3  915.5238167  71510 303831767      821666        syn-C2H3C(O)NH2, v=0
  605015.2737  0.0728 -5.3473 3 1215.0628187  71510 303932568      932271        syn-C2H3C(O)NH2, v=0
  605034.8671  0.1447 -5.7385 3 1845.2317247  71510 303C314A9      C313B0        syn-C2H3C(O)NH2, v=0
  605034.8671  0.1447 -5.7385 3 1845.2317247  71510 303C315A9      C314B0        syn-C2H3C(O)NH2, v=0
  605037.4446  0.0327 -4.5744 3 1284.9552167  71510 303834439      834340        syn-C2H3C(O)NH2, v=0
  605037.4446  0.0327 -4.5744 3 1284.9552167  71510 303834440      834341        syn-C2H3C(O)NH2, v=0
  605044.5714  0.0023 -5.5250 3  153.8253 61  71510 303301614      301317        syn-C2H3C(O)NH2, v=0
  605045.1851  0.0023 -5.5250 3  153.8253 61  71510 303301615      301318        syn-C2H3C(O)NH2, v=0
  605070.2965  0.0660 -5.6037 3 1867.1697215  71510 303A74562      A74463        syn-C2H3C(O)NH2, v=0
  605070.2965  0.0660 -5.6037 3 1867.1697215  71510 303A74563      A74464        syn-C2H3C(O)NH2, v=0
  605149.1655  0.0147 -5.8382 3  981.1502163  71510 303812854      802853        syn-C2H3C(O)NH2, v=0
  605149.2605  0.0147 -5.8382 3  981.1502163  71510 303812853      802852        syn-C2H3C(O)NH2, v=0
  605181.4698  0.0038 -4.9323 3  313.3510 99  71510 303491139      49 842        syn-C2H3C(O)NH2, v=0
  605194.7605  0.0120 -5.5943 3  874.0360161  71510 303801862      791861        syn-C2H3C(O)NH2, v=0
  605374.0142  0.0052 -5.6174 3   81.7099 53  71510 30326 819      25 322        syn-C2H3C(O)NH2, v=0
  605400.6220  0.1037 -4.9737 3 1218.2679213  71510 303A6 4A2      A6 3A3        syn-C2H3C(O)NH2, v=0
  605400.6220  0.1037 -4.9737 3 1218.2679213  71510 303A6 5A2      A6 4A3        syn-C2H3C(O)NH2, v=0
  605457.3031  0.0321 -4.5415 3 1264.6573165  71510 303824438      824339        syn-C2H3C(O)NH2, v=0
  605457.3031  0.0321 -4.5415 3 1264.6573165  71510 303824439      824340        syn-C2H3C(O)NH2, v=0
  605533.6242  0.0015 -2.9831 3  369.7841101  71510 303501833      491732        syn-C2H3C(O)NH2, v=0
  605568.9102  0.0015 -2.9831 3  369.7831101  71510 303501832      491733        syn-C2H3C(O)NH2, v=0
  605608.3817  0.0138 -5.6943 3  916.7249161  71510 303802457      792456        syn-C2H3C(O)NH2, v=0
  605705.4919  0.1131 -5.3275 3 1578.3429233  71510 303B610A6      B6 9A7        syn-C2H3C(O)NH2, v=0
  605705.4919  0.1131 -5.3275 3 1578.3429233  71510 303B611A6      B610A7        syn-C2H3C(O)NH2, v=0
  605863.2052  0.0316 -4.5093 3 1244.6089163  71510 303814437      814338        syn-C2H3C(O)NH2, v=0
  605863.2052  0.0316 -4.5093 3 1244.6089163  71510 303814438      814339        syn-C2H3C(O)NH2, v=0
  605881.1295  0.0139 -5.6940 3  916.7381161  71510 303802456      792455        syn-C2H3C(O)NH2, v=0
  605906.3529  0.0640 -5.5544 3 1840.8480213  71510 303A64561      A64462        syn-C2H3C(O)NH2, v=0
  605906.3529  0.0640 -5.5544 3 1840.8480213  71510 303A64562      A64463        syn-C2H3C(O)NH2, v=0
  605985.4433  0.1580 -5.8658 3 1921.3816251  71510 303C515B0      C514B1        syn-C2H3C(O)NH2, v=0
  605985.4433  0.1580 -5.8658 3 1921.3816251  71510 303C516B0      C515B1        syn-C2H3C(O)NH2, v=0
  605989.9581  0.0140 -3.8258 3  905.4333165  71510 303821765      811864        syn-C2H3C(O)NH2, v=0
  606063.3208  0.0102 -5.4941 3  820.1366155  71510 303771958      761957        syn-C2H3C(O)NH2, v=0
  606088.4250  0.0083 -5.5276 3   93.8530 57  71510 30328 721      27 424        syn-C2H3C(O)NH2, v=0
  606138.6166  0.0016 -3.1031 3  401.2011107  71510 303531737      521636        syn-C2H3C(O)NH2, v=0
  606158.7735  0.1037 -5.0976 3 1394.2835223  71510 303B1 7A4      B1 6A5        syn-C2H3C(O)NH2, v=0
  606158.7735  0.1037 -5.0976 3 1394.2835223  71510 303B1 8A4      B1 7A5        syn-C2H3C(O)NH2, v=0
  606255.5183  0.0312 -4.4779 3 1224.8097161  71510 303804436      804337        syn-C2H3C(O)NH2, v=0
  606255.5183  0.0312 -4.4779 3 1224.8097161  71510 303804437      804338        syn-C2H3C(O)NH2, v=0
  606267.8063  0.0032 -3.7652 3  202.5323 81  71510 30340 832      39 733        syn-C2H3C(O)NH2, v=0
  606269.6367  0.1102 -5.0521 3 1112.5008207  71510 303A3 2A1      A3 1A2        syn-C2H3C(O)NH2, v=0
  606269.6367  0.1102 -5.0521 3 1112.5008207  71510 303A3 3A1      A3 2A2        syn-C2H3C(O)NH2, v=0
  606297.3864  0.0052 -4.8234 3  389.6409109  71510 303541242      54 945        syn-C2H3C(O)NH2, v=0
  606313.7510  0.0414 -4.9885 3  845.8350157  71510 303782058      781761        syn-C2H3C(O)NH2, v=0
  606330.0295  0.0140 -5.6468 3  905.4333165  71510 303821865      811864        syn-C2H3C(O)NH2, v=0
  606496.2786  0.0050 -4.7230 3  459.1435117  71510 303581544      581247        syn-C2H3C(O)NH2, v=0
  606504.9734  0.0023 -5.6091 3  146.4136 59  71510 303291613      291316        syn-C2H3C(O)NH2, v=0
  606505.2225  0.0023 -5.6091 3  146.4136 59  71510 303291614      291317        syn-C2H3C(O)NH2, v=0
  606539.4842  0.0052 -4.6901 3  533.3784125  71510 303621746      621449        syn-C2H3C(O)NH2, v=0
  606543.1253  0.0140 -5.6464 3  905.4148165  71510 303821765      811764        syn-C2H3C(O)NH2, v=0
  606588.5285  0.2513 -5.3291 3 1426.4801203  71510 303A12675      A02774        syn-C2H3C(O)NH2, v=0
  606603.5319  0.0038 -5.0350 3  283.4847 95  71510 30347 938      47 641        syn-C2H3C(O)NH2, v=0
  606634.6007  0.0307 -4.4474 3 1205.2597159  71510 303794435      794336        syn-C2H3C(O)NH2, v=0
  606634.6007  0.0307 -4.4474 3 1205.2597159  71510 303794436      794337        syn-C2H3C(O)NH2, v=0
  606717.5053  0.0023 -5.2715 3   81.2061 47  71510 303231212      22 913        syn-C2H3C(O)NH2, v=0
  606718.0464  0.0620 -5.5057 3 1814.7806211  71510 303A54560      A54461        syn-C2H3C(O)NH2, v=0
  606718.0464  0.0620 -5.5057 3 1814.7806211  71510 303A54561      A54462        syn-C2H3C(O)NH2, v=0
  606753.8258  0.0024 -4.8435 3  302.1863 91  71510 303451728      451431        syn-C2H3C(O)NH2, v=0
  606774.2482  0.0023 -5.2714 3   81.2042 47  71510 303231211      22 914        syn-C2H3C(O)NH2, v=0
  606782.5604  0.0074 -3.6708 3  657.8120139  71510 303691852      681751        syn-C2H3C(O)NH2, v=0
  606800.8033  0.0044 -5.3156 3  227.5053 87  71510 30343 736      43 439        syn-C2H3C(O)NH2, v=0
  606804.9512  0.0049 -4.6819 3  556.2448127  71510 303631846      631549        syn-C2H3C(O)NH2, v=0
  606830.5153  0.0147 -5.8067 3  969.1481163  71510 303812755      802754        syn-C2H3C(O)NH2, v=0
  606831.4695  0.0147 -5.8067 3  969.1481163  71510 303812754      802753        syn-C2H3C(O)NH2, v=0
  606876.2679  0.0044 -5.3155 3  227.5053 87  71510 30343 836      43 539        syn-C2H3C(O)NH2, v=0
  606883.1968  0.0139 -3.8245 3  905.4148165  71510 303821865      811764        syn-C2H3C(O)NH2, v=0
  606947.9895  0.0047 -3.5077 3  339.2800101  71510 303501337      491238        syn-C2H3C(O)NH2, v=0
  607000.8025  0.0304 -4.4176 3 1185.9586157  71510 303784434      784335        syn-C2H3C(O)NH2, v=0
  607000.8025  0.0304 -4.4176 3 1185.9586157  71510 303784435      784336        syn-C2H3C(O)NH2, v=0
  607036.7869  0.0053 -5.4118 3  227.4710 83  71510 303411229      41 734        syn-C2H3C(O)NH2, v=0
  607274.0667  0.1207 -5.4336 3 1650.1114237  71510 303B811A7      B810A8        syn-C2H3C(O)NH2, v=0
  607274.0667  0.1207 -5.4336 3 1650.1114237  71510 303B812A7      B811A8        syn-C2H3C(O)NH2, v=0
  607326.5088  0.0040 -4.2965 3  144.2660 73  71510 30336 432      35 333        syn-C2H3C(O)NH2, v=0
  607328.0890  0.0040 -4.2965 3  144.2660 73  71510 30336 532      35 233        syn-C2H3C(O)NH2, v=0
  607354.4659  0.0300 -4.3887 3 1166.9063155  71510 303774433      774334        syn-C2H3C(O)NH2, v=0
  607354.4659  0.0300 -4.3887 3 1166.9063155  71510 303774434      774335        syn-C2H3C(O)NH2, v=0
  607455.6976  0.0037 -5.0340 3  283.4847 95  71510 303471038      47 741        syn-C2H3C(O)NH2, v=0
  607506.0305  0.0602 -5.4577 3 1788.9672209  71510 303A44559      A44460        syn-C2H3C(O)NH2, v=0
  607506.0305  0.0602 -5.4577 3 1788.9672209  71510 303A44560      A44461        syn-C2H3C(O)NH2, v=0
  607649.6728  0.0021 -2.5791 3  277.9607 61  71510 3033028 2      2927 3        syn-C2H3C(O)NH2, v=0
  607649.6728  0.0021 -2.5791 3  277.9607 61  71510 3033028 3      2927 2        syn-C2H3C(O)NH2, v=0
  607695.9250  0.0297 -4.3607 3 1148.1025153  71510 303764432      764333        syn-C2H3C(O)NH2, v=0
  607695.9250  0.0297 -4.3607 3 1148.1025153  71510 303764433      764334        syn-C2H3C(O)NH2, v=0
  607733.1530  0.0015 -2.9113 3  353.4066 97  71510 303481930      471829        syn-C2H3C(O)NH2, v=0
  607733.8375  0.0015 -2.9113 3  353.4066 97  71510 303481929      471830        syn-C2H3C(O)NH2, v=0
  607738.5346  0.0277 -5.7635 3 1001.8278191  71510 30395 590      94 589        syn-C2H3C(O)NH2, v=0
  607738.5346  0.0277 -3.6156 3 1001.8278191  71510 30395 590      94 689        syn-C2H3C(O)NH2, v=0
  607738.5346  0.0277 -3.6156 3 1001.8278191  71510 30395 690      94 589        syn-C2H3C(O)NH2, v=0
  607738.5346  0.0277 -5.7635 3 1001.8278191  71510 30395 690      94 689        syn-C2H3C(O)NH2, v=0
  607742.8184  0.0293 -5.7626 3 1004.4306193  71510 30396 492      95 491        syn-C2H3C(O)NH2, v=0
  607742.8184  0.0293 -3.6020 3 1004.4306193  71510 30396 492      95 591        syn-C2H3C(O)NH2, v=0
  607742.8184  0.0293 -3.6020 3 1004.4306193  71510 30396 592      95 491        syn-C2H3C(O)NH2, v=0
  607742.8184  0.0293 -5.7626 3 1004.4306193  71510 30396 592      95 591        syn-C2H3C(O)NH2, v=0
  607743.3964  0.0039 -5.1597 3  254.8656 91  71510 30345 837      45 540        syn-C2H3C(O)NH2, v=0
  607743.5431  0.0264 -5.7633 3  998.6967189  71510 30394 688      93 687        syn-C2H3C(O)NH2, v=0
  607743.5431  0.0264 -3.6291 3  998.6967189  71510 30394 688      93 787        syn-C2H3C(O)NH2, v=0
  607743.5431  0.0264 -3.6291 3  998.6967189  71510 30394 788      93 687        syn-C2H3C(O)NH2, v=0
  607743.5431  0.0264 -5.7633 3  998.6967189  71510 30394 788      93 787        syn-C2H3C(O)NH2, v=0
  607752.8119  0.0313 -5.7607 3 1006.5114195  71510 30397 394      96 393        syn-C2H3C(O)NH2, v=0
  607752.8119  0.0313 -3.5882 3 1006.5114195  71510 30397 394      96 493        syn-C2H3C(O)NH2, v=0
  607752.8119  0.0313 -3.5882 3 1006.5114195  71510 30397 494      96 393        syn-C2H3C(O)NH2, v=0
  607752.8119  0.0313 -5.7607 3 1006.5114195  71510 30397 494      96 493        syn-C2H3C(O)NH2, v=0
  607762.3783  0.0253 -5.7619 3  995.0303187  71510 30393 786      92 785        syn-C2H3C(O)NH2, v=0
  607762.3783  0.0253 -3.6425 3  995.0303187  71510 30393 786      92 885        syn-C2H3C(O)NH2, v=0
  607762.3783  0.0253 -3.6425 3  995.0303187  71510 30393 886      92 785        syn-C2H3C(O)NH2, v=0
  607762.3783  0.0253 -5.7619 3  995.0303187  71510 30393 886      92 885        syn-C2H3C(O)NH2, v=0
  607765.6534  0.0339 -5.7578 3 1008.0752197  71510 30398 296      97 295        syn-C2H3C(O)NH2, v=0
  607765.6534  0.0339 -3.5742 3 1008.0752197  71510 30398 296      97 395        syn-C2H3C(O)NH2, v=0
  607765.6534  0.0339 -3.5742 3 1008.0752197  71510 30398 396      97 295        syn-C2H3C(O)NH2, v=0
  607765.6534  0.0339 -5.7578 3 1008.0752197  71510 30398 396      97 395        syn-C2H3C(O)NH2, v=0
  607779.0344  0.0374 -5.7538 3 1009.1265199  71510 30399 198      98 197        syn-C2H3C(O)NH2, v=0
  607779.0344  0.0374 -3.5598 3 1009.1265199  71510 30399 198      98 297        syn-C2H3C(O)NH2, v=0
  607779.0344  0.0374 -3.5598 3 1009.1265199  71510 30399 298      98 197        syn-C2H3C(O)NH2, v=0
  607779.0344  0.0374 -5.7538 3 1009.1265199  71510 30399 298      98 297        syn-C2H3C(O)NH2, v=0
  607780.7947  0.1048 -5.0101 3 1283.6206217  71510 303A8 5A3      A8 4A4        syn-C2H3C(O)NH2, v=0
  607780.7947  0.1048 -5.0101 3 1283.6206217  71510 303A8 6A3      A8 5A4        syn-C2H3C(O)NH2, v=0
  607791.0758  0.0419 -5.7489 3 1009.6692201  71510 303A0 0A0      99 099        syn-C2H3C(O)NH2, v=0
  607791.0758  0.0419 -3.5450 3 1009.6692201  71510 303A0 0A0      99 199        syn-C2H3C(O)NH2, v=0
  607791.0758  0.0419 -3.5450 3 1009.6692201  71510 303A0 1A0      99 099        syn-C2H3C(O)NH2, v=0
  607791.0758  0.0419 -5.7489 3 1009.6692201  71510 303A0 1A0      99 199        syn-C2H3C(O)NH2, v=0
  607800.8508  0.0243 -5.7595 3  990.8201185  71510 30392 884      91 883        syn-C2H3C(O)NH2, v=0
  607800.8508  0.0243 -3.6561 3  990.8201185  71510 30392 884      91 983        syn-C2H3C(O)NH2, v=0
  607800.8508  0.0243 -3.6561 3  990.8201185  71510 30392 984      91 883        syn-C2H3C(O)NH2, v=0
  607800.8508  0.0243 -5.7595 3  990.8201185  71510 30392 984      91 983        syn-C2H3C(O)NH2, v=0
  607815.0519  0.0024 -5.6997 3  139.2579 57  71510 303281612      281315        syn-C2H3C(O)NH2, v=0
  607815.1492  0.0024 -5.6997 3  139.2579 57  71510 303281613      281316        syn-C2H3C(O)NH2, v=0
  607854.5170  0.0125 -5.5032 3  825.2068155  71510 303772057      762056        syn-C2H3C(O)NH2, v=0
  607866.5129  0.0232 -5.7559 3  986.0562183  71510 30391 982      90 981        syn-C2H3C(O)NH2, v=0
  607866.5129  0.0232 -3.6699 3  986.0562183  71510 30391 982      901081        syn-C2H3C(O)NH2, v=0
  607866.5129  0.0232 -3.6699 3  986.0562183  71510 303911082      90 981        syn-C2H3C(O)NH2, v=0
  607866.5129  0.0232 -5.7559 3  986.0562183  71510 303911082      901081        syn-C2H3C(O)NH2, v=0
  607868.7343  0.0027 -3.6964 3  217.6297 83  71510 303411032      40 733        syn-C2H3C(O)NH2, v=0
  607930.1591  0.0024 -3.8677 3  216.7457 81  71510 303401229      39 930        syn-C2H3C(O)NH2, v=0
  607969.3466  0.0222 -5.7511 3  980.7263181  71510 303901080      891079        syn-C2H3C(O)NH2, v=0
  607969.3466  0.0222 -3.6843 3  980.7263181  71510 303901080      891179        syn-C2H3C(O)NH2, v=0
  607969.3466  0.0222 -3.6843 3  980.7263181  71510 303901180      891079        syn-C2H3C(O)NH2, v=0
  607969.3466  0.0222 -5.7511 3  980.7263181  71510 303901180      891179        syn-C2H3C(O)NH2, v=0
  607982.4565  0.0145 -5.6112 3  878.7579159  71510 303792257      782256        syn-C2H3C(O)NH2, v=0
  608010.1073  0.0039 -5.1594 3  254.8656 91  71510 30345 937      45 640        syn-C2H3C(O)NH2, v=0
  608018.4009  0.0067 -5.6461 3  202.5302 79  71510 303391128      39 633        syn-C2H3C(O)NH2, v=0
  608025.5066  0.0294 -4.3335 3 1129.5471151  71510 303754431      754332        syn-C2H3C(O)NH2, v=0
  608025.5066  0.0294 -4.3335 3 1129.5471151  71510 303754432      754333        syn-C2H3C(O)NH2, v=0
  608081.6238  0.0019 -2.6013 3  280.3166 65  71510 3033227 5      3126 6        syn-C2H3C(O)NH2, v=0
  608081.6238  0.0019 -2.6013 3  280.3166 65  71510 3033227 6      3126 5        syn-C2H3C(O)NH2, v=0
  608082.5800  0.0016 -3.1007 3  401.1482107  71510 303531736      521637        syn-C2H3C(O)NH2, v=0
  608122.8111  0.0212 -5.7451 3  974.8158179  71510 303891178      881177        syn-C2H3C(O)NH2, v=0
  608122.8111  0.0212 -3.6994 3  974.8158179  71510 303891178      881277        syn-C2H3C(O)NH2, v=0
  608122.8111  0.0212 -3.6994 3  974.8158179  71510 303891278      881177        syn-C2H3C(O)NH2, v=0
  608122.8111  0.0212 -5.7451 3  974.8158179  71510 303891278      881277        syn-C2H3C(O)NH2, v=0
  608136.4024  0.0132 -5.6273 3  894.4097163  71510 303811963      801962        syn-C2H3C(O)NH2, v=0
  608148.5469  0.1078 -5.1800 3 1462.8650227  71510 303B3 8A5      B3 7A6        syn-C2H3C(O)NH2, v=0
  608148.5469  0.1078 -5.1800 3 1462.8650227  71510 303B3 9A5      B3 8A6        syn-C2H3C(O)NH2, v=0
  608155.1087  0.0193 -4.0171 3  923.3246165  71510 303821963      812062        syn-C2H3C(O)NH2, v=0
  608236.5619  0.0028 -3.9580 3  206.6398 79  71510 303391228      38 929        syn-C2H3C(O)NH2, v=0
  608270.9367  0.0584 -5.4103 3 1763.4076207  71510 303A34558      A34459        syn-C2H3C(O)NH2, v=0
  608270.9367  0.0584 -5.4103 3 1763.4076207  71510 303A34559      A34460        syn-C2H3C(O)NH2, v=0
  608319.5869  0.0143 -5.5557 3  851.3160157  71510 303782157      772156        syn-C2H3C(O)NH2, v=0
  608343.5301  0.0292 -4.3073 3 1111.2400149  71510 303744430      744331        syn-C2H3C(O)NH2, v=0
  608343.5301  0.0292 -4.3073 3 1111.2400149  71510 303744431      744332        syn-C2H3C(O)NH2, v=0
  608344.5009  0.0032 -3.3414 3  402.4502109  71510 303541539      531440        syn-C2H3C(O)NH2, v=0
  608345.5034  0.0202 -3.7156 3  968.3065177  71510 303881276      871375        syn-C2H3C(O)NH2, v=0
  608345.5035  0.0202 -5.7377 3  968.3065177  71510 303881276      871275        syn-C2H3C(O)NH2, v=0
  608345.5035  0.0202 -5.7377 3  968.3065177  71510 303881376      871375        syn-C2H3C(O)NH2, v=0
  608345.5036  0.0202 -3.7156 3  968.3065177  71510 303881376      871275        syn-C2H3C(O)NH2, v=0
  608401.2666  0.0033 -4.6947 3  435.9627111  71510 303551838      551541        syn-C2H3C(O)NH2, v=0
  608494.9709  0.0017 -2.6259 3  284.1439 69  71510 3033426 8      3325 9        syn-C2H3C(O)NH2, v=0
  608494.9709  0.0017 -2.6259 3  284.1439 69  71510 3033426 9      3325 8        syn-C2H3C(O)NH2, v=0
  608619.4508  0.0128 -5.6081 3  882.5109161  71510 303802061      792060        syn-C2H3C(O)NH2, v=0
  608638.8222  0.0024 -4.8413 3  302.1234 91  71510 303451729      451432        syn-C2H3C(O)NH2, v=0
  608650.3079  0.0290 -4.2820 3 1093.1809147  71510 303734429      734330        syn-C2H3C(O)NH2, v=0
  608650.3079  0.0290 -4.2820 3 1093.1809147  71510 303734430      734331        syn-C2H3C(O)NH2, v=0
  608663.9161  0.0191 -3.7334 3  961.1755175  71510 303871374      861473        syn-C2H3C(O)NH2, v=0
  608663.9176  0.0191 -5.7288 3  961.1755175  71510 303871474      861473        syn-C2H3C(O)NH2, v=0
  608663.9189  0.0191 -5.7288 3  961.1755175  71510 303871374      861373        syn-C2H3C(O)NH2, v=0
  608663.9205  0.0191 -3.7334 3  961.1755175  71510 303871474      861373        syn-C2H3C(O)NH2, v=0
  608682.1769  0.0140 -5.6668 3  907.2815161  71510 303802358      792357        syn-C2H3C(O)NH2, v=0
  608697.2596  0.1298 -5.5460 3 1723.1327241  71510 303C012A8      C011A9        syn-C2H3C(O)NH2, v=0
  608697.2596  0.1298 -5.5460 3 1723.1327241  71510 303C013A8      C012A9        syn-C2H3C(O)NH2, v=0
  608811.6931  0.0148 -5.7763 3  957.7521163  71510 303812656      802655        syn-C2H3C(O)NH2, v=0
  608820.2080  0.0148 -5.7763 3  957.7525163  71510 303812655      802654        syn-C2H3C(O)NH2, v=0
  608856.8934  0.0015 -2.8520 3  338.7690 93  71510 303462027      451926        syn-C2H3C(O)NH2, v=0
  608856.9017  0.0015 -2.8520 3  338.7690 93  71510 303462026      451927        syn-C2H3C(O)NH2, v=0
  608874.7951  0.0016 -2.6533 3  289.4514 73  71510 303362511      352412        syn-C2H3C(O)NH2, v=0
  608874.7951  0.0016 -2.6533 3  289.4514 73  71510 303362512      352411        syn-C2H3C(O)NH2, v=0
  608875.7219  0.0106 -3.8422 3  834.1156157  71510 303781960      771859        syn-C2H3C(O)NH2, v=0
  608894.7283  0.1097 -5.0049 3 1175.8789211  71510 303A5 3A2      A5 2A3        syn-C2H3C(O)NH2, v=0
  608894.7283  0.1097 -5.0049 3 1175.8789211  71510 303A5 4A2      A5 3A3        syn-C2H3C(O)NH2, v=0
  608946.1457  0.0288 -4.2576 3 1075.3698145  71510 303724428      724329        syn-C2H3C(O)NH2, v=0
  608946.1457  0.0288 -4.2576 3 1075.3698145  71510 303724429      724330        syn-C2H3C(O)NH2, v=0
  608987.4406  0.0025 -5.7977 3  132.3572 55  71510 303271611      271314        syn-C2H3C(O)NH2, v=0
  608987.4769  0.0025 -5.7977 3  132.3572 55  71510 303271612      271315        syn-C2H3C(O)NH2, v=0
  609013.3761  0.0567 -5.3635 3 1738.1015205  71510 303A24557      A24458        syn-C2H3C(O)NH2, v=0
  609013.3761  0.0567 -5.3635 3 1738.1015205  71510 303A24558      A24459        syn-C2H3C(O)NH2, v=0
  609045.6569  0.0111 -3.8528 3  854.0034159  71510 303791961      781860        syn-C2H3C(O)NH2, v=0
  609117.2668  0.0181 -3.7535 3  953.3931173  71510 303861472      851571        syn-C2H3C(O)NH2, v=0
  609117.3058  0.0181 -5.7184 3  953.3931173  71510 303861572      851571        syn-C2H3C(O)NH2, v=0
  609117.3373  0.0181 -5.7184 3  953.3931173  71510 303861472      851471        syn-C2H3C(O)NH2, v=0
  609117.3762  0.0181 -3.7535 3  953.3931173  71510 303861572      851471        syn-C2H3C(O)NH2, v=0
  609198.2041  0.0016 -2.6839 3  296.2510 77  71510 303382414      372315        syn-C2H3C(O)NH2, v=0
  609198.2041  0.0016 -2.6839 3  296.2510 77  71510 303382415      372314        syn-C2H3C(O)NH2, v=0
  609231.3424  0.0286 -4.2342 3 1057.8064143  71510 303714427      714328        syn-C2H3C(O)NH2, v=0
  609231.3424  0.0286 -4.2342 3 1057.8064143  71510 303714428      714329        syn-C2H3C(O)NH2, v=0
  609371.5841  0.0015 -2.8013 3  325.7833 89  71510 303442124      432023        syn-C2H3C(O)NH2, v=0
  609371.5842  0.0015 -2.8013 3  325.7833 89  71510 303442123      432024        syn-C2H3C(O)NH2, v=0
  609430.1215  0.0015 -2.7184 3  304.5579 81  71510 303402317      392218        syn-C2H3C(O)NH2, v=0
  609430.1215  0.0015 -2.7184 3  304.5579 81  71510 303402318      392217        syn-C2H3C(O)NH2, v=0
  609506.1905  0.0285 -4.2119 3 1040.4905141  71510 303704426      704327        syn-C2H3C(O)NH2, v=0
  609506.1905  0.0285 -4.2119 3 1040.4905141  71510 303704427      704328        syn-C2H3C(O)NH2, v=0
  609516.3579  0.0015 -2.7572 3  314.3926 85  71510 303422220      412121        syn-C2H3C(O)NH2, v=0
  609516.3579  0.0015 -2.7572 3  314.3926 85  71510 303422221      412120        syn-C2H3C(O)NH2, v=0
  609530.2021  0.1179 -5.2616 3 1071.0928205  71510 303A2 1A1      A2 0A2        syn-C2H3C(O)NH2, v=0
  609530.2021  0.1179 -5.2616 3 1071.0928205  71510 303A2 2A1      A2 1A2        syn-C2H3C(O)NH2, v=0
  609679.8484  0.0029 -3.7619 3  202.5302 81  71510 30340 932      39 633        syn-C2H3C(O)NH2, v=0
  609733.9401  0.0551 -5.3175 3 1713.0486203  71510 303A14556      A14457        syn-C2H3C(O)NH2, v=0
  609733.9401  0.0551 -5.3175 3 1713.0486203  71510 303A14557      A14458        syn-C2H3C(O)NH2, v=0
  609765.9436  0.0171 -3.7770 3  944.9200171  71510 303851570      841669        syn-C2H3C(O)NH2, v=0
  609766.7679  0.0171 -5.7063 3  944.9200171  71510 303851670      841669        syn-C2H3C(O)NH2, v=0
  609767.3943  0.0171 -5.7063 3  944.9200171  71510 303851570      841569        syn-C2H3C(O)NH2, v=0
  609768.2187  0.0171 -3.7770 3  944.9200171  71510 303851670      841569        syn-C2H3C(O)NH2, v=0
  609770.9765  0.0284 -4.1906 3 1023.4221139  71510 303694425      694326        syn-C2H3C(O)NH2, v=0
  609770.9765  0.0284 -4.1906 3 1023.4221139  71510 303694426      694327        syn-C2H3C(O)NH2, v=0
  609904.4949  0.0074 -5.1255 3  111.4100 61  71510 30330 822      29 525        syn-C2H3C(O)NH2, v=0
  609971.6982  0.1402 -5.6642 3 1797.4020245  71510 303C213A9      C212B0        syn-C2H3C(O)NH2, v=0
  609971.6982  0.1402 -5.6642 3 1797.4020245  71510 303C214A9      C213B0        syn-C2H3C(O)NH2, v=0
  609989.4144  0.0023 -3.6611 3  232.8531 85  71510 303421132      41 833        syn-C2H3C(O)NH2, v=0
  610003.1167  0.1131 -5.2720 3 1532.7136231  71510 303B5 9A6      B5 8A7        syn-C2H3C(O)NH2, v=0
  610003.1167  0.1131 -5.2720 3 1532.7136231  71510 303B510A6      B5 9A7        syn-C2H3C(O)NH2, v=0
  610025.9805  0.0283 -4.1704 3 1006.6010137  71510 303684424      684325        syn-C2H3C(O)NH2, v=0
  610025.9805  0.0283 -4.1704 3 1006.6010137  71510 303684425      684326        syn-C2H3C(O)NH2, v=0
  610033.9366  0.1069 -5.0670 3 1350.2543221  71510 303B0 6A4      B0 5A5        syn-C2H3C(O)NH2, v=0
  610033.9366  0.1069 -5.0670 3 1350.2543221  71510 303B0 7A4      B0 6A5        syn-C2H3C(O)NH2, v=0
  610079.8218  0.0036 -4.1049 3  158.4613 75  71510 30337 532      36 433        syn-C2H3C(O)NH2, v=0
  610094.1674  0.0131 -5.6241 3  894.2231163  71510 303811863      801862        syn-C2H3C(O)NH2, v=0
  610094.5982  0.0036 -4.1049 3  158.4613 75  71510 30337 632      36 333        syn-C2H3C(O)NH2, v=0
  610270.1409  0.0147 -5.6647 3  907.3692161  71510 303802357      792356        syn-C2H3C(O)NH2, v=0
  610271.4770  0.0283 -4.1514 3  990.0270135  71510 303674423      674324        syn-C2H3C(O)NH2, v=0
  610271.4770  0.0283 -4.1514 3  990.0270135  71510 303674424      674325        syn-C2H3C(O)NH2, v=0
  610275.7371  0.0043 -3.4307 3  517.4781123  71510 303611745      601644        syn-C2H3C(O)NH2, v=0
  610417.3045  0.0020 -3.7913 3  227.0250 83  71510 303411230      40 931        syn-C2H3C(O)NH2, v=0
  610433.2014  0.0535 -5.2720 3 1688.2487201  71510 303A04555      A04456        syn-C2H3C(O)NH2, v=0
  610433.2014  0.0535 -5.2720 3 1688.2487201  71510 303A04556      A04457        syn-C2H3C(O)NH2, v=0
  610507.7346  0.0282 -4.1336 3  973.7000133  71510 303664422      664323        syn-C2H3C(O)NH2, v=0
  610507.7346  0.0282 -4.1336 3  973.7000133  71510 303664423      664324        syn-C2H3C(O)NH2, v=0
  610616.0784  0.0776 -4.5511 3 1099.9483179  71510 303892267      882366        syn-C2H3C(O)NH2, v=0
  610652.9111  0.0106 -3.8322 3  814.3638155  71510 303771959      761858        syn-C2H3C(O)NH2, v=0
  610655.0282  0.0031 -3.8499 3  187.6150 79  71510 30339 732      38 633        syn-C2H3C(O)NH2, v=0
  610697.0601  0.0161 -3.8057 3  935.7012169  71510 303841668      831767        syn-C2H3C(O)NH2, v=0
  610711.5487  0.0161 -5.6921 3  935.7012169  71510 303841768      831767        syn-C2H3C(O)NH2, v=0
  610721.7539  0.0161 -5.6921 3  935.7004169  71510 303841668      831667        syn-C2H3C(O)NH2, v=0
  610735.0165  0.0282 -4.1171 3  957.6198131  71510 303654421      654322        syn-C2H3C(O)NH2, v=0
  610735.0165  0.0282 -4.1171 3  957.6198131  71510 303654422      654323        syn-C2H3C(O)NH2, v=0
  610736.2425  0.0161 -3.8056 3  935.7004169  71510 303841768      831667        syn-C2H3C(O)NH2, v=0
  610787.7831  0.0118 -3.8645 3  874.0360161  71510 303801962      791861        syn-C2H3C(O)NH2, v=0
  610864.3172  0.1996 -5.1312 3 1340.9137197  71510 303982573      972672        syn-C2H3C(O)NH2, v=0
  610886.5357  0.0032 -4.0564 3  196.7240 77  71510 303381227      37 928        syn-C2H3C(O)NH2, v=0
  610953.5802  0.0282 -4.1019 3  941.7863129  71510 303644420      644321        syn-C2H3C(O)NH2, v=0
  610953.5802  0.0282 -4.1019 3  941.7863129  71510 303644421      644322        syn-C2H3C(O)NH2, v=0
  610968.3291  0.0072 -4.7909 3  587.7264129  71510 303642044      641747        syn-C2H3C(O)NH2, v=0
  611018.1497  0.0108 -5.5246 3  840.3527157  71510 303781959      771958        syn-C2H3C(O)NH2, v=0
  611061.0819  0.0016 -3.1321 3  414.6256109  71510 303541738      531637        syn-C2H3C(O)NH2, v=0
  611093.7533  0.1523 -5.7878 3 1872.9141249  71510 303C414B0      C413B1        syn-C2H3C(O)NH2, v=0
  611093.7533  0.1523 -5.7878 3 1872.9141249  71510 303C415B0      C414B1        syn-C2H3C(O)NH2, v=0
  611111.7153  0.0521 -5.2273 3 1663.7015199  71510 303994554      994455        syn-C2H3C(O)NH2, v=0
  611111.7153  0.0521 -5.2273 3 1663.7015199  71510 303994555      994456        syn-C2H3C(O)NH2, v=0
  611146.2943  0.0020 -3.2458 3  421.9889111  71510 303551639      541540        syn-C2H3C(O)NH2, v=0
  611163.6782  0.0283 -4.0881 3  926.1993127  71510 303634419      634320        syn-C2H3C(O)NH2, v=0
  611163.6782  0.0283 -4.0881 3  926.1993127  71510 303634420      634321        syn-C2H3C(O)NH2, v=0
  611187.3326  0.0150 -5.7468 3  946.9964163  71510 303812557      802556        syn-C2H3C(O)NH2, v=0
  611212.6232  0.0048 -4.7616 3  423.7938113  71510 303561443      561146        syn-C2H3C(O)NH2, v=0
  611253.8873  0.0150 -5.7467 3  946.9994163  71510 303812556      802555        syn-C2H3C(O)NH2, v=0
  611336.7631  0.0031 -3.8492 3  187.6147 79  71510 30339 832      38 533        syn-C2H3C(O)NH2, v=0
  611365.5576  0.0283 -4.0759 3  910.8587125  71510 303624418      624319        syn-C2H3C(O)NH2, v=0
  611365.5576  0.0283 -4.0759 3  910.8587125  71510 303624419      624320        syn-C2H3C(O)NH2, v=0
  611367.0294  0.0140 -5.6416 3  898.5652161  71510 303802259      792258        syn-C2H3C(O)NH2, v=0
  611396.0560  0.0033 -3.9610 3  172.9172 77  71510 30338 632      37 533        syn-C2H3C(O)NH2, v=0
  611397.7350  0.1100 -5.0118 3 1240.5470215  71510 303A7 4A3      A7 3A4        syn-C2H3C(O)NH2, v=0
  611397.7350  0.1100 -5.0118 3 1240.5470215  71510 303A7 5A3      A7 4A4        syn-C2H3C(O)NH2, v=0
  611507.1307  0.0033 -3.9609 3  172.9171 77  71510 30338 732      37 433        syn-C2H3C(O)NH2, v=0
  611559.4603  0.0284 -4.0654 3  895.7645123  71510 303614417      614318        syn-C2H3C(O)NH2, v=0
  611559.4603  0.0284 -4.0654 3  895.7645123  71510 303614418      614319        syn-C2H3C(O)NH2, v=0
  611580.5306  0.0149 -3.9006 3  914.6950165  71510 303821864      811963        syn-C2H3C(O)NH2, v=0
  611719.8256  0.1197 -5.3722 3 1603.8246235  71510 303B710A7      B7 9A8        syn-C2H3C(O)NH2, v=0
  611719.8256  0.1197 -5.3722 3 1603.8246235  71510 303B711A7      B710A8        syn-C2H3C(O)NH2, v=0
  611745.6237  0.0285 -4.0566 3  880.9163121  71510 303604416      604317        syn-C2H3C(O)NH2, v=0
  611745.6237  0.0285 -4.0566 3  880.9163121  71510 303604417      604318        syn-C2H3C(O)NH2, v=0
  611770.0200  0.0507 -5.1832 3 1639.4069197  71510 303984553      984454        syn-C2H3C(O)NH2, v=0
  611770.0200  0.0507 -5.1832 3 1639.4069197  71510 303984554      984455        syn-C2H3C(O)NH2, v=0
  611851.1747  0.0135 -5.6215 3  890.4350161  71510 303802160      792159        syn-C2H3C(O)NH2, v=0
  611888.8059  0.0152 -3.8432 3  925.6583167  71510 303831766      821865        syn-C2H3C(O)NH2, v=0
  611917.2163  0.0314 -4.1768 3  973.4918169  71510 303842064      832163        syn-C2H3C(O)NH2, v=0
  611924.2799  0.0286 -4.0497 3  866.3141119  71510 303594415      594316        syn-C2H3C(O)NH2, v=0
  611924.2799  0.0286 -4.0497 3  866.3141119  71510 303594416      594317        syn-C2H3C(O)NH2, v=0
  611968.6963  0.0015 -3.0035 3  382.2895103  71510 303511834      501733        syn-C2H3C(O)NH2, v=0
  612036.6334  0.0015 -3.0034 3  382.2876103  71510 303511833      501734        syn-C2H3C(O)NH2, v=0
  612095.6564  0.0287 -4.0450 3  851.9579117  71510 303584414      584315        syn-C2H3C(O)NH2, v=0
  612095.6564  0.0287 -4.0450 3  851.9579117  71510 303584415      584316        syn-C2H3C(O)NH2, v=0
  612096.1926  0.0152 -5.6755 3  925.6583167  71510 303831866      821865        syn-C2H3C(O)NH2, v=0
  612157.9175  0.1101 -5.1389 3 1418.1644225  71510 303B2 7A5      B2 6A6        syn-C2H3C(O)NH2, v=0
  612157.9175  0.1101 -5.1389 3 1418.1644225  71510 303B2 8A5      B2 7A6        syn-C2H3C(O)NH2, v=0
  612209.5267  0.0023 -4.8762 3  290.8234 89  71510 303441727      441430        syn-C2H3C(O)NH2, v=0
  612228.8773  0.0152 -5.6752 3  925.6469167  71510 303831766      821765        syn-C2H3C(O)NH2, v=0
  612259.9760  0.0289 -4.0427 3  837.8473115  71510 303574413      574314        syn-C2H3C(O)NH2, v=0
  612259.9760  0.0289 -4.0427 3  837.8473115  71510 303574414      574315        syn-C2H3C(O)NH2, v=0
  612271.2645  0.1168 -5.0880 3 1133.7779209  71510 303A4 2A2      A4 1A3        syn-C2H3C(O)NH2, v=0
  612271.2645  0.1168 -5.0880 3 1133.7779209  71510 303A4 3A2      A4 2A3        syn-C2H3C(O)NH2, v=0
  612408.6378  0.0493 -5.1398 3 1615.3645195  71510 303974552      974453        syn-C2H3C(O)NH2, v=0
  612408.6378  0.0493 -5.1398 3 1615.3645195  71510 303974553      974454        syn-C2H3C(O)NH2, v=0
  612417.4570  0.0290 -4.0430 3  823.9824113  71510 303564412      564313        syn-C2H3C(O)NH2, v=0
  612417.4570  0.0290 -4.0430 3  823.9824113  71510 303564413      564314        syn-C2H3C(O)NH2, v=0
  612424.9757  0.0023 -5.1728 3   86.9180 49  71510 303241213      23 914        syn-C2H3C(O)NH2, v=0
  612436.2641  0.0151 -3.8423 3  925.6469167  71510 303831866      821765        syn-C2H3C(O)NH2, v=0
  612549.5473  0.0023 -5.1727 3   86.9138 49  71510 303241212      23 915        syn-C2H3C(O)NH2, v=0
  612556.7682  0.0020 -4.4529 3  138.2585 65  71510 303321121      31 824        syn-C2H3C(O)NH2, v=0
  612568.3132  0.0292 -4.0463 3  810.3630111  71510 303554411      554312        syn-C2H3C(O)NH2, v=0
  612568.3132  0.0292 -4.0463 3  810.3630111  71510 303554412      554313        syn-C2H3C(O)NH2, v=0
  612712.7537  0.0294 -4.0530 3  796.9890109  71510 303544410      544311        syn-C2H3C(O)NH2, v=0
  612712.7537  0.0294 -4.0530 3  796.9890109  71510 303544411      544312        syn-C2H3C(O)NH2, v=0
  612756.6276  0.0298 -4.9456 3  779.6776151  71510 303751956      751659        syn-C2H3C(O)NH2, v=0
  612850.9836  0.0296 -4.0638 3  783.8602107  71510 3035344 9      534310        syn-C2H3C(O)NH2, v=0
  612850.9836  0.0296 -4.0638 3  783.8602107  71510 303534410      534311        syn-C2H3C(O)NH2, v=0
  612983.2036  0.0298 -4.0793 3  770.9766105  71510 3035244 8      5243 9        syn-C2H3C(O)NH2, v=0
  612983.2036  0.0298 -4.0793 3  770.9766105  71510 3035244 9      524310        syn-C2H3C(O)NH2, v=0
  613028.0758  0.0481 -5.0970 3 1591.5741193  71510 303964551      964452        syn-C2H3C(O)NH2, v=0
  613028.0758  0.0481 -5.0970 3 1591.5741193  71510 303964552      964453        syn-C2H3C(O)NH2, v=0
  613109.6099  0.0300 -4.1006 3  758.3380103  71510 3035144 7      5143 8        syn-C2H3C(O)NH2, v=0
  613109.6099  0.0300 -4.1006 3  758.3380103  71510 3035144 8      5143 9        syn-C2H3C(O)NH2, v=0
  613116.2462  0.0161 -5.8624 3 1001.3358165  71510 303822855      812854        syn-C2H3C(O)NH2, v=0
  613116.4272  0.0161 -5.8624 3 1001.3358165  71510 303822854      812853        syn-C2H3C(O)NH2, v=0
  613230.3949  0.0303 -4.1292 3  745.9443101  71510 3035044 6      5043 7        syn-C2H3C(O)NH2, v=0
  613230.3949  0.0303 -4.1292 3  745.9443101  71510 3035044 7      5043 8        syn-C2H3C(O)NH2, v=0
  613289.6452  0.0428 -5.1293 3 1000.2505169  71510 303842460      842163        syn-C2H3C(O)NH2, v=0
  613291.6825  0.0023 -4.8749 3  290.7873 89  71510 303441728      441431        syn-C2H3C(O)NH2, v=0
  613295.8285  0.1276 -5.4795 3 1676.1932239  71510 303B911A8      B910A9        syn-C2H3C(O)NH2, v=0
  613295.8285  0.1276 -5.4795 3 1676.1932239  71510 303B912A8      B911A9        syn-C2H3C(O)NH2, v=0
  613345.7467  0.0305 -4.1671 3  733.7955 99  71510 3034944 5      4943 6        syn-C2H3C(O)NH2, v=0
  613345.7467  0.0305 -4.1671 3  733.7955 99  71510 3034944 6      4943 7        syn-C2H3C(O)NH2, v=0
  613413.8063  0.1522 -4.9340 3 1257.9719191  71510 303952471      942570        syn-C2H3C(O)NH2, v=0
  613455.8493  0.0308 -4.2176 3  721.8913 97  71510 3034844 4      4843 5        syn-C2H3C(O)NH2, v=0
  613455.8493  0.0308 -4.2176 3  721.8913 97  71510 3034844 5      4843 6        syn-C2H3C(O)NH2, v=0
  613518.5997  0.1111 -4.7397 3 1177.6513185  71510 303922369      912468        syn-C2H3C(O)NH2, v=0
  613560.8827  0.0310 -4.2862 3  710.2318 95  71510 3034744 3      4743 4        syn-C2H3C(O)NH2, v=0
  613560.8827  0.0310 -4.2862 3  710.2318 95  71510 3034744 4      4743 5        syn-C2H3C(O)NH2, v=0
  613597.3864  0.0293 -5.0205 3  886.9018159  71510 303792356      792059        syn-C2H3C(O)NH2, v=0
  613614.1703  0.0037 -4.4865 3  142.2176 67  71510 303331023      32 726        syn-C2H3C(O)NH2, v=0
  613628.8265  0.0469 -5.0550 3 1568.0356191  71510 303954550      954451        syn-C2H3C(O)NH2, v=0
  613628.8265  0.0469 -5.0550 3 1568.0356191  71510 303954551      954452        syn-C2H3C(O)NH2, v=0
  613661.0230  0.0313 -4.3832 3  698.8167 93  71510 3034644 2      4643 3        syn-C2H3C(O)NH2, v=0
  613661.0230  0.0313 -4.3832 3  698.8167 93  71510 3034644 3      4643 4        syn-C2H3C(O)NH2, v=0
  613729.4250  0.0128 -3.8774 3  894.2231163  71510 303811963      801862        syn-C2H3C(O)NH2, v=0
  613756.4422  0.0315 -4.5317 3  687.6461 91  71510 3034544 1      4543 2        syn-C2H3C(O)NH2, v=0
  613756.4422  0.0315 -4.5317 3  687.6461 91  71510 3034544 2      4543 3        syn-C2H3C(O)NH2, v=0
  613756.9641  0.0298 -5.7927 3 1022.0997193  71510 30396 591      95 590        syn-C2H3C(O)NH2, v=0
  613756.9641  0.0298 -3.6441 3 1022.0997193  71510 30396 591      95 690        syn-C2H3C(O)NH2, v=0
  613756.9641  0.0298 -3.6441 3 1022.0997193  71510 30396 691      95 590        syn-C2H3C(O)NH2, v=0
  613756.9641  0.0298 -5.7927 3 1022.0997193  71510 30396 691      95 690        syn-C2H3C(O)NH2, v=0
  613760.9848  0.0284 -5.7924 3 1018.9688191  71510 30395 689      94 688        syn-C2H3C(O)NH2, v=0
  613760.9848  0.0284 -3.6573 3 1018.9688191  71510 30395 689      94 788        syn-C2H3C(O)NH2, v=0
  613760.9848  0.0284 -3.6573 3 1018.9688191  71510 30395 789      94 688        syn-C2H3C(O)NH2, v=0
  613760.9848  0.0284 -5.7924 3 1018.9688191  71510 30395 789      94 788        syn-C2H3C(O)NH2, v=0
  613761.8786  0.0315 -5.7919 3 1024.7028195  71510 30397 493      96 492        syn-C2H3C(O)NH2, v=0
  613761.8786  0.0315 -3.6308 3 1024.7028195  71510 30397 493      96 592        syn-C2H3C(O)NH2, v=0
  613761.8786  0.0315 -3.6308 3 1024.7028195  71510 30397 593      96 492        syn-C2H3C(O)NH2, v=0
  613761.8786  0.0315 -5.7919 3 1024.7028195  71510 30397 593      96 592        syn-C2H3C(O)NH2, v=0
  613772.2517  0.0337 -5.7901 3 1026.7838197  71510 30398 395      97 394        syn-C2H3C(O)NH2, v=0
  613772.2517  0.0337 -3.6172 3 1026.7838197  71510 30398 395      97 494        syn-C2H3C(O)NH2, v=0
  613772.2517  0.0337 -3.6172 3 1026.7838197  71510 30398 495      97 394        syn-C2H3C(O)NH2, v=0
  613772.2517  0.0337 -5.7901 3 1026.7838197  71510 30398 495      97 494        syn-C2H3C(O)NH2, v=0
  613776.8160  0.1112 -5.0494 3 1306.5006219  71510 303A9 5A4      A9 4A5        syn-C2H3C(O)NH2, v=0
  613776.8160  0.1112 -5.0494 3 1306.5006219  71510 303A9 6A4      A9 5A5        syn-C2H3C(O)NH2, v=0
  613778.3261  0.0272 -5.7911 3 1015.3031189  71510 30394 787      93 786        syn-C2H3C(O)NH2, v=0
  613778.3261  0.0272 -3.6705 3 1015.3031189  71510 30394 787      93 886        syn-C2H3C(O)NH2, v=0
  613778.3261  0.0272 -3.6705 3 1015.3031189  71510 30394 887      93 786        syn-C2H3C(O)NH2, v=0
  613778.3261  0.0272 -5.7911 3 1015.3031189  71510 30394 887      93 886        syn-C2H3C(O)NH2, v=0
  613785.2983  0.0364 -5.7872 3 1028.3481199  71510 30399 297      98 296        syn-C2H3C(O)NH2, v=0
  613785.2983  0.0364 -3.6033 3 1028.3481199  71510 30399 297      98 396        syn-C2H3C(O)NH2, v=0
  613785.2983  0.0364 -3.6033 3 1028.3481199  71510 30399 397      98 296        syn-C2H3C(O)NH2, v=0
  613785.2983  0.0364 -5.7872 3 1028.3481199  71510 30399 397      98 396        syn-C2H3C(O)NH2, v=0
  613798.7649  0.0401 -5.7833 3 1029.3998201  71510 303A0 199      99 198        syn-C2H3C(O)NH2, v=0
  613798.7649  0.0401 -3.5891 3 1029.3998201  71510 303A0 199      99 298        syn-C2H3C(O)NH2, v=0
  613798.7649  0.0401 -3.5891 3 1029.3998201  71510 303A0 299      99 198        syn-C2H3C(O)NH2, v=0
  613798.7649  0.0401 -5.7833 3 1029.3998201  71510 303A0 299      99 298        syn-C2H3C(O)NH2, v=0
  613810.8123  0.0447 -5.7784 3 1029.9429203  71510 303A1 0A1      A0 0A0        syn-C2H3C(O)NH2, v=0
  613810.8123  0.0447 -3.5745 3 1029.9429203  71510 303A1 0A1      A0 1A0        syn-C2H3C(O)NH2, v=0
  613810.8123  0.0447 -3.5745 3 1029.9429203  71510 303A1 1A1      A0 0A0        syn-C2H3C(O)NH2, v=0
  613810.8123  0.0447 -5.7784 3 1029.9429203  71510 303A1 1A1      A0 1A0        syn-C2H3C(O)NH2, v=0
  613814.5879  0.0261 -5.7886 3 1011.0942187  71510 30393 885      92 884        syn-C2H3C(O)NH2, v=0
  613814.5879  0.0261 -3.6837 3 1011.0942187  71510 30393 885      92 984        syn-C2H3C(O)NH2, v=0
  613814.5879  0.0261 -3.6837 3 1011.0942187  71510 30393 985      92 884        syn-C2H3C(O)NH2, v=0
  613814.5879  0.0261 -5.7886 3 1011.0942187  71510 30393 985      92 984        syn-C2H3C(O)NH2, v=0
  613835.0349  0.0032 -4.7109 3  421.9889109  71510 303541837      541540        syn-C2H3C(O)NH2, v=0
  613847.3086  0.0318 -4.8056 3  676.7197 89  71510 3034444 0      4443 1        syn-C2H3C(O)NH2, v=0
  613847.3086  0.0318 -4.8056 3  676.7197 89  71510 3034444 1      4443 2        syn-C2H3C(O)NH2, v=0
  613877.0203  0.0250 -5.7849 3 1006.3324185  71510 30392 983      91 982        syn-C2H3C(O)NH2, v=0
  613877.0203  0.0250 -3.6972 3 1006.3324185  71510 30392 983      911082        syn-C2H3C(O)NH2, v=0
  613877.0203  0.0250 -3.6972 3 1006.3324185  71510 303921083      91 982        syn-C2H3C(O)NH2, v=0
  613877.0203  0.0250 -5.7849 3 1006.3324185  71510 303921083      911082        syn-C2H3C(O)NH2, v=0
  613913.8398  0.0144 -5.6561 3  914.6950165  71510 303821964      811963        syn-C2H3C(O)NH2, v=0
  613975.1627  0.0239 -5.7801 3 1001.0060183  71510 303911081      901080        syn-C2H3C(O)NH2, v=0
  613975.1627  0.0239 -3.7112 3 1001.0060183  71510 303911081      901180        syn-C2H3C(O)NH2, v=0
  613975.1627  0.0239 -3.7112 3 1001.0060183  71510 303911181      901080        syn-C2H3C(O)NH2, v=0
  613975.1627  0.0239 -5.7801 3 1001.0060183  71510 303911181      901180        syn-C2H3C(O)NH2, v=0
  614032.8509  0.0153 -5.7182 3  936.9258163  71510 303812458      802457        syn-C2H3C(O)NH2, v=0
  614121.8118  0.0228 -5.7740 3  995.1006181  71510 303901179      891178        syn-C2H3C(O)NH2, v=0
  614121.8118  0.0228 -3.7258 3  995.1006181  71510 303901179      891278        syn-C2H3C(O)NH2, v=0
  614121.8118  0.0228 -3.7258 3  995.1006181  71510 303901279      891178        syn-C2H3C(O)NH2, v=0
  614121.8118  0.0228 -5.7740 3  995.1006181  71510 303901279      891278        syn-C2H3C(O)NH2, v=0
  614150.4671  0.1144 -5.2226 3 1487.3462229  71510 303B4 8A6      B4 7A7        syn-C2H3C(O)NH2, v=0
  614150.4671  0.1144 -5.2226 3 1487.3462229  71510 303B4 9A6      B4 8A7        syn-C2H3C(O)NH2, v=0
  614211.3683  0.0458 -5.0136 3 1544.7486189  71510 303944549      944450        syn-C2H3C(O)NH2, v=0
  614211.3683  0.0458 -5.0136 3 1544.7486189  71510 303944550      944451        syn-C2H3C(O)NH2, v=0
  614263.6232  0.0106 -4.8524 3  680.5888139  71510 303692148      691851        syn-C2H3C(O)NH2, v=0
  614334.5405  0.0217 -5.7665 3  988.5987179  71510 303891277      881276        syn-C2H3C(O)NH2, v=0
  614334.5405  0.0217 -3.7414 3  988.5987179  71510 303891277      881376        syn-C2H3C(O)NH2, v=0
  614334.5405  0.0217 -5.7665 3  988.5987179  71510 303891377      881376        syn-C2H3C(O)NH2, v=0
  614334.5406  0.0217 -3.7414 3  988.5987179  71510 303891377      881276        syn-C2H3C(O)NH2, v=0
  614373.8885  0.0016 -3.1282 3  414.5363109  71510 303541737      531638        syn-C2H3C(O)NH2, v=0
  614478.0121  0.0155 -5.7176 3  936.9481163  71510 303812457      802456        syn-C2H3C(O)NH2, v=0
  614479.0847  0.0024 -2.5643 3  283.8779 59  71510 3032929 0      2828 1        syn-C2H3C(O)NH2, v=0
  614479.0847  0.0024 -2.5643 3  283.8779 59  71510 3032929 1      2828 0        syn-C2H3C(O)NH2, v=0
  614498.9233  0.0015 -2.9284 3  365.3358 99  71510 303491931      481830        syn-C2H3C(O)NH2, v=0
  614500.3754  0.0015 -2.9284 3  365.3358 99  71510 303491930      481831        syn-C2H3C(O)NH2, v=0
  614588.2549  0.0178 -4.9290 3  780.3294149  71510 303742252      741955        syn-C2H3C(O)NH2, v=0
  614635.1730  0.0048 -3.5824 3  309.5377 97  71510 303481236      471137        syn-C2H3C(O)NH2, v=0
  614638.1951  0.0206 -3.7585 3  981.4783177  71510 303881375      871474        syn-C2H3C(O)NH2, v=0
  614638.1960  0.0206 -5.7577 3  981.4783177  71510 303881475      871474        syn-C2H3C(O)NH2, v=0
  614638.1967  0.0206 -5.7577 3  981.4783177  71510 303881375      871374        syn-C2H3C(O)NH2, v=0
  614638.1975  0.0206 -3.7585 3  981.4783177  71510 303881475      871374        syn-C2H3C(O)NH2, v=0
  614667.2709  0.0107 -3.8218 3  794.7433153  71510 303761958      751857        syn-C2H3C(O)NH2, v=0
  614728.0753  0.1370 -5.5932 3 1749.8145243  71510 303C112A9      C111B0        syn-C2H3C(O)NH2, v=0
  614728.0753  0.1370 -5.5932 3 1749.8145243  71510 303C113A9      C112B0        syn-C2H3C(O)NH2, v=0
  614776.1667  0.0447 -4.9729 3 1521.7131187  71510 303934548      934449        syn-C2H3C(O)NH2, v=0
  614776.1667  0.0447 -4.9729 3 1521.7131187  71510 303934549      934450        syn-C2H3C(O)NH2, v=0
  614889.1990  0.0162 -5.8311 3  989.3898165  71510 303822756      812755        syn-C2H3C(O)NH2, v=0
  614890.9506  0.0162 -5.8311 3  989.3898165  71510 303822755      812754        syn-C2H3C(O)NH2, v=0
  614892.9781  0.1163 -5.0422 3 1197.7573213  71510 303A6 3A3      A6 2A4        syn-C2H3C(O)NH2, v=0
  614892.9781  0.1163 -5.0422 3 1197.7573213  71510 303A6 4A3      A6 3A4        syn-C2H3C(O)NH2, v=0
  614918.1055  0.0020 -2.5849 3  285.2617 63  71510 3033128 3      3027 4        syn-C2H3C(O)NH2, v=0
  614918.1055  0.0020 -2.5849 3  285.2617 63  71510 3033128 4      3027 3        syn-C2H3C(O)NH2, v=0
  614944.8798  0.0138 -5.6360 3  902.8123163  71510 303812062      802061        syn-C2H3C(O)NH2, v=0
  615042.9230  0.0054 -4.7009 3  572.2407129  71510 303641847      641550        syn-C2H3C(O)NH2, v=0
  615069.2227  0.0196 -3.7777 3  973.7111175  71510 303871473      861572        syn-C2H3C(O)NH2, v=0
  615069.2442  0.0196 -5.7473 3  973.7111175  71510 303871573      861572        syn-C2H3C(O)NH2, v=0
  615069.2617  0.0196 -5.7473 3  973.7111175  71510 303871473      861472        syn-C2H3C(O)NH2, v=0
  615069.2831  0.0196 -3.7777 3  973.7111175  71510 303871573      861472        syn-C2H3C(O)NH2, v=0
  615215.7882  0.0143 -5.6540 3  914.5737165  71510 303821864      811863        syn-C2H3C(O)NH2, v=0
  615228.7351  0.0035 -4.1563 3  187.0210 75  71510 303371226      36 927        syn-C2H3C(O)NH2, v=0
  615285.3366  0.0060 -4.8077 3  437.4767115  71510 303571344      571047        syn-C2H3C(O)NH2, v=0
  615289.4867  0.0116 -5.5565 3  860.7341159  71510 303791960      781959        syn-C2H3C(O)NH2, v=0
  615319.9817  0.0017 -3.1639 3  428.3469111  71510 303551739      541638        syn-C2H3C(O)NH2, v=0
  615323.6741  0.0437 -4.9329 3 1498.9286185  71510 303924547      924448        syn-C2H3C(O)NH2, v=0
  615323.6741  0.0437 -4.9329 3 1498.9286185  71510 303924548      924449        syn-C2H3C(O)NH2, v=0
  615345.5835  0.0018 -2.6077 3  288.1120 67  71510 3033327 6      3226 7        syn-C2H3C(O)NH2, v=0
  615345.5835  0.0018 -2.6077 3  288.1120 67  71510 3033327 7      3226 6        syn-C2H3C(O)NH2, v=0
  615535.3580  0.1247 -5.2968 3 1091.9688207  71510 303A3 1A2      A3 0A3        syn-C2H3C(O)NH2, v=0
  615535.3580  0.1247 -5.2968 3 1091.9688207  71510 303A3 2A2      A3 1A3        syn-C2H3C(O)NH2, v=0
  615654.1093  0.0034 -4.7585 3  395.1532105  71510 303521834      521537        syn-C2H3C(O)NH2, v=0
  615683.3412  0.0185 -3.8001 3  965.2596173  71510 303861571      851670        syn-C2H3C(O)NH2, v=0
  615683.8075  0.0185 -5.7352 3  965.2596173  71510 303861671      851670        syn-C2H3C(O)NH2, v=0
  615684.1656  0.0185 -5.7352 3  965.2596173  71510 303861571      851570        syn-C2H3C(O)NH2, v=0
  615684.6318  0.0185 -3.8001 3  965.2596173  71510 303861671      851570        syn-C2H3C(O)NH2, v=0
  615750.7306  0.0017 -2.6330 3  292.4360 71  71510 3033526 9      342510        syn-C2H3C(O)NH2, v=0
  615750.7306  0.0017 -2.6330 3  292.4360 71  71510 303352610      3425 9        syn-C2H3C(O)NH2, v=0
  615806.1000  0.0015 -2.8667 3  350.1471 95  71510 303472028      461927        syn-C2H3C(O)NH2, v=0
  615806.1196  0.0015 -2.8667 3  350.1471 95  71510 303472027      461928        syn-C2H3C(O)NH2, v=0
  615845.4760  0.0531 -5.2603 3 1120.3163179  71510 303892564      892267        syn-C2H3C(O)NH2, v=0
  615854.3312  0.0427 -4.8936 3 1476.3952183  71510 303914546      914447        syn-C2H3C(O)NH2, v=0
  615854.3312  0.0427 -4.8936 3 1476.3952183  71510 303914547      914448        syn-C2H3C(O)NH2, v=0
  615877.5721  0.0019 -3.7318 3  237.4683 85  71510 303421231      41 932        syn-C2H3C(O)NH2, v=0
  616009.1627  0.1199 -5.3159 3 1557.7950233  71510 303B6 9A7      B6 8A8        syn-C2H3C(O)NH2, v=0
  616009.1627  0.1199 -5.3159 3 1557.7950233  71510 303B610A7      B6 9A8        syn-C2H3C(O)NH2, v=0
  616013.2919  0.1478 -5.7127 3 1824.6837247  71510 303C313B0      C312B1        syn-C2H3C(O)NH2, v=0
  616013.2919  0.1478 -5.7127 3 1824.6837247  71510 303C314B0      C313B1        syn-C2H3C(O)NH2, v=0
  616030.0158  0.1134 -5.1076 3 1373.7349223  71510 303B1 6A5      B1 5A6        syn-C2H3C(O)NH2, v=0
  616030.0158  0.1134 -5.1076 3 1373.7349223  71510 303B1 7A5      B1 6A6        syn-C2H3C(O)NH2, v=0
  616110.4624  0.0036 -3.3796 3  501.7733121  71510 303601744      591643        syn-C2H3C(O)NH2, v=0
  616116.9602  0.0017 -2.6613 3  298.2435 75  71510 303372512      362413        syn-C2H3C(O)NH2, v=0
  616116.9602  0.0017 -2.6613 3  298.2435 75  71510 303372513      362412        syn-C2H3C(O)NH2, v=0
  616368.5667  0.0418 -4.8550 3 1454.1124181  71510 303904545      904446        syn-C2H3C(O)NH2, v=0
  616368.5667  0.0418 -4.8550 3 1454.1124181  71510 303904546      904447        syn-C2H3C(O)NH2, v=0
  616418.9849  0.0016 -2.6929 3  305.5468 79  71510 303392415      382316        syn-C2H3C(O)NH2, v=0
  616418.9849  0.0016 -2.6929 3  305.5468 79  71510 303392416      382315        syn-C2H3C(O)NH2, v=0
  616435.5790  0.0015 -2.8142 3  336.6265 91  71510 303452125      442024        syn-C2H3C(O)NH2, v=0
  616435.5792  0.0015 -2.8142 3  336.6265 91  71510 303452124      442025        syn-C2H3C(O)NH2, v=0
  616564.0586  0.0175 -3.8271 3  956.0723171  71510 303851669      841768        syn-C2H3C(O)NH2, v=0
  616572.5106  0.0175 -5.7211 3  956.0723171  71510 303851769      841768        syn-C2H3C(O)NH2, v=0
  616578.5472  0.0175 -5.7211 3  956.0718171  71510 303851669      841668        syn-C2H3C(O)NH2, v=0
  616586.9992  0.0175 -3.8270 3  956.0718171  71510 303851769      841668        syn-C2H3C(O)NH2, v=0
  616618.2021  0.0016 -2.7285 3  314.3624 83  71510 303412318      402219        syn-C2H3C(O)NH2, v=0
  616618.2021  0.0016 -2.7285 3  314.3624 83  71510 303412319      402218        syn-C2H3C(O)NH2, v=0
  616655.0461  0.0015 -2.7686 3  324.7123 87  71510 303432221      422122        syn-C2H3C(O)NH2, v=0
  616655.0461  0.0015 -2.7686 3  324.7123 87  71510 303432222      422121        syn-C2H3C(O)NH2, v=0
  616675.5567  0.0045 -4.8132 3  389.6415109  71510 303541342      541045        syn-C2H3C(O)NH2, v=0
  616792.3103  0.0050 -5.0206 3  123.6921 71  71510 30335 233      34 134        syn-C2H3C(O)NH2, v=0
  616792.3142  0.0050 -5.0206 3  123.6921 71  71510 30335 333      34 034        syn-C2H3C(O)NH2, v=0
  616866.7984  0.0410 -4.8172 3 1432.0802179  71510 303894544      894445        syn-C2H3C(O)NH2, v=0
  616866.7984  0.0410 -4.8172 3 1432.0802179  71510 303894545      894446        syn-C2H3C(O)NH2, v=0
  616876.1799  0.0133 -5.5263 3  845.4827157  71510 303782058      772057        syn-C2H3C(O)NH2, v=0
  616938.9065  0.0044 -5.2735 3  253.6105 87  71510 303431330      43 835        syn-C2H3C(O)NH2, v=0
  616986.8722  0.0163 -5.8007 3  978.0599165  71510 303822657      812656        syn-C2H3C(O)NH2, v=0
  616997.9489  0.0796 -5.8338 3 1995.0678223  71510 303B14665      B14566        syn-C2H3C(O)NH2, v=0
  616997.9489  0.0796 -5.8338 3 1995.0678223  71510 303B14666      B14567        syn-C2H3C(O)NH2, v=0
  617001.9027  0.0163 -5.8007 3  978.0605165  71510 303822656      812655        syn-C2H3C(O)NH2, v=0
  617012.5979  0.0022 -4.9113 3  279.7434 87  71510 303431726      431429        syn-C2H3C(O)NH2, v=0
  617147.9580  0.1602 -5.8375 3 1900.7958251  71510 303C514B1      C513B2        syn-C2H3C(O)NH2, v=0
  617147.9580  0.1602 -5.8375 3 1900.7958251  71510 303C515B1      C514B2        syn-C2H3C(O)NH2, v=0
  617154.0194  0.0155 -5.6910 3  927.5850163  71510 303812359      802358        syn-C2H3C(O)NH2, v=0
  617209.1180  0.0394 -5.4365 3 1271.7064191  71510 303952669      952372        syn-C2H3C(O)NH2, v=0
  617332.3504  0.0071 -3.6424 3  639.8970137  71510 303681851      671750        syn-C2H3C(O)NH2, v=0
  617349.4332  0.0402 -4.7800 3 1410.2983177  71510 303884543      884444        syn-C2H3C(O)NH2, v=0
  617349.4332  0.0402 -4.7800 3 1410.2983177  71510 303884544      884445        syn-C2H3C(O)NH2, v=0
  617391.7642  0.0043 -4.8830 3  356.7007105  71510 303521141      52 844        syn-C2H3C(O)NH2, v=0
  617393.6451  0.1167 -5.0503 3 1263.0265217  71510 303A8 4A4      A8 3A5        syn-C2H3C(O)NH2, v=0
  617393.6451  0.1167 -5.0503 3 1263.0265217  71510 303A8 5A4      A8 4A5        syn-C2H3C(O)NH2, v=0
  617440.4733  0.0033 -3.7069 3  227.4787 85  71510 30342 933      41 834        syn-C2H3C(O)NH2, v=0
  617549.0974  0.0140 -3.8917 3  914.5737165  71510 303821964      811863        syn-C2H3C(O)NH2, v=0
  617618.9168  0.0022 -4.9106 3  279.7231 87  71510 303431727      431430        syn-C2H3C(O)NH2, v=0
  617731.4163  0.1267 -5.4174 3 1629.5061237  71510 303B810A8      B8 9A9        syn-C2H3C(O)NH2, v=0
  617731.4163  0.1267 -5.4174 3 1629.5061237  71510 303B811A8      B810A9        syn-C2H3C(O)NH2, v=0
  617749.0655  0.0165 -3.8619 3  946.0756169  71510 303841767      831866        syn-C2H3C(O)NH2, v=0
  617816.8681  0.0394 -4.7436 3 1388.7666175  71510 303874542      874443        syn-C2H3C(O)NH2, v=0
  617816.8681  0.0394 -4.7436 3 1388.7666175  71510 303874543      874444        syn-C2H3C(O)NH2, v=0
  617836.9418  0.0022 -5.0801 3   92.8929 51  71510 303251214      24 915        syn-C2H3C(O)NH2, v=0
  617874.5873  0.0165 -5.7047 3  946.0756169  71510 303841867      831866        syn-C2H3C(O)NH2, v=0
  617876.8751  0.0772 -5.7821 3 1967.7575221  71510 303B04664      B04565        syn-C2H3C(O)NH2, v=0
  617876.8751  0.0772 -5.7821 3 1967.7575221  71510 303B04665      B04566        syn-C2H3C(O)NH2, v=0
  617956.4523  0.0165 -5.7045 3  946.0687169  71510 303841767      831766        syn-C2H3C(O)NH2, v=0
  618055.5198  0.0060 -4.7797 3  130.2074 65  71510 30332 923      31 626        syn-C2H3C(O)NH2, v=0
  618081.9741  0.0165 -3.8614 3  946.0687169  71510 303841867      831766        syn-C2H3C(O)NH2, v=0
  618098.4521  0.0022 -5.0799 3   92.8842 51  71510 303251213      24 916        syn-C2H3C(O)NH2, v=0
  618155.2542  0.1167 -5.1808 3 1442.2455227  71510 303B3 7A6      B3 6A7        syn-C2H3C(O)NH2, v=0
  618155.2542  0.1167 -5.1808 3 1442.2455227  71510 303B3 8A6      B3 7A7        syn-C2H3C(O)NH2, v=0
  618178.5264  0.0160 -3.9130 3  935.1729167  71510 303831865      821964        syn-C2H3C(O)NH2, v=0
  618269.4900  0.0388 -4.7079 3 1367.4848173  71510 303864541      864442        syn-C2H3C(O)NH2, v=0
  618269.4900  0.0388 -4.7079 3 1367.4848173  71510 303864542      864443        syn-C2H3C(O)NH2, v=0
  618271.9458  0.1236 -5.1245 3 1155.2556211  71510 303A5 2A3      A5 1A4        syn-C2H3C(O)NH2, v=0
  618271.9458  0.1236 -5.1245 3 1155.2556211  71510 303A5 3A3      A5 2A4        syn-C2H3C(O)NH2, v=0
  618297.9496  0.0016 -3.0252 3  395.0644105  71510 303521835      511734        syn-C2H3C(O)NH2, v=0
  618311.2983  0.0167 -5.6326 3  899.0381161  71510 303802258      792257        syn-C2H3C(O)NH2, v=0
  618345.2670  0.0581 -5.4693 3 1296.4844193  71510 303962670      962373        syn-C2H3C(O)NH2, v=0
  618396.9076  0.0192 -4.0142 3  944.0419167  71510 303831964      822063        syn-C2H3C(O)NH2, v=0
  618426.2346  0.0016 -3.0250 3  395.0608105  71510 303521834      511735        syn-C2H3C(O)NH2, v=0
  618470.9222  0.0057 -5.7914 3  185.1939 81  71510 30340 535      40 238        syn-C2H3C(O)NH2, v=0
  618473.1994  0.0057 -5.7914 3  185.1939 81  71510 30340 635      40 338        syn-C2H3C(O)NH2, v=0
  618656.5362  0.0204 -4.9067 3  716.1123145  71510 303721854      721557        syn-C2H3C(O)NH2, v=0
  618658.7545  0.0019 -3.1992 3  442.3745113  71510 303561740      551639        syn-C2H3C(O)NH2, v=0
  618707.6764  0.0381 -4.6729 3 1346.4527171  71510 303854540      854441        syn-C2H3C(O)NH2, v=0
  618707.6764  0.0381 -4.6729 3 1346.4527171  71510 303854541      854442        syn-C2H3C(O)NH2, v=0
  618730.9206  0.0749 -5.7310 3 1940.7018219  71510 303A94663      A94564        syn-C2H3C(O)NH2, v=0
  618730.9206  0.0749 -5.7310 3 1940.7018219  71510 303A94664      A94565        syn-C2H3C(O)NH2, v=0
  618927.8937  0.1090 -5.3163 3 1159.2520183  71510 303912467      912170        syn-C2H3C(O)NH2, v=0
  619120.8561  0.0146 -5.6481 3  910.8442163  71510 303812161      802160        syn-C2H3C(O)NH2, v=0
  619131.7958  0.0375 -4.6387 3 1325.6702169  71510 303844539      844440        syn-C2H3C(O)NH2, v=0
  619131.7958  0.0375 -4.6387 3 1325.6702169  71510 303844540      844441        syn-C2H3C(O)NH2, v=0
  619174.2803  0.0161 -5.5759 3  871.6073159  71510 303792158      782157        syn-C2H3C(O)NH2, v=0
  619194.7408  0.0124 -5.5891 3  881.2580161  71510 303801961      791960        syn-C2H3C(O)NH2, v=0
  619314.4595  0.1348 -5.5260 3 1702.4746241  71510 303C011A9      C010B0        syn-C2H3C(O)NH2, v=0
  619314.4595  0.1348 -5.5260 3 1702.4746241  71510 303C012A9      C011B0        syn-C2H3C(O)NH2, v=0
  619500.5039  0.0153 -5.6667 3  918.9582163  71510 303812260      802259        syn-C2H3C(O)NH2, v=0
  619507.8010  0.0166 -5.7713 3  967.3834165  71510 303822558      812557        syn-C2H3C(O)NH2, v=0
  619542.2077  0.0369 -4.6053 3 1305.1371167  71510 303834538      834439        syn-C2H3C(O)NH2, v=0
  619542.2077  0.0369 -4.6053 3 1305.1371167  71510 303834539      834440        syn-C2H3C(O)NH2, v=0
  619560.7439  0.0727 -5.6806 3 1913.9002217  71510 303A84662      A84563        syn-C2H3C(O)NH2, v=0
  619560.7439  0.0727 -5.6806 3 1913.9002217  71510 303A84663      A84564        syn-C2H3C(O)NH2, v=0
  619584.8587  0.0167 -5.6879 3  927.7257163  71510 303812358      802357        syn-C2H3C(O)NH2, v=0
  619587.6425  0.0031 -4.7289 3  408.2748107  71510 303531836      531539        syn-C2H3C(O)NH2, v=0
  619620.3156  0.0166 -5.7712 3  967.3886165  71510 303822557      812556        syn-C2H3C(O)NH2, v=0
  619659.5236  0.0156 -5.6855 3  935.1729167  71510 303831965      821964        syn-C2H3C(O)NH2, v=0
  619763.3470  0.0030 -3.3291 3  486.4113119  71510 303591743      581642        syn-C2H3C(O)NH2, v=0
  619771.4646  0.1180 -5.0893 3 1329.5809221  71510 303B0 5A5      B0 4A6        syn-C2H3C(O)NH2, v=0
  619771.4646  0.1180 -5.0893 3 1329.5809221  71510 303B0 6A5      B0 5A6        syn-C2H3C(O)NH2, v=0
  619774.5970  0.0320 -5.8225 3 1042.5725195  71510 30397 592      96 591        syn-C2H3C(O)NH2, v=0
  619774.5970  0.0320 -3.6732 3 1042.5725195  71510 30397 592      96 691        syn-C2H3C(O)NH2, v=0
  619774.5970  0.0320 -3.6732 3 1042.5725195  71510 30397 692      96 591        syn-C2H3C(O)NH2, v=0
  619774.5970  0.0320 -5.8225 3 1042.5725195  71510 30397 692      96 691        syn-C2H3C(O)NH2, v=0
  619777.6605  0.0305 -5.8221 3 1039.4417193  71510 30396 690      95 689        syn-C2H3C(O)NH2, v=0
  619777.6605  0.0305 -3.6861 3 1039.4417193  71510 30396 690      95 789        syn-C2H3C(O)NH2, v=0
  619777.6605  0.0305 -3.6861 3 1039.4417193  71510 30396 790      95 689        syn-C2H3C(O)NH2, v=0
  619777.6605  0.0305 -5.8221 3 1039.4417193  71510 30396 790      95 789        syn-C2H3C(O)NH2, v=0
  619780.1243  0.0338 -5.8218 3 1045.1756197  71510 30398 494      97 493        syn-C2H3C(O)NH2, v=0
  619780.1243  0.0338 -3.6601 3 1045.1756197  71510 30398 494      97 593        syn-C2H3C(O)NH2, v=0
  619780.1243  0.0338 -3.6601 3 1045.1756197  71510 30398 594      97 493        syn-C2H3C(O)NH2, v=0
  619780.1243  0.0338 -5.8218 3 1045.1756197  71510 30398 594      97 593        syn-C2H3C(O)NH2, v=0
  619790.8674  0.0361 -5.8200 3 1047.2571199  71510 30399 396      98 395        syn-C2H3C(O)NH2, v=0
  619790.8674  0.0361 -3.6467 3 1047.2571199  71510 30399 396      98 495        syn-C2H3C(O)NH2, v=0
  619790.8674  0.0361 -3.6467 3 1047.2571199  71510 30399 496      98 395        syn-C2H3C(O)NH2, v=0
  619790.8674  0.0361 -5.8200 3 1047.2571199  71510 30399 496      98 495        syn-C2H3C(O)NH2, v=0
  619793.5588  0.0292 -5.8207 3 1035.7765191  71510 30395 788      94 787        syn-C2H3C(O)NH2, v=0
  619793.5588  0.0292 -3.6990 3 1035.7765191  71510 30395 788      94 887        syn-C2H3C(O)NH2, v=0
  619793.5588  0.0292 -3.6990 3 1035.7765191  71510 30395 888      94 787        syn-C2H3C(O)NH2, v=0
  619793.5588  0.0292 -5.8207 3 1035.7765191  71510 30395 888      94 887        syn-C2H3C(O)NH2, v=0
  619804.1143  0.0390 -5.8172 3 1048.8217201  71510 303A0 298      99 297        syn-C2H3C(O)NH2, v=0
  619804.1143  0.0390 -3.6331 3 1048.8217201  71510 303A0 298      99 397        syn-C2H3C(O)NH2, v=0
  619804.1143  0.0390 -3.6331 3 1048.8217201  71510 303A0 398      99 297        syn-C2H3C(O)NH2, v=0
  619804.1143  0.0390 -5.8172 3 1048.8217201  71510 303A0 398      99 397        syn-C2H3C(O)NH2, v=0
  619817.6644  0.0429 -5.8133 3 1049.8740203  71510 303A1 1A0      A0 199        syn-C2H3C(O)NH2, v=0
  619817.6644  0.0429 -3.6190 3 1049.8740203  71510 303A1 1A0      A0 299        syn-C2H3C(O)NH2, v=0
  619817.6644  0.0429 -3.6190 3 1049.8740203  71510 303A1 2A0      A0 199        syn-C2H3C(O)NH2, v=0
  619817.6644  0.0429 -5.8133 3 1049.8740203  71510 303A1 2A0      A0 299        syn-C2H3C(O)NH2, v=0
  619827.6925  0.0280 -5.8182 3 1031.5688189  71510 30394 886      93 885        syn-C2H3C(O)NH2, v=0
  619827.6925  0.0280 -3.7120 3 1031.5688189  71510 30394 886      93 985        syn-C2H3C(O)NH2, v=0
  619827.6925  0.0280 -3.7120 3 1031.5688189  71510 30394 986      93 885        syn-C2H3C(O)NH2, v=0
  619827.6925  0.0280 -5.8182 3 1031.5688189  71510 30394 986      93 985        syn-C2H3C(O)NH2, v=0
  619829.7169  0.0478 -5.8085 3 1050.4175205  71510 303A2 0A2      A1 0A1        syn-C2H3C(O)NH2, v=0
  619829.7169  0.0478 -3.6046 3 1050.4175205  71510 303A2 0A2      A1 1A1        syn-C2H3C(O)NH2, v=0
  619829.7169  0.0478 -3.6046 3 1050.4175205  71510 303A2 1A2      A1 0A1        syn-C2H3C(O)NH2, v=0
  619829.7169  0.0478 -5.8085 3 1050.4175205  71510 303A2 1A2      A1 1A1        syn-C2H3C(O)NH2, v=0
  619887.0264  0.0269 -5.8145 3 1026.8091187  71510 30393 984      92 983        syn-C2H3C(O)NH2, v=0
  619887.0264  0.0269 -3.7251 3 1026.8091187  71510 30393 984      921083        syn-C2H3C(O)NH2, v=0
  619887.0264  0.0269 -3.7251 3 1026.8091187  71510 303931084      92 983        syn-C2H3C(O)NH2, v=0
  619887.0264  0.0269 -5.8145 3 1026.8091187  71510 303931084      921083        syn-C2H3C(O)NH2, v=0
  619913.8538  0.0049 -4.7565 3  486.4113117  71510 303581939      581642        syn-C2H3C(O)NH2, v=0
  619939.2636  0.0364 -4.5727 3 1284.8532165  71510 303824537      824438        syn-C2H3C(O)NH2, v=0
  619939.2636  0.0364 -4.5727 3 1284.8532165  71510 303824538      824439        syn-C2H3C(O)NH2, v=0
  619980.6856  0.0257 -5.8096 3 1021.4860185  71510 303921082      911081        syn-C2H3C(O)NH2, v=0
  619980.6856  0.0257 -3.7386 3 1021.4860185  71510 303921082      911181        syn-C2H3C(O)NH2, v=0
  619980.6856  0.0257 -3.7386 3 1021.4860185  71510 303921182      911081        syn-C2H3C(O)NH2, v=0
  619980.6856  0.0257 -5.8096 3 1021.4860185  71510 303921182      911181        syn-C2H3C(O)NH2, v=0
  620120.8495  0.0246 -5.8034 3 1015.5855183  71510 303911180      901179        syn-C2H3C(O)NH2, v=0
  620120.8495  0.0246 -3.7528 3 1015.5855183  71510 303911180      901279        syn-C2H3C(O)NH2, v=0
  620120.8495  0.0246 -3.7528 3 1015.5855183  71510 303911280      901179        syn-C2H3C(O)NH2, v=0
  620120.8495  0.0246 -5.8034 3 1015.5855183  71510 303911280      901279        syn-C2H3C(O)NH2, v=0
  620150.3156  0.1212 -5.2658 3 1512.0276231  71510 303B5 8A7      B5 7A8        syn-C2H3C(O)NH2, v=0
  620150.3156  0.1212 -5.2658 3 1512.0276231  71510 303B5 9A7      B5 8A8        syn-C2H3C(O)NH2, v=0
  620323.3065  0.0360 -4.5408 3 1264.8183163  71510 303814536      814437        syn-C2H3C(O)NH2, v=0
  620323.3065  0.0360 -4.5408 3 1264.8183163  71510 303814537      814438        syn-C2H3C(O)NH2, v=0
  620324.1452  0.0234 -5.7960 3 1009.0907181  71510 303901278      891277        syn-C2H3C(O)NH2, v=0
  620324.1452  0.0234 -3.7679 3 1009.0907181  71510 303901278      891377        syn-C2H3C(O)NH2, v=0
  620324.1452  0.0234 -3.7679 3 1009.0907181  71510 303901378      891277        syn-C2H3C(O)NH2, v=0
  620324.1452  0.0234 -5.7960 3 1009.0907181  71510 303901378      891377        syn-C2H3C(O)NH2, v=0
  620366.9816  0.0705 -5.6308 3 1887.3527215  71510 303A74661      A74562        syn-C2H3C(O)NH2, v=0
  620366.9816  0.0705 -5.6308 3 1887.3527215  71510 303A74662      A74563        syn-C2H3C(O)NH2, v=0
  620509.5053  0.0037 -4.2520 3  177.5560 73  71510 303361225      35 926        syn-C2H3C(O)NH2, v=0
  620511.5659  0.1113 -5.4088 3 1239.0583189  71510 303942569      942272        syn-C2H3C(O)NH2, v=0
  620511.8356  0.0155 -5.6841 3  935.0951167  71510 303831865      821864        syn-C2H3C(O)NH2, v=0
  620613.9134  0.0223 -3.7843 3 1001.9805179  71510 303891376      881475        syn-C2H3C(O)NH2, v=0
  620613.9139  0.0223 -5.7871 3 1001.9805179  71510 303891476      881475        syn-C2H3C(O)NH2, v=0
  620613.9142  0.0223 -5.7871 3 1001.9805179  71510 303891376      881375        syn-C2H3C(O)NH2, v=0
  620613.9147  0.0223 -3.7843 3 1001.9805179  71510 303891476      881375        syn-C2H3C(O)NH2, v=0
  620676.7849  0.0055 -4.7188 3  548.9421127  71510 303631747      631450        syn-C2H3C(O)NH2, v=0
  620694.6718  0.0355 -4.5098 3 1245.0322161  71510 303804535      804436        syn-C2H3C(O)NH2, v=0
  620694.6718  0.0355 -4.5098 3 1245.0322161  71510 303804536      804437        syn-C2H3C(O)NH2, v=0
  620753.1344  0.0021 -3.2383 3  456.7200115  71510 303571741      561640        syn-C2H3C(O)NH2, v=0
  620755.3270  0.1445 -5.6409 3 1776.6958245  71510 303C212B0      C211B1        syn-C2H3C(O)NH2, v=0
  620755.3270  0.1445 -5.6409 3 1776.6958245  71510 303C213B0      C212B1        syn-C2H3C(O)NH2, v=0
  620844.3661  0.0016 -3.1578 3  428.1994111  71510 303551738      541639        syn-C2H3C(O)NH2, v=0
  620890.1639  0.1232 -5.0800 3 1219.8363215  71510 303A7 3A4      A7 2A5        syn-C2H3C(O)NH2, v=0
  620890.1639  0.1232 -5.0800 3 1219.8363215  71510 303A7 4A4      A7 3A5        syn-C2H3C(O)NH2, v=0
  621016.9119  0.0109 -3.8096 3  775.2569151  71510 303751957      741856        syn-C2H3C(O)NH2, v=0
  621024.0921  0.0211 -3.8027 3  994.2276177  71510 303881474      871573        syn-C2H3C(O)NH2, v=0
  621024.1038  0.0211 -5.7767 3  994.2276177  71510 303881574      871573        syn-C2H3C(O)NH2, v=0
  621024.1135  0.0211 -5.7767 3  994.2276177  71510 303881474      871473        syn-C2H3C(O)NH2, v=0
  621024.1253  0.0211 -3.8027 3  994.2276177  71510 303881574      871473        syn-C2H3C(O)NH2, v=0
  621053.6871  0.0351 -4.4796 3 1225.4948159  71510 303794534      794435        syn-C2H3C(O)NH2, v=0
  621053.6871  0.0351 -4.4796 3 1225.4948159  71510 303794535      794436        syn-C2H3C(O)NH2, v=0
  621088.0536  0.0150 -5.6648 3  923.3246165  71510 303822063      812062        syn-C2H3C(O)NH2, v=0
  621150.2489  0.0685 -5.5817 3 1861.0589213  71510 303A64660      A64561        syn-C2H3C(O)NH2, v=0
  621150.2489  0.0685 -5.5817 3 1861.0589213  71510 303A64661      A64562        syn-C2H3C(O)NH2, v=0
  621210.8129  0.0015 -2.9464 3  377.5275101  71510 303501932      491831        syn-C2H3C(O)NH2, v=0
  621213.8300  0.0015 -2.9464 3  377.5274101  71510 303501931      491832        syn-C2H3C(O)NH2, v=0
  621236.3589  0.0025 -3.2816 3  471.3954117  71510 303581742      571641        syn-C2H3C(O)NH2, v=0
  621285.1915  0.0022 -4.9491 3  268.9411 85  71510 303421725      421428        syn-C2H3C(O)NH2, v=0
  621345.0001  0.0053 -4.7300 3  510.6102123  71510 303611646      611349        syn-C2H3C(O)NH2, v=0
  621369.0177  0.0044 -3.6318 3  280.9913 93  71510 303461135      451036        syn-C2H3C(O)NH2, v=0
  621384.7881  0.0980 -5.2384 3 1081.9787177  71510 303882365      882068        syn-C2H3C(O)NH2, v=0
  621400.6731  0.0348 -4.4502 3 1206.2060157  71510 303784533      784434        syn-C2H3C(O)NH2, v=0
  621400.6731  0.0348 -4.4502 3 1206.2060157  71510 303784534      784435        syn-C2H3C(O)NH2, v=0
  621470.6010  0.0039 -5.4197 3   91.6421 55  71510 30327 919      26 422        syn-C2H3C(O)NH2, v=0
  621539.6545  0.1319 -5.3325 3 1113.0455209  71510 303A4 1A3      A4 0A4        syn-C2H3C(O)NH2, v=0
  621539.6545  0.1319 -5.3325 3 1113.0455209  71510 303A4 2A3      A4 1A4        syn-C2H3C(O)NH2, v=0
  621545.4073  0.0068 -4.8072 3  487.9525121  71510 303601446      601149        syn-C2H3C(O)NH2, v=0
  621581.1394  0.0041 -4.8785 3  356.7009105  71510 303521241      52 944        syn-C2H3C(O)NH2, v=0
  621606.1242  0.0200 -3.8239 3  985.7966175  71510 303871572      861671        syn-C2H3C(O)NH2, v=0
  621606.3868  0.0200 -5.7647 3  985.7966175  71510 303871672      861671        syn-C2H3C(O)NH2, v=0
  621606.5905  0.0200 -5.7647 3  985.7966175  71510 303871572      861571        syn-C2H3C(O)NH2, v=0
  621606.8530  0.0200 -3.8239 3  985.7966175  71510 303871672      861571        syn-C2H3C(O)NH2, v=0
  621616.8404  0.0022 -4.9487 3  268.9301 85  71510 303421726      421429        syn-C2H3C(O)NH2, v=0
  621669.3700  0.0045 -4.5717 3  137.7246 73  71510 30336 333      35 234        syn-C2H3C(O)NH2, v=0
  621669.4362  0.0045 -4.5717 3  137.7246 73  71510 30336 433      35 134        syn-C2H3C(O)NH2, v=0
  621709.5548  0.0021 -4.4125 3  146.2361 67  71510 303331122      32 825        syn-C2H3C(O)NH2, v=0
  621735.9430  0.0344 -4.4217 3 1187.1654155  71510 303774532      774433        syn-C2H3C(O)NH2, v=0
  621735.9430  0.0344 -4.4217 3 1187.1654155  71510 303774533      774434        syn-C2H3C(O)NH2, v=0
  621748.3470  0.0023 -2.5701 3  290.9313 61  71510 3033029 1      2928 2        syn-C2H3C(O)NH2, v=0
  621748.3470  0.0023 -2.5701 3  290.9313 61  71510 3033029 2      2928 1        syn-C2H3C(O)NH2, v=0
  621911.1416  0.0666 -5.5332 3 1835.0186211  71510 303A54659      A54560        syn-C2H3C(O)NH2, v=0
  621911.1416  0.0666 -5.5332 3 1835.0186211  71510 303A54660      A54561        syn-C2H3C(O)NH2, v=0
  621992.8328  0.0153 -3.9074 3  935.0951167  71510 303831965      821864        syn-C2H3C(O)NH2, v=0
  622012.8380  0.1269 -5.3604 3 1583.0765235  71510 303B7 9A8      B7 8A9        syn-C2H3C(O)NH2, v=0
  622012.8380  0.1269 -5.3604 3 1583.0765235  71510 303B710A8      B7 9A9        syn-C2H3C(O)NH2, v=0
  622024.5250  0.1203 -5.1487 3 1397.4159225  71510 303B2 6A6      B2 5A7        syn-C2H3C(O)NH2, v=0
  622024.5250  0.1203 -5.1487 3 1397.4159225  71510 303B2 7A6      B2 6A7        syn-C2H3C(O)NH2, v=0
  622050.8386  0.1556 -5.7617 3 1852.1647249  71510 303C413B1      C412B2        syn-C2H3C(O)NH2, v=0
  622050.8386  0.1556 -5.7617 3 1852.1647249  71510 303C414B1      C413B2        syn-C2H3C(O)NH2, v=0
  622059.8035  0.0342 -4.3940 3 1168.3730153  71510 303764531      764432        syn-C2H3C(O)NH2, v=0
  622059.8035  0.0342 -4.3940 3 1168.3730153  71510 303764532      764433        syn-C2H3C(O)NH2, v=0
  622184.7331  0.0020 -2.5913 3  292.8081 65  71510 3033228 4      3127 5        syn-C2H3C(O)NH2, v=0
  622184.7331  0.0020 -2.5913 3  292.8081 65  71510 3033228 5      3127 4        syn-C2H3C(O)NH2, v=0
  622288.2991  0.0024 -3.2892 3  435.9627113  71510 303561640      551541        syn-C2H3C(O)NH2, v=0
  622372.5544  0.0339 -4.3673 3 1149.8287151  71510 303754530      754431        syn-C2H3C(O)NH2, v=0
  622372.5544  0.0339 -4.3673 3 1149.8287151  71510 303754531      754432        syn-C2H3C(O)NH2, v=0
  622438.5861  0.0189 -3.8494 3  976.6390173  71510 303861670      851769        syn-C2H3C(O)NH2, v=0
  622443.4896  0.0189 -5.7507 3  976.6390173  71510 303861770      851769        syn-C2H3C(O)NH2, v=0
  622447.0381  0.0189 -5.7507 3  976.6387173  71510 303861670      851669        syn-C2H3C(O)NH2, v=0
  622451.9416  0.0189 -3.8494 3  976.6387173  71510 303861770      851669        syn-C2H3C(O)NH2, v=0
  622495.3826  0.0169 -5.7429 3  957.4077165  71510 303822459      812458        syn-C2H3C(O)NH2, v=0
  622606.7643  0.0018 -2.6147 3  296.1534 69  71510 3033427 7      3326 8        syn-C2H3C(O)NH2, v=0
  622606.7643  0.0018 -2.6147 3  296.1534 69  71510 3033427 8      3326 7        syn-C2H3C(O)NH2, v=0
  622650.2363  0.0647 -5.4854 3 1809.2315209  71510 303A44658      A44559        syn-C2H3C(O)NH2, v=0
  622650.2363  0.0647 -5.4854 3 1809.2315209  71510 303A44659      A44560        syn-C2H3C(O)NH2, v=0
  622674.4894  0.0337 -4.3415 3 1131.5322149  71510 303744529      744430        syn-C2H3C(O)NH2, v=0
  622674.4894  0.0337 -4.3415 3 1131.5322149  71510 303744530      744431        syn-C2H3C(O)NH2, v=0
  622720.6793  0.0015 -2.8823 3  361.7833 97  71510 303482029      471928        syn-C2H3C(O)NH2, v=0
  622720.7242  0.0015 -2.8823 3  361.7833 97  71510 303482028      471929        syn-C2H3C(O)NH2, v=0
  622807.5756  0.0049 -5.5344 3  210.6106 85  71510 30342 636      42 339        syn-C2H3C(O)NH2, v=0
  622818.0620  0.0049 -5.5344 3  210.6106 85  71510 30342 736      42 439        syn-C2H3C(O)NH2, v=0
  622838.2172  0.0038 -3.6667 3  253.6360 89  71510 303441034      43 935        syn-C2H3C(O)NH2, v=0
  622882.9661  0.0022 -4.9928 3   99.1343 53  71510 303261215      25 916        syn-C2H3C(O)NH2, v=0
  622965.8958  0.0335 -4.3166 3 1113.4833147  71510 303734528      734429        syn-C2H3C(O)NH2, v=0
  622965.8958  0.0335 -4.3166 3 1113.4833147  71510 303734529      734430        syn-C2H3C(O)NH2, v=0
  622980.9534  0.0177 -5.8562 3 1009.9003167  71510 303832757      822756        syn-C2H3C(O)NH2, v=0
  622984.1299  0.0177 -5.8562 3 1009.9004167  71510 303832756      822755        syn-C2H3C(O)NH2, v=0
  623002.3848  0.0017 -2.6408 3  300.9751 73  71510 303362610      352511        syn-C2H3C(O)NH2, v=0
  623002.3848  0.0017 -2.6408 3  300.9751 73  71510 303362611      352510        syn-C2H3C(O)NH2, v=0
  623039.8489  0.0134 -5.6220 3  901.9121163  71510 303811962      801961        syn-C2H3C(O)NH2, v=0
  623091.2958  0.0138 -4.8717 3  655.1489139  71510 303691752      691455        syn-C2H3C(O)NH2, v=0
  623210.5006  0.0173 -5.7420 3  957.4449165  71510 303822458      812457        syn-C2H3C(O)NH2, v=0
  623247.0548  0.0333 -4.2928 3 1095.6820145  71510 303724527      724428        syn-C2H3C(O)NH2, v=0
  623247.0548  0.0333 -4.2928 3 1095.6820145  71510 303724528      724429        syn-C2H3C(O)NH2, v=0
  623353.2177  0.0017 -2.6699 3  307.2835 77  71510 303382513      372414        syn-C2H3C(O)NH2, v=0
  623353.2177  0.0017 -2.6699 3  307.2835 77  71510 303382514      372413        syn-C2H3C(O)NH2, v=0
  623368.0918  0.0629 -5.4382 3 1783.6973207  71510 303A34657      A34558        syn-C2H3C(O)NH2, v=0
  623368.0918  0.0629 -5.4382 3 1783.6973207  71510 303A34658      A34559        syn-C2H3C(O)NH2, v=0
  623388.3498  0.1236 -5.0894 3 1285.7066219  71510 303A9 4A5      A9 3A6        syn-C2H3C(O)NH2, v=0
  623388.3498  0.1236 -5.0894 3 1285.7066219  71510 303A9 5A5      A9 4A6        syn-C2H3C(O)NH2, v=0
  623409.2183  0.0022 -4.9924 3   99.1167 53  71510 303261214      25 917        syn-C2H3C(O)NH2, v=0
  623423.1604  0.0533 -5.4194 3 1247.0444189  71510 303942668      942371        syn-C2H3C(O)NH2, v=0
  623475.9443  0.0015 -2.8278 3  347.7246 93  71510 303462126      452025        syn-C2H3C(O)NH2, v=0
  623475.9447  0.0015 -2.8278 3  347.7246 93  71510 303462125      452026        syn-C2H3C(O)NH2, v=0
  623518.2420  0.0332 -4.2699 3 1078.1281143  71510 303714526      714427        syn-C2H3C(O)NH2, v=0
  623518.2420  0.0332 -4.2699 3 1078.1281143  71510 303714527      714428        syn-C2H3C(O)NH2, v=0
  623591.0244  0.0179 -3.8819 3  966.6857171  71510 303851768      841867        syn-C2H3C(O)NH2, v=0
  623621.1236  0.0038 -4.9612 3  324.9852101  71510 303501040      50 743        syn-C2H3C(O)NH2, v=0
  623631.3986  0.0016 -2.7026 3  315.0918 81  71510 303402416      392317        syn-C2H3C(O)NH2, v=0
  623631.3986  0.0016 -2.7026 3  315.0918 81  71510 303402417      392316        syn-C2H3C(O)NH2, v=0
  623666.4615  0.0179 -5.7344 3  966.6857171  71510 303851868      841867        syn-C2H3C(O)NH2, v=0
  623716.5462  0.0179 -5.7343 3  966.6815171  71510 303851768      841767        syn-C2H3C(O)NH2, v=0
  623740.3000  0.1339 -5.4631 3 1655.3874239  71510 303B910A9      B9 9B0        syn-C2H3C(O)NH2, v=0
  623740.3000  0.1339 -5.4631 3 1655.3874239  71510 303B911A9      B910B0        syn-C2H3C(O)NH2, v=0
  623777.1607  0.0015 -2.7807 3  335.2845 89  71510 303442222      432123        syn-C2H3C(O)NH2, v=0
  623777.1607  0.0015 -2.7807 3  335.2845 89  71510 303442223      432122        syn-C2H3C(O)NH2, v=0
  623779.7270  0.0331 -4.2482 3 1060.8215141  71510 303704525      704426        syn-C2H3C(O)NH2, v=0
  623779.7270  0.0331 -4.2482 3 1060.8215141  71510 303704526      704427        syn-C2H3C(O)NH2, v=0
  623791.9833  0.0178 -3.8816 3  966.6815171  71510 303851868      841767        syn-C2H3C(O)NH2, v=0
  623794.5161  0.0016 -2.7392 3  324.4176 85  71510 303422319      412220        syn-C2H3C(O)NH2, v=0
  623794.5161  0.0016 -2.7392 3  324.4176 85  71510 303422320      412219        syn-C2H3C(O)NH2, v=0
  624031.7740  0.0330 -4.2275 3 1043.7619139  71510 303694524      694425        syn-C2H3C(O)NH2, v=0
  624031.7740  0.0330 -4.2275 3 1043.7619139  71510 303694525      694426        syn-C2H3C(O)NH2, v=0
  624065.2498  0.0612 -5.3917 3 1758.4160205  71510 303A24656      A24557        syn-C2H3C(O)NH2, v=0
  624065.2498  0.0612 -5.3917 3 1758.4160205  71510 303A24657      A24558        syn-C2H3C(O)NH2, v=0
  624150.7942  0.1237 -5.2232 3 1466.5268229  71510 303B4 7A7      B4 6A8        syn-C2H3C(O)NH2, v=0
  624150.7942  0.1237 -5.2232 3 1466.5268229  71510 303B4 8A7      B4 7A8        syn-C2H3C(O)NH2, v=0
  624224.4199  0.0019 -3.6893 3  248.0743 87  71510 303431232      42 933        syn-C2H3C(O)NH2, v=0
  624271.6739  0.1308 -5.1615 3 1176.9339213  71510 303A6 2A4      A6 1A5        syn-C2H3C(O)NH2, v=0
  624271.6739  0.1308 -5.1615 3 1176.9339213  71510 303A6 3A4      A6 2A5        syn-C2H3C(O)NH2, v=0
  624274.6419  0.0330 -4.2080 3 1026.9493137  71510 303684523      684424        syn-C2H3C(O)NH2, v=0
  624274.6419  0.0330 -4.2080 3 1026.9493137  71510 303684524      684425        syn-C2H3C(O)NH2, v=0
  624459.7239  0.0171 -3.9279 3  955.8425169  71510 303841866      831965        syn-C2H3C(O)NH2, v=0
  624499.1121  0.0016 -3.0482 3  408.1109107  71510 303531836      521735        syn-C2H3C(O)NH2, v=0
  624508.5842  0.0329 -4.1897 3 1010.3835135  71510 303674522      674423        syn-C2H3C(O)NH2, v=0
  624508.5842  0.0329 -4.1897 3 1010.3835135  71510 303674523      674424        syn-C2H3C(O)NH2, v=0
  624733.8494  0.0329 -4.1727 3  994.0643133  71510 303664521      664422        syn-C2H3C(O)NH2, v=0
  624733.8494  0.0329 -4.1727 3  994.0643133  71510 303664522      664423        syn-C2H3C(O)NH2, v=0
  624736.7533  0.0016 -3.0479 3  408.1043107  71510 303531835      521736        syn-C2H3C(O)NH2, v=0
  624742.2357  0.0596 -5.3458 3 1733.3871203  71510 303A14655      A14556        syn-C2H3C(O)NH2, v=0
  624742.2357  0.0596 -5.3458 3 1733.3871203  71510 303A14656      A14557        syn-C2H3C(O)NH2, v=0
  624808.9243  0.0488 -4.3396 3 1046.7726175  71510 303872166      862265        syn-C2H3C(O)NH2, v=0
  624838.9128  0.0139 -5.5522 3  866.0594159  71510 303792059      782058        syn-C2H3C(O)NH2, v=0
  624896.6619  0.0079 -4.8195 3  541.0612127  71510 303631548      631251        syn-C2H3C(O)NH2, v=0
  624950.6808  0.0330 -4.1571 3  977.9917131  71510 303654520      654421        syn-C2H3C(O)NH2, v=0
  624950.6808  0.0330 -4.1571 3  977.9917131  71510 303654521      654422        syn-C2H3C(O)NH2, v=0
  625072.7862  0.0044 -4.7072 3  563.0470127  71510 303631945      631648        syn-C2H3C(O)NH2, v=0
  625089.1286  0.0048 -4.7109 3  579.2392129  71510 303641946      641649        syn-C2H3C(O)NH2, v=0
  625105.2504  0.0031 -4.7766 3  381.8516103  71510 303511833      511536        syn-C2H3C(O)NH2, v=0
  625116.4089  0.0021 -4.9893 3  258.4127 83  71510 303411724      411427        syn-C2H3C(O)NH2, v=0
  625153.1706  0.0037 -4.9595 3  324.9852101  71510 303501140      50 843        syn-C2H3C(O)NH2, v=0
  625159.3169  0.0330 -4.1428 3  962.1655129  71510 303644519      644420        syn-C2H3C(O)NH2, v=0
  625159.3169  0.0330 -4.1428 3  962.1655129  71510 303644520      644421        syn-C2H3C(O)NH2, v=0
  625203.2922  0.0179 -5.8259 3  998.6404167  71510 303832658      822657        syn-C2H3C(O)NH2, v=0
  625229.4901  0.0180 -5.8259 3  998.6415167  71510 303832657      822656        syn-C2H3C(O)NH2, v=0
  625293.5105  0.0021 -4.9891 3  258.4068 83  71510 303411725      411428        syn-C2H3C(O)NH2, v=0
  625330.0069  0.1424 -5.5729 3 1728.9557243  71510 303C111B0      C110B1        syn-C2H3C(O)NH2, v=0
  625330.0069  0.1424 -5.5729 3 1728.9557243  71510 303C112B0      C111B1        syn-C2H3C(O)NH2, v=0
  625334.4482  0.0099 -4.8419 3  596.7959133  71510 303661650      661353        syn-C2H3C(O)NH2, v=0
  625359.9916  0.0331 -4.1302 3  946.5855127  71510 303634518      634419        syn-C2H3C(O)NH2, v=0
  625359.9916  0.0331 -4.1302 3  946.5855127  71510 303634519      634420        syn-C2H3C(O)NH2, v=0
  625390.2949  0.0169 -5.7154 3  955.8425169  71510 303841966      831965        syn-C2H3C(O)NH2, v=0
  625399.5596  0.0581 -5.3006 3 1708.6105201  71510 303A04654      A04555        syn-C2H3C(O)NH2, v=0
  625399.5596  0.0581 -5.3006 3 1708.6105201  71510 303A04655      A04556        syn-C2H3C(O)NH2, v=0
  625447.2045  0.0058 -4.7246 3  588.4347131  71510 303651848      651551        syn-C2H3C(O)NH2, v=0
  625456.5013  0.0029 -4.7487 3  394.8256105  71510 303521835      521538        syn-C2H3C(O)NH2, v=0
  625512.4921  0.0051 -4.7556 3  473.4508119  71510 303591545      591248        syn-C2H3C(O)NH2, v=0
  625552.9338  0.0332 -4.1191 3  931.2517125  71510 303624517      624418        syn-C2H3C(O)NH2, v=0
  625552.9338  0.0332 -4.1191 3  931.2517125  71510 303624518      624419        syn-C2H3C(O)NH2, v=0
  625571.0659  0.0032 -5.3322 3  248.0743 85  71510 303421428      42 933        syn-C2H3C(O)NH2, v=0
  625595.2981  0.0171 -5.7161 3  948.1710165  71510 303822360      812359        syn-C2H3C(O)NH2, v=0
  625646.6746  0.0040 -4.3002 3  152.0478 75  71510 30337 433      36 334        syn-C2H3C(O)NH2, v=0
  625647.4982  0.0040 -4.3002 3  152.0478 75  71510 30337 533      36 234        syn-C2H3C(O)NH2, v=0
  625738.3681  0.0333 -4.1099 3  916.1639123  71510 303614516      614417        syn-C2H3C(O)NH2, v=0
  625738.3681  0.0333 -4.1099 3  916.1639123  71510 303614517      614418        syn-C2H3C(O)NH2, v=0
  625739.5865  0.0043 -5.3382 3  237.3087 89  71510 30344 737      44 440        syn-C2H3C(O)NH2, v=0
  625764.7413  0.1250 -5.1296 3 1352.8617223  71510 303B1 5A6      B1 4A7        syn-C2H3C(O)NH2, v=0
  625764.7413  0.1250 -5.1296 3 1352.8617223  71510 303B1 6A6      B1 5A7        syn-C2H3C(O)NH2, v=0
  625782.1729  0.0043 -5.3381 3  237.3087 89  71510 30344 837      44 540        syn-C2H3C(O)NH2, v=0
  625791.4233  0.0344 -5.8528 3 1063.2459197  71510 30398 593      97 592        syn-C2H3C(O)NH2, v=0
  625791.4233  0.0344 -3.7028 3 1063.2459197  71510 30398 593      97 692        syn-C2H3C(O)NH2, v=0
  625791.4233  0.0344 -3.7028 3 1063.2459197  71510 30398 693      97 592        syn-C2H3C(O)NH2, v=0
  625791.4233  0.0344 -5.8528 3 1063.2459197  71510 30398 693      97 692        syn-C2H3C(O)NH2, v=0
  625793.5588  0.0328 -5.8524 3 1060.1153195  71510 30397 691      96 690        syn-C2H3C(O)NH2, v=0
  625793.5588  0.0328 -3.7155 3 1060.1153195  71510 30397 691      96 790        syn-C2H3C(O)NH2, v=0
  625793.5588  0.0328 -3.7155 3 1060.1153195  71510 30397 791      96 690        syn-C2H3C(O)NH2, v=0
  625793.5588  0.0328 -5.8524 3 1060.1153195  71510 30397 791      96 790        syn-C2H3C(O)NH2, v=0
  625797.5465  0.0363 -5.8521 3 1065.8493199  71510 30399 495      98 494        syn-C2H3C(O)NH2, v=0
  625797.5465  0.0363 -3.6899 3 1065.8493199  71510 30399 495      98 594        syn-C2H3C(O)NH2, v=0
  625797.5465  0.0363 -3.6899 3 1065.8493199  71510 30399 595      98 494        syn-C2H3C(O)NH2, v=0
  625797.5465  0.0363 -5.8521 3 1065.8493199  71510 30399 595      98 594        syn-C2H3C(O)NH2, v=0
  625808.0625  0.0314 -5.8509 3 1056.4506193  71510 30396 789      95 788        syn-C2H3C(O)NH2, v=0
  625808.0625  0.0314 -3.7282 3 1056.4506193  71510 30396 789      95 888        syn-C2H3C(O)NH2, v=0
  625808.0625  0.0314 -3.7282 3 1056.4506193  71510 30396 889      95 788        syn-C2H3C(O)NH2, v=0
  625808.0625  0.0314 -5.8509 3 1056.4506193  71510 30396 889      95 888        syn-C2H3C(O)NH2, v=0
  625808.6504  0.0387 -5.8504 3 1067.9311201  71510 303A0 397      99 396        syn-C2H3C(O)NH2, v=0
  625808.6504  0.0387 -3.6768 3 1067.9311201  71510 303A0 397      99 496        syn-C2H3C(O)NH2, v=0
  625808.6504  0.0387 -3.6768 3 1067.9311201  71510 303A0 497      99 396        syn-C2H3C(O)NH2, v=0
  625808.6504  0.0387 -5.8504 3 1067.9311201  71510 303A0 497      99 496        syn-C2H3C(O)NH2, v=0
  625822.0930  0.0418 -5.8477 3 1069.4962203  71510 303A1 299      A0 298        syn-C2H3C(O)NH2, v=0
  625822.0930  0.0418 -3.6633 3 1069.4962203  71510 303A1 299      A0 398        syn-C2H3C(O)NH2, v=0
  625822.0930  0.0418 -3.6633 3 1069.4962203  71510 303A1 399      A0 298        syn-C2H3C(O)NH2, v=0
  625822.0930  0.0418 -5.8477 3 1069.4962203  71510 303A1 399      A0 398        syn-C2H3C(O)NH2, v=0
  625835.7247  0.0458 -5.8439 3 1070.5489205  71510 303A2 1A1      A1 1A0        syn-C2H3C(O)NH2, v=0
  625835.7247  0.0458 -3.6494 3 1070.5489205  71510 303A2 1A1      A1 2A0        syn-C2H3C(O)NH2, v=0
  625835.7247  0.0458 -3.6494 3 1070.5489205  71510 303A2 2A1      A1 1A0        syn-C2H3C(O)NH2, v=0
  625835.7247  0.0458 -5.8439 3 1070.5489205  71510 303A2 2A1      A1 2A0        syn-C2H3C(O)NH2, v=0
  625840.1458  0.0301 -5.8483 3 1052.2441191  71510 30395 887      94 886        syn-C2H3C(O)NH2, v=0
  625840.1458  0.0301 -3.7408 3 1052.2441191  71510 30395 887      94 986        syn-C2H3C(O)NH2, v=0
  625840.1458  0.0301 -3.7408 3 1052.2441191  71510 30395 987      94 886        syn-C2H3C(O)NH2, v=0
  625840.1458  0.0301 -5.8483 3 1052.2441191  71510 30395 987      94 986        syn-C2H3C(O)NH2, v=0
  625847.7816  0.0509 -5.8391 3 1071.0928207  71510 303A3 0A3      A2 0A2        syn-C2H3C(O)NH2, v=0
  625847.7816  0.0509 -3.6352 3 1071.0928207  71510 303A3 0A3      A2 1A2        syn-C2H3C(O)NH2, v=0
  625847.7816  0.0509 -3.6352 3 1071.0928207  71510 303A3 1A3      A2 0A2        syn-C2H3C(O)NH2, v=0
  625847.7816  0.0509 -5.8391 3 1071.0928207  71510 303A3 1A3      A2 1A2        syn-C2H3C(O)NH2, v=0
  625896.5048  0.0289 -5.8446 3 1047.4864189  71510 30394 985      93 984        syn-C2H3C(O)NH2, v=0
  625896.5048  0.0289 -3.7536 3 1047.4864189  71510 30394 985      931084        syn-C2H3C(O)NH2, v=0
  625896.5048  0.0289 -3.7536 3 1047.4864189  71510 303941085      93 984        syn-C2H3C(O)NH2, v=0
  625896.5048  0.0289 -5.8446 3 1047.4864189  71510 303941085      931084        syn-C2H3C(O)NH2, v=0
  625916.5144  0.0334 -4.1026 3  901.3219121  71510 303604515      604416        syn-C2H3C(O)NH2, v=0
  625916.5144  0.0334 -4.1026 3  901.3219121  71510 303604516      604417        syn-C2H3C(O)NH2, v=0
  625940.7211  0.0169 -5.7146 3  955.7931169  71510 303841866      831865        syn-C2H3C(O)NH2, v=0
  625960.5764  0.0037 -4.3396 3  168.3537 71  71510 303351224      34 925        syn-C2H3C(O)NH2, v=0
  625985.8755  0.0276 -5.8396 3 1042.1663187  71510 303931083      921082        syn-C2H3C(O)NH2, v=0
  625985.8755  0.0276 -3.7667 3 1042.1663187  71510 303931083      921182        syn-C2H3C(O)NH2, v=0
  625985.8755  0.0276 -3.7667 3 1042.1663187  71510 303931183      921082        syn-C2H3C(O)NH2, v=0
  625985.8755  0.0276 -5.8396 3 1042.1663187  71510 303931183      921182        syn-C2H3C(O)NH2, v=0
  626037.7166  0.0566 -5.2560 3 1684.0860199  71510 303994653      994554        syn-C2H3C(O)NH2, v=0
  626037.7166  0.0566 -5.2560 3 1684.0860199  71510 303994654      994555        syn-C2H3C(O)NH2, v=0
  626087.5883  0.0335 -4.0974 3  886.7257119  71510 303594514      594415        syn-C2H3C(O)NH2, v=0
  626087.5883  0.0335 -4.0974 3  886.7257119  71510 303594515      594416        syn-C2H3C(O)NH2, v=0
  626119.8620  0.0264 -5.8334 3 1036.2705185  71510 303921181      911180        syn-C2H3C(O)NH2, v=0
  626119.8620  0.0264 -3.7804 3 1036.2705185  71510 303921181      911280        syn-C2H3C(O)NH2, v=0
  626119.8620  0.0264 -3.7804 3 1036.2705185  71510 303921281      911180        syn-C2H3C(O)NH2, v=0
  626119.8620  0.0264 -5.8334 3 1036.2705185  71510 303921281      911280        syn-C2H3C(O)NH2, v=0
  626128.3118  0.0158 -5.6758 3  931.4958165  71510 303822162      812161        syn-C2H3C(O)NH2, v=0
  626148.1096  0.1283 -5.3095 3 1536.9090233  71510 303B6 8A8      B6 7A9        syn-C2H3C(O)NH2, v=0
  626148.1096  0.1283 -5.3095 3 1536.9090233  71510 303B6 9A8      B6 8A9        syn-C2H3C(O)NH2, v=0
  626251.8011  0.0337 -4.0946 3  872.3752117  71510 303584513      584414        syn-C2H3C(O)NH2, v=0
  626251.8011  0.0337 -4.0946 3  872.3752117  71510 303584514      584415        syn-C2H3C(O)NH2, v=0
  626314.2162  0.0252 -5.8259 3 1029.7825183  71510 303911279      901278        syn-C2H3C(O)NH2, v=0
  626314.2162  0.0252 -3.7950 3 1029.7825183  71510 303911279      901378        syn-C2H3C(O)NH2, v=0
  626314.2162  0.0252 -3.7950 3 1029.7825183  71510 303911379      901278        syn-C2H3C(O)NH2, v=0
  626314.2162  0.0252 -5.8259 3 1029.7825183  71510 303911379      901378        syn-C2H3C(O)NH2, v=0
  626325.6201  0.0025 -3.6573 3  243.1369 87  71510 303431133      42 834        syn-C2H3C(O)NH2, v=0
  626409.3597  0.0339 -4.0944 3  858.2701115  71510 303574512      574413        syn-C2H3C(O)NH2, v=0
  626409.3597  0.0339 -4.0944 3  858.2701115  71510 303574513      574414        syn-C2H3C(O)NH2, v=0
  626438.2347  0.0294 -4.1607 3  994.8195171  71510 303852065      842164        syn-C2H3C(O)NH2, v=0
  626455.8684  0.0027 -3.7001 3  227.4710 85  71510 303421033      41 734        syn-C2H3C(O)NH2, v=0
  626467.0684  0.0034 -5.2728 3  258.8467 87  71510 303431429      43 934        syn-C2H3C(O)NH2, v=0
  626545.7860  0.0037 -5.0602 3  294.5069 97  71510 30348 939      48 642        syn-C2H3C(O)NH2, v=0
  626560.4671  0.0340 -4.0973 3  844.4105113  71510 303564511      564412        syn-C2H3C(O)NH2, v=0
  626560.4671  0.0340 -4.0973 3  844.4105113  71510 303564512      564413        syn-C2H3C(O)NH2, v=0
  626590.8986  0.0240 -3.8108 3 1022.6819181  71510 303901377      891476        syn-C2H3C(O)NH2, v=0
  626590.8988  0.0240 -5.8170 3 1022.6819181  71510 303901477      891476        syn-C2H3C(O)NH2, v=0
  626590.8990  0.0240 -5.8170 3 1022.6819181  71510 303901377      891376        syn-C2H3C(O)NH2, v=0
  626590.8993  0.0240 -3.8108 3 1022.6819181  71510 303901477      891376        syn-C2H3C(O)NH2, v=0
  626657.1879  0.0553 -5.2122 3 1659.8133197  71510 303984652      984553        syn-C2H3C(O)NH2, v=0
  626657.1879  0.0553 -5.2122 3 1659.8133197  71510 303984653      984554        syn-C2H3C(O)NH2, v=0
  626665.6291  0.0030 -3.7692 3  211.9498 83  71510 30341 833      40 734        syn-C2H3C(O)NH2, v=0
  626705.3219  0.0342 -4.1036 3  830.7961111  71510 303554510      554411        syn-C2H3C(O)NH2, v=0
  626705.3219  0.0342 -4.1036 3  830.7961111  71510 303554511      554412        syn-C2H3C(O)NH2, v=0
  626728.0841  0.0821 -5.1714 3 1007.2549171  71510 303852263      851966        syn-C2H3C(O)NH2, v=0
  626747.9984  0.0042 -4.7074 3  547.0767125  71510 303621944      621647        syn-C2H3C(O)NH2, v=0
  626779.0746  0.1523 -5.6892 3 1803.7766247  71510 303C312B1      C311B2        syn-C2H3C(O)NH2, v=0
  626779.0746  0.1523 -5.6892 3 1803.7766247  71510 303C313B1      C312B2        syn-C2H3C(O)NH2, v=0
  626844.1189  0.0345 -4.1139 3  817.4269109  71510 3035445 9      544410        syn-C2H3C(O)NH2, v=0
  626844.1189  0.0345 -4.1139 3  817.4269109  71510 303544510      544411        syn-C2H3C(O)NH2, v=0
  626871.2921  0.0167 -3.9243 3  955.7931169  71510 303841966      831865        syn-C2H3C(O)NH2, v=0
  626886.2807  0.1304 -5.1183 3 1242.1159217  71510 303A8 3A5      A8 2A6        syn-C2H3C(O)NH2, v=0
  626886.2807  0.1304 -5.1183 3 1242.1159217  71510 303A8 4A5      A8 3A6        syn-C2H3C(O)NH2, v=0
  626977.0486  0.0347 -4.1289 3  804.3027107  71510 3035345 8      5344 9        syn-C2H3C(O)NH2, v=0
  626977.0486  0.0347 -4.1289 3  804.3027107  71510 3035345 9      534410        syn-C2H3C(O)NH2, v=0
  626981.5710  0.0228 -3.8284 3 1014.9427179  71510 303891475      881574        syn-C2H3C(O)NH2, v=0
  626981.5775  0.0228 -5.8067 3 1014.9427179  71510 303891575      881574        syn-C2H3C(O)NH2, v=0
  626981.5828  0.0228 -5.8067 3 1014.9427179  71510 303891475      881474        syn-C2H3C(O)NH2, v=0
  626981.5892  0.0228 -3.8284 3 1014.9427179  71510 303891575      881474        syn-C2H3C(O)NH2, v=0
  627009.2681  0.0040 -3.3999 3  416.1321111  71510 303551540      541441        syn-C2H3C(O)NH2, v=0
  627017.5351  0.0052 -4.7191 3  595.6462131  71510 303651947      651650        syn-C2H3C(O)NH2, v=0
  627047.0605  0.0146 -5.6548 3  922.6944165  71510 303821963      811962        syn-C2H3C(O)NH2, v=0
  627056.3943  0.0036 -5.0596 3  294.5069 97  71510 303481039      48 742        syn-C2H3C(O)NH2, v=0
  627082.9084  0.0038 -5.1837 3  265.2777 93  71510 30346 838      46 541        syn-C2H3C(O)NH2, v=0
  627083.9549  0.0162 -5.6944 3  944.0419167  71510 303832064      822063        syn-C2H3C(O)NH2, v=0
  627104.2978  0.0349 -4.1498 3  791.4235105  71510 3035245 7      5244 8        syn-C2H3C(O)NH2, v=0
  627104.2978  0.0349 -4.1498 3  791.4235105  71510 3035245 8      5244 9        syn-C2H3C(O)NH2, v=0
  627149.3062  0.1014 -5.5188 3 1321.3795195  71510 303972671      972374        syn-C2H3C(O)NH2, v=0
  627226.0135  0.0194 -4.0177 3  964.9592169  71510 303841965      832064        syn-C2H3C(O)NH2, v=0
  627226.0495  0.0352 -4.1779 3  778.7891103  71510 3035145 6      5144 7        syn-C2H3C(O)NH2, v=0
  627226.0495  0.0352 -4.1779 3  778.7891103  71510 3035145 7      5144 8        syn-C2H3C(O)NH2, v=0
  627237.8811  0.0038 -5.1835 3  265.2777 93  71510 30346 938      46 641        syn-C2H3C(O)NH2, v=0
  627258.4411  0.0539 -5.1690 3 1635.7922195  71510 303974651      974552        syn-C2H3C(O)NH2, v=0
  627258.4411  0.0539 -5.1690 3 1635.7922195  71510 303974652      974553        syn-C2H3C(O)NH2, v=0
  627342.4825  0.0354 -4.2154 3  766.3995101  71510 3035045 5      5044 6        syn-C2H3C(O)NH2, v=0
  627342.4825  0.0354 -4.2154 3  766.3995101  71510 3035045 6      5044 7        syn-C2H3C(O)NH2, v=0
  627453.7722  0.0357 -4.2655 3  754.2545 99  71510 3034945 4      4944 5        syn-C2H3C(O)NH2, v=0
  627453.7722  0.0357 -4.2655 3  754.2545 99  71510 3034945 5      4944 6        syn-C2H3C(O)NH2, v=0
  627459.0391  0.0167 -5.6929 3  939.6226165  71510 303822261      812260        syn-C2H3C(O)NH2, v=0
  627463.8132  0.0022 -4.9104 3  105.6464 55  71510 303271216      26 917        syn-C2H3C(O)NH2, v=0
  627533.7914  0.0216 -3.8486 3 1006.5312177  71510 303881573      871672        syn-C2H3C(O)NH2, v=0
  627533.9386  0.0216 -5.7946 3 1006.5312177  71510 303881673      871672        syn-C2H3C(O)NH2, v=0
  627534.0540  0.0216 -5.7946 3 1006.5312177  71510 303881573      871572        syn-C2H3C(O)NH2, v=0
  627534.2012  0.0216 -3.8486 3 1006.5312177  71510 303881673      871572        syn-C2H3C(O)NH2, v=0
  627543.0842  0.1393 -5.3687 3 1134.3230211  71510 303A5 1A4      A5 0A5        syn-C2H3C(O)NH2, v=0
  627543.0842  0.1393 -5.3687 3 1134.3230211  71510 303A5 2A4      A5 1A5        syn-C2H3C(O)NH2, v=0
  627560.0901  0.0360 -4.3336 3  742.3540 97  71510 3034845 3      4844 4        syn-C2H3C(O)NH2, v=0
  627560.0901  0.0360 -4.3336 3  742.3540 97  71510 3034845 4      4844 5        syn-C2H3C(O)NH2, v=0
  627601.3116  0.0049 -3.4802 3  383.3474107  71510 303531439      521340        syn-C2H3C(O)NH2, v=0
  627661.6038  0.0362 -4.4302 3  730.6980 95  71510 3034745 2      4744 3        syn-C2H3C(O)NH2, v=0
  627661.6038  0.0362 -4.4302 3  730.6980 95  71510 3034745 3      4744 4        syn-C2H3C(O)NH2, v=0
  627662.6673  0.0017 -3.1896 3  442.1368113  71510 303561739      551640        syn-C2H3C(O)NH2, v=0
  627758.4775  0.0365 -4.5783 3  719.2863 93  71510 3034645 1      4644 2        syn-C2H3C(O)NH2, v=0
  627758.4775  0.0365 -4.5783 3  719.2863 93  71510 3034645 2      4644 3        syn-C2H3C(O)NH2, v=0
  627841.9311  0.0527 -5.1264 3 1612.0225193  71510 303964650      964551        syn-C2H3C(O)NH2, v=0
  627841.9311  0.0527 -5.1264 3 1612.0225193  71510 303964651      964552        syn-C2H3C(O)NH2, v=0
  627850.8717  0.0368 -4.8517 3  708.1188 91  71510 3034545 0      4544 1        syn-C2H3C(O)NH2, v=0
  627850.8717  0.0368 -4.8517 3  708.1188 91  71510 3034545 1      4544 2        syn-C2H3C(O)NH2, v=0
  627863.3176  0.0016 -2.9655 3  389.9827103  71510 303511933      501832        syn-C2H3C(O)NH2, v=0
  627869.4622  0.0016 -2.9655 3  389.9826103  71510 303511932      501833        syn-C2H3C(O)NH2, v=0
  627875.4081  0.0183 -5.7966 3  988.0480167  71510 303832559      822558        syn-C2H3C(O)NH2, v=0
  627896.1762  0.0033 -5.4151 3  237.4683 83  71510 303411427      41 932        syn-C2H3C(O)NH2, v=0
  628013.7258  0.0066 -3.6052 3  622.2220135  71510 303671850      661749        syn-C2H3C(O)NH2, v=0
  628014.1675  0.1342 -5.4053 3 1608.5578237  71510 303B8 9A9      B8 8B0        syn-C2H3C(O)NH2, v=0
  628014.1675  0.1342 -5.4053 3 1608.5578237  71510 303B810A9      B8 9B0        syn-C2H3C(O)NH2, v=0
  628017.4692  0.1274 -5.1904 3 1421.2971227  71510 303B3 6A7      B3 5A8        syn-C2H3C(O)NH2, v=0
  628017.4692  0.1274 -5.1904 3 1421.2971227  71510 303B3 7A7      B3 6A8        syn-C2H3C(O)NH2, v=0
  628063.0028  0.0184 -5.7964 3  988.0569167  71510 303832558      822557        syn-C2H3C(O)NH2, v=0
  628084.4130  0.1638 -5.8112 3 1879.8451251  71510 303C513B2      C512B3        syn-C2H3C(O)NH2, v=0
  628084.4130  0.1638 -5.8112 3 1879.8451251  71510 303C514B2      C513B3        syn-C2H3C(O)NH2, v=0
  628320.7307  0.0204 -3.8727 3  997.4015175  71510 303871671      861770        syn-C2H3C(O)NH2, v=0
  628323.5607  0.0204 -5.7807 3  997.4015175  71510 303871771      861770        syn-C2H3C(O)NH2, v=0
  628325.6342  0.0204 -5.7807 3  997.4013175  71510 303871671      861670        syn-C2H3C(O)NH2, v=0
  628328.4642  0.0204 -3.8727 3  997.4013175  71510 303871771      861670        syn-C2H3C(O)NH2, v=0
  628408.1005  0.0515 -5.0846 3 1588.5040191  71510 303954649      954550        syn-C2H3C(O)NH2, v=0
  628408.1005  0.0515 -5.0846 3 1588.5040191  71510 303954650      954551        syn-C2H3C(O)NH2, v=0
  628480.6886  0.0022 -4.9096 3  105.6125 55  71510 303271215      26 918        syn-C2H3C(O)NH2, v=0
  628552.8442  0.0036 -4.1092 3  166.6484 77  71510 30338 533      37 434        syn-C2H3C(O)NH2, v=0
  628560.8328  0.0036 -4.1092 3  166.6484 77  71510 30338 633      37 334        syn-C2H3C(O)NH2, v=0
  628571.7575  0.0021 -5.0323 3  248.1550 81  71510 303401723      401426        syn-C2H3C(O)NH2, v=0
  628622.6596  0.3990 -5.7191 3 1632.8132217  71510 303A82880      A72979        syn-C2H3C(O)NH2, v=0
  628664.0626  0.0021 -5.0322 3  248.1519 81  71510 303401724      401427        syn-C2H3C(O)NH2, v=0
  628780.8956  0.0028 -3.7671 3  211.9487 83  71510 30341 933      40 634        syn-C2H3C(O)NH2, v=0
  628957.3799  0.0504 -5.0434 3 1565.2365189  71510 303944648      944549        syn-C2H3C(O)NH2, v=0
  628957.3799  0.0504 -5.0434 3 1565.2365189  71510 303944649      944550        syn-C2H3C(O)NH2, v=0
  629016.2969  0.0023 -2.5764 3  298.2297 63  71510 3033129 2      3028 3        syn-C2H3C(O)NH2, v=0
  629016.2969  0.0023 -2.5764 3  298.2297 63  71510 3033129 3      3028 2        syn-C2H3C(O)NH2, v=0
  629018.6511  0.0191 -5.6544 3  919.6627163  71510 303812259      802258        syn-C2H3C(O)NH2, v=0
  629231.5780  0.0190 -5.7115 3  948.3928165  71510 303822359      812358        syn-C2H3C(O)NH2, v=0
  629381.8465  0.1309 -5.1290 3 1308.5870221  71510 303B0 4A6      B0 3A7        syn-C2H3C(O)NH2, v=0
  629381.8465  0.1309 -5.1290 3 1308.5870221  71510 303B0 5A6      B0 4A7        syn-C2H3C(O)NH2, v=0
  629427.0095  0.0193 -3.9030 3  987.4890173  71510 303861769      851868        syn-C2H3C(O)NH2, v=0
  629449.2806  0.0020 -2.5981 3  300.6000 67  71510 3033328 5      3227 6        syn-C2H3C(O)NH2, v=0
  629449.2806  0.0020 -2.5981 3  300.6000 67  71510 3033328 6      3227 5        syn-C2H3C(O)NH2, v=0
  629472.0449  0.0193 -5.7646 3  987.4890173  71510 303861869      851868        syn-C2H3C(O)NH2, v=0
  629490.1889  0.0493 -5.0030 3 1542.2198187  71510 303934647      934548        syn-C2H3C(O)NH2, v=0
  629490.1889  0.0493 -5.0030 3 1542.2198187  71510 303934648      934549        syn-C2H3C(O)NH2, v=0
  629502.4466  0.0193 -5.7646 3  987.4865173  71510 303861769      851768        syn-C2H3C(O)NH2, v=0
  629527.1710  0.0109 -3.7933 3  755.9176149  71510 303741956      731855        syn-C2H3C(O)NH2, v=0
  629547.4820  0.0193 -3.9028 3  987.4865173  71510 303861869      851768        syn-C2H3C(O)NH2, v=0
  629597.7319  0.0015 -2.8987 3  373.6784 99  71510 303492030      481929        syn-C2H3C(O)NH2, v=0
  629597.8325  0.0015 -2.8987 3  373.6784 99  71510 303492029      481930        syn-C2H3C(O)NH2, v=0
  629620.0832  0.0056 -5.6332 3   87.6806 55  71510 30327 820      26 323        syn-C2H3C(O)NH2, v=0
  629716.2369  0.0176 -5.5976 3  892.2608161  71510 303802159      792158        syn-C2H3C(O)NH2, v=0
  629746.5107  0.1415 -5.5093 3 1681.4686241  71510 303C010B0      C0 9B1        syn-C2H3C(O)NH2, v=0
  629746.5107  0.1415 -5.5093 3 1681.4686241  71510 303C011B0      C010B1        syn-C2H3C(O)NH2, v=0
  629857.8075  0.0040 -4.7111 3  531.3360123  71510 303611943      611646        syn-C2H3C(O)NH2, v=0
  629864.8168  0.0018 -2.6222 3  304.4411 71  71510 3033527 8      3426 9        syn-C2H3C(O)NH2, v=0
  629864.8168  0.0018 -2.6222 3  304.4411 71  71510 3033527 9      3426 8        syn-C2H3C(O)NH2, v=0
  629887.2481  0.0030 -3.8549 3  196.6190 81  71510 30340 733      39 634        syn-C2H3C(O)NH2, v=0
  630006.9363  0.0483 -4.9632 3 1519.4536185  71510 303924646      924547        syn-C2H3C(O)NH2, v=0
  630006.9363  0.0483 -4.9632 3 1519.4536185  71510 303924647      924548        syn-C2H3C(O)NH2, v=0
  630123.6813  0.0059 -5.4830 3  237.5095 85  71510 303421230      42 735        syn-C2H3C(O)NH2, v=0
  630127.7410  0.0033 -3.9659 3  181.5114 79  71510 30339 633      38 534        syn-C2H3C(O)NH2, v=0
  630144.5476  0.1310 -5.2661 3 1491.0082231  71510 303B5 7A8      B5 6A9        syn-C2H3C(O)NH2, v=0
  630144.5476  0.1310 -5.2661 3 1491.0082231  71510 303B5 8A8      B5 7A9        syn-C2H3C(O)NH2, v=0
  630190.2054  0.0033 -3.9658 3  181.5114 79  71510 30339 733      38 434        syn-C2H3C(O)NH2, v=0
  630202.8960  0.0049 -4.8508 3  402.7059111  71510 303551243      55 946        syn-C2H3C(O)NH2, v=0
  630249.4903  0.0017 -2.6491 3  309.7613 75  71510 303372611      362512        syn-C2H3C(O)NH2, v=0
  630249.4903  0.0017 -2.6491 3  309.7613 75  71510 303372612      362511        syn-C2H3C(O)NH2, v=0
  630270.4422  0.1382 -5.1990 3 1198.8128215  71510 303A7 2A5      A7 1A6        syn-C2H3C(O)NH2, v=0
  630270.4422  0.1382 -5.1990 3 1198.8128215  71510 303A7 3A5      A7 2A6        syn-C2H3C(O)NH2, v=0
  630287.9492  0.0030 -3.8544 3  196.6188 81  71510 30340 833      39 534        syn-C2H3C(O)NH2, v=0
  630490.8163  0.0016 -2.8423 3  359.0783 95  71510 303472127      462026        syn-C2H3C(O)NH2, v=0
  630490.8174  0.0016 -2.8423 3  359.0783 95  71510 303472126      462027        syn-C2H3C(O)NH2, v=0
  630504.1205  0.0064 -4.7975 3  570.9613127  71510 303632043      631746        syn-C2H3C(O)NH2, v=0
  630508.0204  0.0474 -4.9242 3 1496.9378183  71510 303914645      914546        syn-C2H3C(O)NH2, v=0
  630508.0204  0.0474 -4.9242 3 1496.9378183  71510 303914646      914547        syn-C2H3C(O)NH2, v=0
  630519.9788  0.0036 -5.2351 3  269.7915 89  71510 303441430      44 935        syn-C2H3C(O)NH2, v=0
  630538.8761  0.0185 -3.9448 3  976.7033171  71510 303851867      841966        syn-C2H3C(O)NH2, v=0
  630540.2207  0.0016 -3.0726 3  421.4317109  71510 303541837      531736        syn-C2H3C(O)NH2, v=0
  630583.0027  0.0017 -2.6792 3  316.5716 79  71510 303392514      382415        syn-C2H3C(O)NH2, v=0
  630583.0027  0.0017 -2.6792 3  316.5716 79  71510 303392515      382414        syn-C2H3C(O)NH2, v=0
  630834.7170  0.0016 -2.7128 3  324.8863 83  71510 303412417      402318        syn-C2H3C(O)NH2, v=0
  630834.7170  0.0016 -2.7128 3  324.8863 83  71510 303412418      402317        syn-C2H3C(O)NH2, v=0
  630870.9761  0.0035 -4.4182 3  159.4369 69  71510 303341223      33 924        syn-C2H3C(O)NH2, v=0
  630881.3997  0.0016 -2.7935 3  346.1097 91  71510 303452223      442124        syn-C2H3C(O)NH2, v=0
  630881.3997  0.0016 -2.7935 3  346.1097 91  71510 303452224      442123        syn-C2H3C(O)NH2, v=0
  630958.1059  0.0016 -2.7507 3  334.7239 87  71510 303432320      422221        syn-C2H3C(O)NH2, v=0
  630958.1059  0.0016 -2.7507 3  334.7239 87  71510 303432321      422220        syn-C2H3C(O)NH2, v=0
  630972.1497  0.0016 -3.0721 3  421.4197109  71510 303541836      531737        syn-C2H3C(O)NH2, v=0
  630986.1499  0.0186 -5.7684 3  978.1720167  71510 303832460      822459        syn-C2H3C(O)NH2, v=0
  630993.8296  0.0465 -4.8858 3 1474.6723181  71510 303904644      904545        syn-C2H3C(O)NH2, v=0
  630993.8296  0.0465 -4.8858 3 1474.6723181  71510 303904645      904546        syn-C2H3C(O)NH2, v=0
  631028.0869  0.0057 -4.7320 3  612.2622133  71510 303661948      661651        syn-C2H3C(O)NH2, v=0
  631118.2174  0.0183 -5.7459 3  976.7033171  71510 303851967      841966        syn-C2H3C(O)NH2, v=0
  631268.0047  0.0048 -4.7937 3  437.4780115  71510 303571444      571147        syn-C2H3C(O)NH2, v=0
  631278.9098  0.0028 -4.7701 3  381.6453103  71510 303511834      511537        syn-C2H3C(O)NH2, v=0
  631329.8526  0.0158 -5.6874 3  943.6105167  71510 303831964      821963        syn-C2H3C(O)NH2, v=0
  631342.5151  0.1502 -5.6204 3 1755.6365245  71510 303C211B1      C210B2        syn-C2H3C(O)NH2, v=0
  631342.5151  0.1502 -5.6204 3 1755.6365245  71510 303C212B1      C211B2        syn-C2H3C(O)NH2, v=0
  631440.2749  0.0022 -4.8325 3  112.4350 57  71510 303281217      27 918        syn-C2H3C(O)NH2, v=0
  631464.7429  0.0457 -4.8482 3 1452.6567179  71510 303894643      894544        syn-C2H3C(O)NH2, v=0
  631464.7429  0.0457 -4.8482 3 1452.6567179  71510 303894644      894545        syn-C2H3C(O)NH2, v=0
  631469.4471  0.0183 -5.7453 3  976.6723171  71510 303851867      841866        syn-C2H3C(O)NH2, v=0
  631672.2575  0.0144 -5.5810 3  886.9018161  71510 303802060      792059        syn-C2H3C(O)NH2, v=0
  631700.3712  0.0020 -5.0780 3  238.1654 79  71510 303391722      391425        syn-C2H3C(O)NH2, v=0
  631747.3055  0.0020 -5.0780 3  238.1639 79  71510 303391723      391426        syn-C2H3C(O)NH2, v=0
  631756.6466  0.1324 -5.1705 3 1376.3428225  71510 303B2 5A7      B2 4A8        syn-C2H3C(O)NH2, v=0
  631756.6466  0.1324 -5.1705 3 1376.3428225  71510 303B2 6A7      B2 5A8        syn-C2H3C(O)NH2, v=0
  631807.4334  0.0368 -3.7330 3 1084.1201199  71510 30399 594      98 693        syn-C2H3C(O)NH2, v=0
  631807.4334  0.0368 -3.7330 3 1084.1201199  71510 30399 694      98 593        syn-C2H3C(O)NH2, v=0
  631808.6687  0.0351 -3.7455 3 1080.9895197  71510 30398 692      97 791        syn-C2H3C(O)NH2, v=0
  631808.6687  0.0351 -3.7455 3 1080.9895197  71510 30398 792      97 691        syn-C2H3C(O)NH2, v=0
  631814.1364  0.0389 -3.7204 3 1086.7236201  71510 303A0 496      99 595        syn-C2H3C(O)NH2, v=0
  631814.1364  0.0389 -3.7204 3 1086.7236201  71510 303A0 596      99 495        syn-C2H3C(O)NH2, v=0
  631821.8235  0.0336 -3.7579 3 1077.3253195  71510 30397 790      96 889        syn-C2H3C(O)NH2, v=0
  631821.8235  0.0336 -3.7579 3 1077.3253195  71510 30397 890      96 789        syn-C2H3C(O)NH2, v=0
  631825.5922  0.0414 -3.7074 3 1088.8058203  71510 303A1 398      A0 497        syn-C2H3C(O)NH2, v=0
  631825.5922  0.0414 -3.7074 3 1088.8058203  71510 303A1 498      A0 397        syn-C2H3C(O)NH2, v=0
  631827.7529  0.0025 -5.7636 3   70.0433 41  71510 3032013 8      1910 9        syn-C2H3C(O)NH2, v=0
  631827.9057  0.0025 -5.7636 3   70.0433 41  71510 3032013 7      191010        syn-C2H3C(O)NH2, v=0
  631839.2261  0.0447 -3.6941 3 1090.3714205  71510 303A2 2A0      A1 399        syn-C2H3C(O)NH2, v=0
  631839.2261  0.0447 -3.6941 3 1090.3714205  71510 303A2 3A0      A1 299        syn-C2H3C(O)NH2, v=0
  631851.9300  0.0322 -3.7702 3 1073.1199193  71510 30396 888      95 987        syn-C2H3C(O)NH2, v=0
  631851.9300  0.0322 -3.7702 3 1073.1199193  71510 30396 988      95 887        syn-C2H3C(O)NH2, v=0
  631852.9374  0.0489 -3.6804 3 1091.4245207  71510 303A3 1A2      A2 2A1        syn-C2H3C(O)NH2, v=0
  631852.9374  0.0489 -3.6804 3 1091.4245207  71510 303A3 2A2      A2 1A1        syn-C2H3C(O)NH2, v=0
  631864.9979  0.0542 -3.6663 3 1091.9688209  71510 303A4 0A4      A3 1A3        syn-C2H3C(O)NH2, v=0
  631864.9979  0.0542 -3.6663 3 1091.9688209  71510 303A4 1A4      A3 0A3        syn-C2H3C(O)NH2, v=0
  631905.4303  0.0309 -3.7827 3 1068.3640191  71510 30395 986      941085        syn-C2H3C(O)NH2, v=0
  631905.4303  0.0309 -3.7827 3 1068.3640191  71510 303951086      94 985        syn-C2H3C(O)NH2, v=0
  631921.1299  0.0449 -4.8113 3 1430.8909177  71510 303884642      884543        syn-C2H3C(O)NH2, v=0
  631921.1299  0.0449 -4.8113 3 1430.8909177  71510 303884643      884544        syn-C2H3C(O)NH2, v=0
  631990.6952  0.0297 -3.7954 3 1063.0470189  71510 303941084      931183        syn-C2H3C(O)NH2, v=0
  631990.6952  0.0297 -3.7954 3 1063.0470189  71510 303941184      931083        syn-C2H3C(O)NH2, v=0
  632048.7884  0.0182 -3.9426 3  976.6723171  71510 303851967      841866        syn-C2H3C(O)NH2, v=0
  632115.7250  0.0193 -5.7670 3  978.2329167  71510 303832459      822458        syn-C2H3C(O)NH2, v=0
  632118.7916  0.0284 -3.8087 3 1057.1556187  71510 303931182      921281        syn-C2H3C(O)NH2, v=0
  632118.7916  0.0284 -3.8087 3 1057.1556187  71510 303931282      921181        syn-C2H3C(O)NH2, v=0
  632143.8654  0.1358 -5.3536 3 1561.9904235  71510 303B7 8A9      B7 7B0        syn-C2H3C(O)NH2, v=0
  632143.8654  0.1358 -5.3536 3 1561.9904235  71510 303B7 9A9      B7 8B0        syn-C2H3C(O)NH2, v=0
  632304.6601  0.0271 -3.8227 3 1050.6741185  71510 303921280      911379        syn-C2H3C(O)NH2, v=0
  632304.6601  0.0271 -3.8227 3 1050.6741185  71510 303921380      911279        syn-C2H3C(O)NH2, v=0
  632363.3516  0.0442 -4.7751 3 1409.3747175  71510 303874641      874542        syn-C2H3C(O)NH2, v=0
  632363.3516  0.0442 -4.7751 3 1409.3747175  71510 303874642      874543        syn-C2H3C(O)NH2, v=0
  632568.9934  0.0258 -3.8379 3 1043.5827183  71510 303911378      901477        syn-C2H3C(O)NH2, v=0
  632568.9936  0.0258 -5.8475 3 1043.5827183  71510 303911478      901477        syn-C2H3C(O)NH2, v=0
  632568.9937  0.0258 -5.8475 3 1043.5827183  71510 303911378      901377        syn-C2H3C(O)NH2, v=0
  632568.9938  0.0258 -3.8379 3 1043.5827183  71510 303911478      901377        syn-C2H3C(O)NH2, v=0
  632598.1046  0.0023 -4.3846 3  154.4342 69  71510 303341123      33 826        syn-C2H3C(O)NH2, v=0
  632638.4309  0.0029 -5.8206 3   82.2835 51  71510 303251016      24 519        syn-C2H3C(O)NH2, v=0
  632791.7604  0.0435 -4.7397 3 1388.1080173  71510 303864640      864541        syn-C2H3C(O)NH2, v=0
  632791.7604  0.0435 -4.7397 3 1388.1080173  71510 303864641      864542        syn-C2H3C(O)NH2, v=0
  632799.3749  0.1605 -5.7379 3 1831.0568249  71510 303C412B2      C411B3        syn-C2H3C(O)NH2, v=0
  632799.3749  0.1605 -5.7379 3 1831.0568249  71510 303C413B2      C412B3        syn-C2H3C(O)NH2, v=0
  632878.3339  0.0171 -5.7047 3  952.3812167  71510 303832163      822162        syn-C2H3C(O)NH2, v=0
  632881.3233  0.1379 -5.1570 3 1264.5959219  71510 303A9 3A6      A9 2A7        syn-C2H3C(O)NH2, v=0
  632881.3233  0.1379 -5.1570 3 1264.5959219  71510 303A9 4A6      A9 3A7        syn-C2H3C(O)NH2, v=0
  632941.3845  0.0245 -3.8548 3 1035.8566181  71510 303901476      891575        syn-C2H3C(O)NH2, v=0
  632941.3880  0.0245 -5.8372 3 1035.8566181  71510 303901576      891575        syn-C2H3C(O)NH2, v=0
  632941.3910  0.0245 -5.8372 3 1035.8566181  71510 303901476      891475        syn-C2H3C(O)NH2, v=0
  632941.3945  0.0245 -3.8548 3 1035.8566181  71510 303901576      891475        syn-C2H3C(O)NH2, v=0
  632967.4215  0.0175 -5.7247 3  964.9592169  71510 303842065      832064        syn-C2H3C(O)NH2, v=0
  633148.8986  0.0029 -4.7973 3  368.8632101  71510 303501832      501535        syn-C2H3C(O)NH2, v=0
  633195.1143  0.0822 -5.8103 3 1988.3677221  71510 303B04763      B04664        syn-C2H3C(O)NH2, v=0
  633195.1143  0.0822 -5.8103 3 1988.3677221  71510 303B04764      B04665        syn-C2H3C(O)NH2, v=0
  633206.7004  0.0429 -4.7050 3 1367.0906171  71510 303854639      854540        syn-C2H3C(O)NH2, v=0
  633206.7004  0.0429 -4.7050 3 1367.0906171  71510 303854640      854541        syn-C2H3C(O)NH2, v=0
  633328.6227  0.0022 -4.8310 3  112.3721 57  71510 303281216      27 919        syn-C2H3C(O)NH2, v=0
  633461.5591  0.0035 -5.5224 3  227.0250 81  71510 303401426      40 931        syn-C2H3C(O)NH2, v=0
  633465.8726  0.0233 -3.8740 3 1027.4635179  71510 303891574      881673        syn-C2H3C(O)NH2, v=0
  633465.9548  0.0233 -5.8252 3 1027.4635179  71510 303891674      881673        syn-C2H3C(O)NH2, v=0
  633466.0198  0.0233 -5.8252 3 1027.4635179  71510 303891574      881573        syn-C2H3C(O)NH2, v=0
  633466.1020  0.0233 -3.8740 3 1027.4635179  71510 303891674      881573        syn-C2H3C(O)NH2, v=0
  633474.4138  0.0049 -5.3075 3  264.2768 89  71510 303441331      44 836        syn-C2H3C(O)NH2, v=0
  633545.6394  0.1471 -5.4054 3 1155.8011213  71510 303A6 1A5      A6 0A6        syn-C2H3C(O)NH2, v=0
  633545.6394  0.1471 -5.4054 3 1155.8011213  71510 303A6 2A5      A6 1A6        syn-C2H3C(O)NH2, v=0
  633608.5082  0.0423 -4.6711 3 1346.3222169  71510 303844638      844539        syn-C2H3C(O)NH2, v=0
  633608.5082  0.0423 -4.6711 3 1346.3222169  71510 303844639      844540        syn-C2H3C(O)NH2, v=0
  633747.5356  0.0645 -5.1118 3  935.0951165  71510 303822161      821864        syn-C2H3C(O)NH2, v=0
  633973.1646  0.0187 -5.7421 3  969.0387167  71510 303832361      822360        syn-C2H3C(O)NH2, v=0
  633996.4535  0.0799 -5.7594 3 1961.3404219  71510 303A94762      A94663        syn-C2H3C(O)NH2, v=0
  633996.4535  0.0799 -5.7594 3 1961.3404219  71510 303A94763      A94664        syn-C2H3C(O)NH2, v=0
  633997.5123  0.0418 -4.6380 3 1325.8028167  71510 303834637      834538        syn-C2H3C(O)NH2, v=0
  633997.5123  0.0418 -4.6380 3 1325.8028167  71510 303834638      834539        syn-C2H3C(O)NH2, v=0
  634008.8525  0.1349 -5.2325 3 1445.3785229  71510 303B4 6A8      B4 5A9        syn-C2H3C(O)NH2, v=0
  634008.8525  0.1349 -5.2325 3 1445.3785229  71510 303B4 7A8      B4 6A9        syn-C2H3C(O)NH2, v=0
  634013.1748  0.1419 -5.4507 3 1634.2390239  71510 303B9 9B0      B9 8B1        syn-C2H3C(O)NH2, v=0
  634013.1748  0.1419 -5.4507 3 1634.2390239  71510 303B910B0      B9 9B1        syn-C2H3C(O)NH2, v=0
  634110.2715  0.0043 -4.7651 3  471.3954115  71510 303571938      571641        syn-C2H3C(O)NH2, v=0
  634124.7435  0.0038 -4.7176 3  515.8330121  71510 303601942      601645        syn-C2H3C(O)NH2, v=0
  634132.3923  0.0622 -5.2676 3 1096.9668177  71510 303882563      882266        syn-C2H3C(O)NH2, v=0
  634210.2216  0.0221 -3.8968 3 1018.3601177  71510 303881672      871771        syn-C2H3C(O)NH2, v=0
  634211.8467  0.0221 -5.8113 3 1018.3601177  71510 303881772      871771        syn-C2H3C(O)NH2, v=0
  634213.0516  0.0221 -5.8113 3 1018.3600177  71510 303881672      871671        syn-C2H3C(O)NH2, v=0
  634214.6766  0.0221 -3.8968 3 1018.3600177  71510 303881772      871671        syn-C2H3C(O)NH2, v=0
  634349.7863  0.0741 -4.5157 3 1122.6567181  71510 303902268      892367        syn-C2H3C(O)NH2, v=0
  634374.0343  0.0413 -4.6057 3 1305.5321165  71510 303824636      824537        syn-C2H3C(O)NH2, v=0
  634374.0343  0.0413 -4.6057 3 1305.5321165  71510 303824637      824538        syn-C2H3C(O)NH2, v=0
  634449.9357  0.0016 -2.9856 3  402.7029105  71510 303521934      511833        syn-C2H3C(O)NH2, v=0
  634462.2082  0.0016 -2.9856 3  402.7025105  71510 303521933      511834        syn-C2H3C(O)NH2, v=0
  634476.9819  0.3331 -5.5137 3 1541.2400211  71510 303A52778      A42877        syn-C2H3C(O)NH2, v=0
  634540.1552  0.0020 -5.1267 3  228.4420 77  71510 303381721      381424        syn-C2H3C(O)NH2, v=0
  634563.4223  0.0020 -5.1267 3  228.4412 77  71510 303381722      381425        syn-C2H3C(O)NH2, v=0
  634620.4734  0.0044 -4.5273 3  150.2305 69  71510 303341024      33 727        syn-C2H3C(O)NH2, v=0
  634623.3181  0.0023 -4.7587 3  119.5077 59  71510 303291218      28 919        syn-C2H3C(O)NH2, v=0
  634660.3341  0.0033 -4.4893 3  150.8236 67  71510 303331222      32 923        syn-C2H3C(O)NH2, v=0
  634738.3884  0.0409 -4.5741 3 1285.5100163  71510 303814635      814536        syn-C2H3C(O)NH2, v=0
  634738.3884  0.0409 -4.5741 3 1285.5100163  71510 303814636      814537        syn-C2H3C(O)NH2, v=0
  634775.5159  0.0777 -5.7092 3 1934.5665217  71510 303A84761      A84662        syn-C2H3C(O)NH2, v=0
  634775.5159  0.0777 -5.7092 3 1934.5665217  71510 303A84762      A84663        syn-C2H3C(O)NH2, v=0
  634797.9489  0.0052 -3.5575 3  351.7920103  71510 303511338      501239        syn-C2H3C(O)NH2, v=0
  634965.7971  0.0051 -5.0235 3  130.8676 73  71510 30336 234      35 135        syn-C2H3C(O)NH2, v=0
  634965.7990  0.0051 -5.0235 3  130.8676 73  71510 30336 334      35 035        syn-C2H3C(O)NH2, v=0
  635028.5311  0.0202 -4.0261 3  986.0727171  71510 303851966      842065        syn-C2H3C(O)NH2, v=0
  635071.6609  0.0018 -3.2241 3  456.3467115  71510 303571740      561641        syn-C2H3C(O)NH2, v=0
  635090.8822  0.0404 -4.5434 3 1265.7364161  71510 303804634      804535        syn-C2H3C(O)NH2, v=0
  635090.8822  0.0404 -4.5434 3 1265.7364161  71510 303804635      804536        syn-C2H3C(O)NH2, v=0
  635178.0787  0.0021 -3.6618 3  258.8467 89  71510 303441233      43 934        syn-C2H3C(O)NH2, v=0
  635179.7466  0.0448 -5.1423 3  978.1307167  71510 303832459      832162        syn-C2H3C(O)NH2, v=0
  635206.1044  0.0181 -5.7202 3  960.5523167  71510 303832262      822261        syn-C2H3C(O)NH2, v=0
  635264.2246  0.0209 -3.9252 3 1008.4859175  71510 303871770      861869        syn-C2H3C(O)NH2, v=0
  635290.9413  0.0209 -5.7954 3 1008.4859175  71510 303871870      861869        syn-C2H3C(O)NH2, v=0
  635309.2600  0.0209 -5.7954 3 1008.4844175  71510 303871770      861769        syn-C2H3C(O)NH2, v=0
  635335.9767  0.0209 -3.9251 3 1008.4844175  71510 303871870      861769        syn-C2H3C(O)NH2, v=0
  635374.1321  0.1385 -5.1690 3 1331.6679223  71510 303B1 4A7      B1 3A8        syn-C2H3C(O)NH2, v=0
  635374.1321  0.1385 -5.1690 3 1331.6679223  71510 303B1 5A7      B1 4A8        syn-C2H3C(O)NH2, v=0
  635431.8164  0.0401 -4.5136 3 1246.2110159  71510 303794633      794534        syn-C2H3C(O)NH2, v=0
  635431.8164  0.0401 -4.5136 3 1246.2110159  71510 303794634      794535        syn-C2H3C(O)NH2, v=0
  635532.8641  0.0755 -5.6596 3 1908.0459215  71510 303A74760      A74661        syn-C2H3C(O)NH2, v=0
  635532.8641  0.0755 -5.6596 3 1908.0459215  71510 303A74761      A74662        syn-C2H3C(O)NH2, v=0
  635729.8586  0.0029 -3.3386 3  450.1897115  71510 303571641      561542        syn-C2H3C(O)NH2, v=0
  635750.0805  0.1494 -5.5560 3 1707.7494243  71510 303C110B1      C1 9B2        syn-C2H3C(O)NH2, v=0
  635750.0805  0.1494 -5.5560 3 1707.7494243  71510 303C111B1      C110B2        syn-C2H3C(O)NH2, v=0
  635761.4856  0.0397 -4.4846 3 1226.9337157  71510 303784632      784533        syn-C2H3C(O)NH2, v=0
  635761.4856  0.0397 -4.4846 3 1226.9337157  71510 303784633      784534        syn-C2H3C(O)NH2, v=0
  635842.9229  0.0026 -2.5630 3  304.3747 61  71510 3033030 0      2929 1        syn-C2H3C(O)NH2, v=0
  635842.9229  0.0026 -2.5630 3  304.3747 61  71510 3033030 1      2929 0        syn-C2H3C(O)NH2, v=0
  635913.0607  0.0172 -5.7200 3  964.6694169  71510 303841965      831964        syn-C2H3C(O)NH2, v=0
  636080.1778  0.0394 -4.4564 3 1207.9043155  71510 303774631      774532        syn-C2H3C(O)NH2, v=0
  636080.1778  0.0394 -4.4564 3 1207.9043155  71510 303774632      774533        syn-C2H3C(O)NH2, v=0
  636136.5237  0.1386 -5.3095 3 1515.6898233  71510 303B6 7A9      B6 6B0        syn-C2H3C(O)NH2, v=0
  636136.5237  0.1386 -5.3095 3 1515.6898233  71510 303B6 8A9      B6 7B0        syn-C2H3C(O)NH2, v=0
  636268.2439  0.1460 -5.2370 3 1220.8922217  71510 303A8 2A6      A8 1A7        syn-C2H3C(O)NH2, v=0
  636268.2439  0.1460 -5.2370 3 1220.8922217  71510 303A8 3A6      A8 2A7        syn-C2H3C(O)NH2, v=0
  636269.0432  0.0735 -5.6107 3 1881.7782213  71510 303A64759      A64660        syn-C2H3C(O)NH2, v=0
  636269.0432  0.0735 -5.6107 3 1881.7782213  71510 303A64760      A64661        syn-C2H3C(O)NH2, v=0
  636282.4143  0.0733 -5.4149 3 1222.5073187  71510 303932667      932370        syn-C2H3C(O)NH2, v=0
  636282.7063  0.0022 -2.5831 3  305.7732 65  71510 3033229 3      3128 4        syn-C2H3C(O)NH2, v=0
  636282.7063  0.0022 -2.5831 3  305.7732 65  71510 3033229 4      3128 3        syn-C2H3C(O)NH2, v=0
  636289.3092  0.0201 -5.8227 3 1008.9916169  71510 303842560      832559        syn-C2H3C(O)NH2, v=0
  636364.8402  0.0094 -4.8603 3  662.4330137  71510 303682147      681850        syn-C2H3C(O)NH2, v=0
  636374.5436  0.0016 -3.0987 3  435.0296111  71510 303551838      541737        syn-C2H3C(O)NH2, v=0
  636388.1754  0.0392 -4.4292 3 1189.1227153  71510 303764630      764531        syn-C2H3C(O)NH2, v=0
  636388.1754  0.0392 -4.4292 3 1189.1227153  71510 303764631      764532        syn-C2H3C(O)NH2, v=0
  636434.0792  0.0016 -2.9161 3  385.8333101  71510 303502031      491930        syn-C2H3C(O)NH2, v=0
  636434.3000  0.0016 -2.9161 3  385.8333101  71510 303502030      491931        syn-C2H3C(O)NH2, v=0
  636493.7765  0.0199 -3.9635 3  997.7551173  71510 303861868      851967        syn-C2H3C(O)NH2, v=0
  636536.4424  0.0058 -4.7506 3  564.7012129  71510 303641748      641451        syn-C2H3C(O)NH2, v=0
  636597.6588  0.0203 -5.8223 3 1009.0068169  71510 303842559      832558        syn-C2H3C(O)NH2, v=0
  636685.7545  0.0390 -4.4029 3 1170.5888151  71510 303754629      754530        syn-C2H3C(O)NH2, v=0
  636685.7545  0.0390 -4.4029 3 1170.5888151  71510 303754630      754531        syn-C2H3C(O)NH2, v=0
  636711.4578  0.0020 -2.6054 3  308.6377 69  71510 3033428 6      3327 7        syn-C2H3C(O)NH2, v=0
  636711.4578  0.0020 -2.6054 3  308.6377 69  71510 3033428 7      3327 6        syn-C2H3C(O)NH2, v=0
  636773.8834  0.0025 -4.6886 3  126.8735 61  71510 303301219      29 920        syn-C2H3C(O)NH2, v=0
  636851.3942  0.0198 -5.7769 3  997.7551173  71510 303861968      851967        syn-C2H3C(O)NH2, v=0
  636901.7209  0.0057 -5.8113 3  193.9851 83  71510 30341 536      41 239        syn-C2H3C(O)NH2, v=0
  636902.9275  0.0057 -5.8113 3  193.9851 83  71510 30341 636      41 339        syn-C2H3C(O)NH2, v=0
  636932.7602  0.0027 -4.7932 3  368.7368101  71510 303501833      501536        syn-C2H3C(O)NH2, v=0
  636954.2153  0.0030 -4.5560 3  142.5246 65  71510 303321221      31 922        syn-C2H3C(O)NH2, v=0
  636973.1860  0.0388 -4.3776 3 1152.3023149  71510 303744628      744529        syn-C2H3C(O)NH2, v=0
  636973.1860  0.0388 -4.3776 3 1152.3023149  71510 303744629      744530        syn-C2H3C(O)NH2, v=0
  636984.5819  0.0716 -5.5624 3 1855.7633211  71510 303A54758      A54659        syn-C2H3C(O)NH2, v=0
  636984.5819  0.0716 -5.5624 3 1855.7633211  71510 303A54759      A54660        syn-C2H3C(O)NH2, v=0
  637054.3677  0.0044 -4.8439 3  402.7063111  71510 303551343      551046        syn-C2H3C(O)NH2, v=0
  637073.1179  0.0198 -5.7765 3  997.7358173  71510 303861868      851867        syn-C2H3C(O)NH2, v=0
  637119.3737  0.0018 -2.6302 3  312.9753 73  71510 3033627 9      352610        syn-C2H3C(O)NH2, v=0
  637119.3737  0.0018 -2.6302 3  312.9753 73  71510 303362710      3526 9        syn-C2H3C(O)NH2, v=0
  637121.3040  0.0020 -5.1786 3  218.9828 75  71510 303371720      371423        syn-C2H3C(O)NH2, v=0
  637132.5403  0.0020 -5.1786 3  218.9824 75  71510 303371721      371424        syn-C2H3C(O)NH2, v=0
  637144.8487  0.0016 -3.0978 3  435.0084111  71510 303551837      541738        syn-C2H3C(O)NH2, v=0
  637213.5590  0.0283 -5.0341 3  866.0594157  71510 303782355      782058        syn-C2H3C(O)NH2, v=0
  637229.6518  0.0063 -4.7497 3  629.0820135  71510 303671949      671652        syn-C2H3C(O)NH2, v=0
  637250.7348  0.0386 -4.3533 3 1134.2632147  71510 303734627      734528        syn-C2H3C(O)NH2, v=0
  637250.7348  0.0386 -4.3533 3 1134.2632147  71510 303734628      734529        syn-C2H3C(O)NH2, v=0
  637352.0263  0.1584 -5.6684 3 1782.5168247  71510 303C311B2      C310B3        syn-C2H3C(O)NH2, v=0
  637352.0263  0.1584 -5.6684 3 1782.5168247  71510 303C312B2      C311B3        syn-C2H3C(O)NH2, v=0
  637414.7975  0.0149 -5.6124 3  907.9721163  71510 303812061      802060        syn-C2H3C(O)NH2, v=0
  637430.7355  0.0197 -3.9621 3  997.7358173  71510 303861968      851867        syn-C2H3C(O)NH2, v=0
  637478.1948  0.0016 -2.8576 3  370.6882 97  71510 303482128      472027        syn-C2H3C(O)NH2, v=0
  637478.1973  0.0016 -2.8576 3  370.6882 97  71510 303482127      472028        syn-C2H3C(O)NH2, v=0
  637491.5822  0.0017 -2.6580 3  318.7950 77  71510 303382612      372513        syn-C2H3C(O)NH2, v=0
  637491.5822  0.0017 -2.6580 3  318.7950 77  71510 303382613      372512        syn-C2H3C(O)NH2, v=0
  637518.6609  0.0385 -4.3300 3 1116.4713145  71510 303724626      724527        syn-C2H3C(O)NH2, v=0
  637518.6609  0.0385 -4.3300 3 1116.4713145  71510 303724627      724528        syn-C2H3C(O)NH2, v=0
  637540.1516  0.0026 -5.6467 3   88.5795 53  71510 303261017      25 520        syn-C2H3C(O)NH2, v=0
  637626.9380  0.0027 -4.6216 3  134.5429 63  71510 303311220      30 921        syn-C2H3C(O)NH2, v=0
  637679.9931  0.0698 -5.5148 3 1830.0008209  71510 303A44757      A44658        syn-C2H3C(O)NH2, v=0
  637679.9931  0.0698 -5.5148 3 1830.0008209  71510 303A44758      A44659        syn-C2H3C(O)NH2, v=0
  637695.1606  0.0039 -5.2174 3  280.9151 91  71510 303451431      45 936        syn-C2H3C(O)NH2, v=0
  637740.2622  0.0073 -5.7534 3  211.9487 81  71510 303401129      40 634        syn-C2H3C(O)NH2, v=0
  637747.1803  0.1401 -5.2118 3 1400.0241227  71510 303B3 5A8      B3 4A9        syn-C2H3C(O)NH2, v=0
  637747.1803  0.1401 -5.2118 3 1400.0241227  71510 303B3 6A8      B3 5A9        syn-C2H3C(O)NH2, v=0
  637777.2186  0.0384 -4.3077 3 1098.9265143  71510 303714625      714526        syn-C2H3C(O)NH2, v=0
  637777.2186  0.0384 -4.3077 3 1098.9265143  71510 303714626      714527        syn-C2H3C(O)NH2, v=0
  637805.7229  0.0017 -2.6890 3  326.1083 81  71510 303402515      392416        syn-C2H3C(O)NH2, v=0
  637805.7229  0.0017 -2.6890 3  326.1083 81  71510 303402516      392415        syn-C2H3C(O)NH2, v=0
  637822.6176  0.0394 -3.7638 3 1105.1949201  71510 303A0 595      99 694        syn-C2H3C(O)NH2, v=0
  637822.6176  0.0394 -3.7638 3 1105.1949201  71510 303A0 695      99 594        syn-C2H3C(O)NH2, v=0
  637822.9790  0.0376 -3.7760 3 1102.0644199  71510 30399 693      98 792        syn-C2H3C(O)NH2, v=0
  637822.9790  0.0376 -3.7760 3 1102.0644199  71510 30399 793      98 692        syn-C2H3C(O)NH2, v=0
  637829.8850  0.0416 -3.7513 3 1107.7987203  71510 303A1 497      A0 596        syn-C2H3C(O)NH2, v=0
  637829.8850  0.0416 -3.7513 3 1107.7987203  71510 303A1 597      A0 496        syn-C2H3C(O)NH2, v=0
  637834.8284  0.0360 -3.7881 3 1098.4006197  71510 30398 791      97 890        syn-C2H3C(O)NH2, v=0
  637834.8284  0.0360 -3.7881 3 1098.4006197  71510 30398 891      97 790        syn-C2H3C(O)NH2, v=0
  637841.6843  0.0443 -3.7386 3 1109.8812205  71510 303A2 399      A1 498        syn-C2H3C(O)NH2, v=0
  637841.6843  0.0443 -3.7386 3 1109.8812205  71510 303A2 499      A1 398        syn-C2H3C(O)NH2, v=0
  637855.5053  0.0477 -3.7255 3 1111.4472207  71510 303A3 2A1      A2 3A0        syn-C2H3C(O)NH2, v=0
  637855.5053  0.0477 -3.7255 3 1111.4472207  71510 303A3 3A1      A2 2A0        syn-C2H3C(O)NH2, v=0
  637863.0276  0.0345 -3.8002 3 1094.1962195  71510 30397 889      96 988        syn-C2H3C(O)NH2, v=0
  637863.0276  0.0345 -3.8002 3 1094.1962195  71510 30397 989      96 888        syn-C2H3C(O)NH2, v=0
  637869.2944  0.0521 -3.7119 3 1112.5008209  71510 303A4 1A3      A3 2A2        syn-C2H3C(O)NH2, v=0
  637869.2944  0.0521 -3.7119 3 1112.5008209  71510 303A4 2A3      A3 1A2        syn-C2H3C(O)NH2, v=0
  637881.3578  0.0577 -3.6979 3 1113.0455211  71510 303A5 0A5      A4 1A4        syn-C2H3C(O)NH2, v=0
  637881.3578  0.0577 -3.6979 3 1113.0455211  71510 303A5 1A5      A4 0A4        syn-C2H3C(O)NH2, v=0
  637913.7791  0.0331 -3.8123 3 1089.4421193  71510 30396 987      951086        syn-C2H3C(O)NH2, v=0
  637913.7791  0.0331 -3.8123 3 1089.4421193  71510 303961087      95 986        syn-C2H3C(O)NH2, v=0
  637930.5084  0.0063 -4.7525 3  604.8250133  71510 303661849      661552        syn-C2H3C(O)NH2, v=0
  637934.0933  0.0505 -5.6115 3 1380.3908199  71510 303992772      992475        syn-C2H3C(O)NH2, v=0
  637966.3815  0.0016 -2.8071 3  357.1886 93  71510 303462224      452125        syn-C2H3C(O)NH2, v=0
  637966.3815  0.0016 -2.8071 3  357.1886 93  71510 303462225      452124        syn-C2H3C(O)NH2, v=0
  637993.0974  0.0021 -4.7564 3  119.3954 59  71510 303291217      28 920        syn-C2H3C(O)NH2, v=0
  637995.1097  0.0318 -3.8247 3 1084.1279191  71510 303951085      941184        syn-C2H3C(O)NH2, v=0
  637995.1097  0.0318 -3.8247 3 1084.1279191  71510 303951185      941084        syn-C2H3C(O)NH2, v=0
  638026.6576  0.0383 -4.2866 3 1081.6285141  71510 303704624      704525        syn-C2H3C(O)NH2, v=0
  638026.6576  0.0383 -4.2866 3 1081.6285141  71510 303704625      704526        syn-C2H3C(O)NH2, v=0
  638028.1757  0.0017 -2.7238 3  334.9306 85  71510 303422418      412319        syn-C2H3C(O)NH2, v=0
  638028.1757  0.0017 -2.7238 3  334.9306 85  71510 303422419      412318        syn-C2H3C(O)NH2, v=0
  638035.8979  0.0060 -3.5601 3  604.8214133  71510 303661849      651748        syn-C2H3C(O)NH2, v=0
  638107.9619  0.0016 -2.7629 3  345.2817 89  71510 303442321      432222        syn-C2H3C(O)NH2, v=0
  638107.9619  0.0016 -2.7629 3  345.2817 89  71510 303442322      432221        syn-C2H3C(O)NH2, v=0
  638117.5843  0.0304 -3.8376 3 1078.2408189  71510 303941183      931282        syn-C2H3C(O)NH2, v=0
  638117.5843  0.0304 -3.8376 3 1078.2408189  71510 303941283      931182        syn-C2H3C(O)NH2, v=0
  638137.5980  0.1436 -5.3983 3 1587.2718237  71510 303B8 8B0      B8 7B1        syn-C2H3C(O)NH2, v=0
  638137.5980  0.1436 -5.3983 3 1587.2718237  71510 303B8 9B0      B8 8B1        syn-C2H3C(O)NH2, v=0
  638182.8237  0.0162 -4.9401 3  760.8106147  71510 303732251      731954        syn-C2H3C(O)NH2, v=0
  638267.2222  0.0382 -4.2666 3 1064.5774139  71510 303694623      694524        syn-C2H3C(O)NH2, v=0
  638267.2222  0.0382 -4.2666 3 1064.5774139  71510 303694624      694525        syn-C2H3C(O)NH2, v=0
  638295.3904  0.0291 -3.8511 3 1071.7655187  71510 303931281      921380        syn-C2H3C(O)NH2, v=0
  638295.3904  0.0291 -3.8511 3 1071.7655187  71510 303931381      921280        syn-C2H3C(O)NH2, v=0
  638355.7750  0.0680 -5.4678 3 1804.4907207  71510 303A34756      A34657        syn-C2H3C(O)NH2, v=0
  638355.7750  0.0680 -5.4678 3 1804.4907207  71510 303A34757      A34658        syn-C2H3C(O)NH2, v=0
  638427.0112  0.0025 -5.6337 3   74.9627 43  71510 3032113 9      201010        syn-C2H3C(O)NH2, v=0
  638427.4614  0.0025 -5.6337 3   74.9627 43  71510 3032113 8      201011        syn-C2H3C(O)NH2, v=0
  638499.1522  0.0382 -4.2478 3 1047.7729137  71510 303684622      684523        syn-C2H3C(O)NH2, v=0
  638499.1522  0.0382 -4.2478 3 1047.7729137  71510 303684623      684524        syn-C2H3C(O)NH2, v=0
  638548.0540  0.0277 -3.8657 3 1064.6830185  71510 303921379      911478        syn-C2H3C(O)NH2, v=0
  638548.0542  0.0277 -3.8657 3 1064.6830185  71510 303921479      911378        syn-C2H3C(O)NH2, v=0
  638603.2707  0.0280 -4.1536 3 1016.3571173  71510 303862066      852165        syn-C2H3C(O)NH2, v=0
  638722.6824  0.0382 -4.2303 3 1031.2148135  71510 303674621      674522        syn-C2H3C(O)NH2, v=0
  638722.6824  0.0382 -4.2303 3 1031.2148135  71510 303674622      674523        syn-C2H3C(O)NH2, v=0
  638770.4784  0.0189 -5.7557 3  986.0727171  71510 303852066      842065        syn-C2H3C(O)NH2, v=0
  638816.2817  0.1690 -5.7871 3 1858.5365251  71510 303C512B3      C511B4        syn-C2H3C(O)NH2, v=0
  638816.2817  0.1690 -5.7871 3 1858.5365251  71510 303C513B3      C512B4        syn-C2H3C(O)NH2, v=0
  638875.2864  0.1458 -5.1963 3 1287.2764221  71510 303B0 3A7      B0 2A8        syn-C2H3C(O)NH2, v=0
  638875.2864  0.1458 -5.1963 3 1287.2764221  71510 303B0 4A7      B0 3A8        syn-C2H3C(O)NH2, v=0
  638903.2833  0.0264 -3.8818 3 1056.9693183  71510 303911477      901576        syn-C2H3C(O)NH2, v=0
  638903.2887  0.0264 -3.8818 3 1056.9693183  71510 303911577      901476        syn-C2H3C(O)NH2, v=0
  638938.0432  0.0383 -4.2142 3 1014.9032133  71510 303664620      664521        syn-C2H3C(O)NH2, v=0
  638938.0432  0.0383 -4.2142 3 1014.9032133  71510 303664621      664522        syn-C2H3C(O)NH2, v=0
  639012.4113  0.0663 -5.4215 3 1779.2325205  71510 303A24755      A24656        syn-C2H3C(O)NH2, v=0
  639012.4113  0.0663 -5.4215 3 1779.2325205  71510 303A24756      A24657        syn-C2H3C(O)NH2, v=0
  639145.4604  0.0383 -4.1995 3  998.8378131  71510 303654619      654520        syn-C2H3C(O)NH2, v=0
  639145.4604  0.0383 -4.1995 3  998.8378131  71510 303654620      654521        syn-C2H3C(O)NH2, v=0
  639180.5748  0.0042 -4.9104 3  369.1492107  71510 303531142      53 845        syn-C2H3C(O)NH2, v=0
  639267.2814  0.0037 -4.7266 3  500.5754119  71510 303591941      591644        syn-C2H3C(O)NH2, v=0
  639269.4781  0.0216 -5.7355 3  969.3817167  71510 303832360      822359        syn-C2H3C(O)NH2, v=0
  639345.1553  0.0384 -4.1864 3  983.0186129  71510 303644618      644519        syn-C2H3C(O)NH2, v=0
  639345.1553  0.0384 -4.1864 3  983.0186129  71510 303644619      644520        syn-C2H3C(O)NH2, v=0
  639348.2139  0.2676 -5.3075 3 1452.2898205  71510 303A22676      A12775        syn-C2H3C(O)NH2, v=0
  639387.4939  0.0184 -5.7345 3  973.4918169  71510 303842164      832163        syn-C2H3C(O)NH2, v=0
  639401.9341  0.0250 -3.9002 3 1048.5936181  71510 303901575      891674        syn-C2H3C(O)NH2, v=0
  639402.0621  0.0250 -3.9002 3 1048.5936181  71510 303901675      891574        syn-C2H3C(O)NH2, v=0
  639468.6459  0.0020 -5.2338 3  209.7863 73  71510 303361719      361422        syn-C2H3C(O)NH2, v=0
  639473.9267  0.0020 -5.2338 3  209.7861 73  71510 303361720      361423        syn-C2H3C(O)NH2, v=0
  639490.1137  0.0204 -5.7947 3  999.2194169  71510 303842461      832460        syn-C2H3C(O)NH2, v=0
  639537.3451  0.0385 -4.1749 3  967.4453127  71510 303634617      634518        syn-C2H3C(O)NH2, v=0
  639537.3451  0.0385 -4.1749 3  967.4453127  71510 303634618      634519        syn-C2H3C(O)NH2, v=0
  639540.8399  0.0031 -3.7106 3  237.5139 87  71510 30343 934      42 835        syn-C2H3C(O)NH2, v=0
  639547.3127  0.1552 -5.4426 3 1177.4798215  71510 303A7 1A6      A7 0A7        syn-C2H3C(O)NH2, v=0
  639547.3127  0.1552 -5.4426 3 1177.4798215  71510 303A7 2A6      A7 1A7        syn-C2H3C(O)NH2, v=0
  639605.2848  0.0188 -5.6213 3  913.2658163  71510 303812160      802159        syn-C2H3C(O)NH2, v=0
  639645.0485  0.0790 -5.6484 3 1406.1969201  71510 303A02773      A02476        syn-C2H3C(O)NH2, v=0
  639650.3722  0.0647 -5.3758 3 1754.2263203  71510 303A14754      A14655        syn-C2H3C(O)NH2, v=0
  639650.3722  0.0647 -5.3758 3 1754.2263203  71510 303A14755      A14656        syn-C2H3C(O)NH2, v=0
  639655.7596  0.0054 -4.7636 3  525.7401125  71510 303621647      621350        syn-C2H3C(O)NH2, v=0
  639722.2425  0.0386 -4.1651 3  952.1179125  71510 303624616      624517        syn-C2H3C(O)NH2, v=0
  639722.2425  0.0386 -4.1651 3  952.1179125  71510 303624617      624518        syn-C2H3C(O)NH2, v=0
  639740.7233  0.0106 -3.7708 3  736.7485147  71510 303731955      721854        syn-C2H3C(O)NH2, v=0
  639890.0771  0.0045 -4.5754 3  145.3040 75  71510 30337 334      36 235        syn-C2H3C(O)NH2, v=0
  639890.1103  0.0045 -4.5754 3  145.3040 75  71510 30337 434      36 135        syn-C2H3C(O)NH2, v=0
  639900.0562  0.0387 -4.1574 3  937.0363123  71510 303614615      614516        syn-C2H3C(O)NH2, v=0
  639900.0562  0.0387 -4.1574 3  937.0363123  71510 303614616      614517        syn-C2H3C(O)NH2, v=0
  639966.0818  0.0216 -5.6768 3  940.6445165  71510 303822260      812259        syn-C2H3C(O)NH2, v=0
  639980.0055  0.0155 -3.9682 3  922.6944165  71510 303822063      811962        syn-C2H3C(O)NH2, v=0
  639998.6789  0.1427 -5.2751 3 1469.6602231  71510 303B5 6A9      B5 5B0        syn-C2H3C(O)NH2, v=0
  639998.6789  0.1427 -5.2751 3 1469.6602231  71510 303B5 7A9      B5 6B0        syn-C2H3C(O)NH2, v=0
  640009.8820  0.1499 -5.4967 3 1660.1201241  71510 303C0 9B1      C0 8B2        syn-C2H3C(O)NH2, v=0
  640009.8820  0.1499 -5.4967 3 1660.1201241  71510 303C010B1      C0 9B2        syn-C2H3C(O)NH2, v=0
  640016.8999  0.0160 -3.9818 3  943.6105167  71510 303832064      821963        syn-C2H3C(O)NH2, v=0
  640070.9907  0.0389 -4.1517 3  922.2003121  71510 303604614      604515        syn-C2H3C(O)NH2, v=0
  640070.9907  0.0389 -4.1517 3  922.2003121  71510 303604615      604516        syn-C2H3C(O)NH2, v=0
  640072.1272  0.0027 -4.8204 3  356.1770 99  71510 303491831      491534        syn-C2H3C(O)NH2, v=0
  640106.6073  0.0238 -3.9218 3 1039.5151179  71510 303891673      881772        syn-C2H3C(O)NH2, v=0
  640109.1611  0.0238 -3.9218 3 1039.5151179  71510 303891773      881672        syn-C2H3C(O)NH2, v=0
  640235.2467  0.0390 -4.1484 3  907.6098119  71510 303594613      594514        syn-C2H3C(O)NH2, v=0
  640235.2467  0.0390 -4.1484 3  907.6098119  71510 303594614      594515        syn-C2H3C(O)NH2, v=0
  640270.1147  0.0632 -5.3308 3 1729.4716201  71510 303A04753      A04654        syn-C2H3C(O)NH2, v=0
  640270.1147  0.0632 -5.3308 3 1729.4716201  71510 303A04754      A04655        syn-C2H3C(O)NH2, v=0
  640365.8372  0.1087 -4.7032 3 1201.1470187  71510 303932370      922469        syn-C2H3C(O)NH2, v=0
  640393.0208  0.0392 -4.1478 3  893.2647117  71510 303584612      584513        syn-C2H3C(O)NH2, v=0
  640393.0208  0.0392 -4.1478 3  893.2647117  71510 303584613      584514        syn-C2H3C(O)NH2, v=0
  640461.3832  0.0043 -5.3987 3   98.0319 57  71510 30328 920      27 423        syn-C2H3C(O)NH2, v=0
  640544.5056  0.0394 -4.1502 3  879.1649115  71510 303574611      574512        syn-C2H3C(O)NH2, v=0
  640544.5056  0.0394 -4.1502 3  879.1649115  71510 303574612      574513        syn-C2H3C(O)NH2, v=0
  640689.8901  0.0396 -4.1560 3  865.3103113  71510 303564610      564511        syn-C2H3C(O)NH2, v=0
  640689.8901  0.0396 -4.1560 3  865.3103113  71510 303564611      564512        syn-C2H3C(O)NH2, v=0
  640769.9392  0.0186 -5.7525 3  985.8812171  71510 303851966      841965        syn-C2H3C(O)NH2, v=0
  640829.3595  0.0399 -4.1659 3  851.7007111  71510 3035546 9      554510        syn-C2H3C(O)NH2, v=0
  640829.3595  0.0399 -4.1659 3  851.7007111  71510 303554610      554511        syn-C2H3C(O)NH2, v=0
  640868.4654  0.0056 -4.8363 3  451.3596117  71510 303581345      581048        syn-C2H3C(O)NH2, v=0
  640872.0835  0.0618 -5.2865 3 1704.9684199  71510 303994752      994653        syn-C2H3C(O)NH2, v=0
  640872.0835  0.0618 -5.2865 3 1704.9684199  71510 303994753      994654        syn-C2H3C(O)NH2, v=0
  640962.7609  0.0016 -3.0068 3  415.6892107  71510 303531935      521834        syn-C2H3C(O)NH2, v=0
  640963.0951  0.0401 -4.1805 3  838.3361109  71510 3035446 8      5445 9        syn-C2H3C(O)NH2, v=0
  640963.0951  0.0401 -4.1805 3  838.3361109  71510 3035446 9      544510        syn-C2H3C(O)NH2, v=0
  640986.8113  0.0016 -3.0067 3  415.6886107  71510 303531934      521835        syn-C2H3C(O)NH2, v=0
  641091.2748  0.0404 -4.2009 3  825.2164107  71510 3035346 7      5345 8        syn-C2H3C(O)NH2, v=0
  641091.2748  0.0404 -4.2009 3  825.2164107  71510 3035346 8      5345 9        syn-C2H3C(O)NH2, v=0
  641106.6466  0.0225 -3.9484 3 1029.6769177  71510 303881771      871870        syn-C2H3C(O)NH2, v=0
  641122.4015  0.0225 -5.8266 3 1029.6769177  71510 303881871      871870        syn-C2H3C(O)NH2, v=0
  641133.3634  0.0225 -5.8266 3 1029.6760177  71510 303881771      871770        syn-C2H3C(O)NH2, v=0
  641149.1182  0.0225 -3.9484 3 1029.6760177  71510 303881871      871770        syn-C2H3C(O)NH2, v=0
  641214.0728  0.0406 -4.2286 3  812.3415105  71510 3035246 6      5245 7        syn-C2H3C(O)NH2, v=0
  641214.0728  0.0406 -4.2286 3  812.3415105  71510 3035246 7      5245 8        syn-C2H3C(O)NH2, v=0
  641242.0871  0.0216 -5.7926 3  999.3181169  71510 303842460      832459        syn-C2H3C(O)NH2, v=0
  641259.8827  0.0478 -5.0571 3  865.5117159  71510 303792059      791762        syn-C2H3C(O)NH2, v=0
  641331.6595  0.0409 -4.2656 3  799.7111103  71510 3035146 5      5145 6        syn-C2H3C(O)NH2, v=0
  641331.6595  0.0409 -4.2656 3  799.7111103  71510 3035146 6      5145 7        syn-C2H3C(O)NH2, v=0
  641365.2036  0.1464 -5.2096 3 1354.9491225  71510 303B2 4A8      B2 3A9        syn-C2H3C(O)NH2, v=0
  641365.2036  0.1464 -5.2096 3 1354.9491225  71510 303B2 5A8      B2 4A9        syn-C2H3C(O)NH2, v=0
  641421.7183  0.0049 -5.5558 3  220.0084 87  71510 30343 637      43 340        syn-C2H3C(O)NH2, v=0
  641427.4281  0.0049 -5.5558 3  220.0084 87  71510 30343 737      43 440        syn-C2H3C(O)NH2, v=0
  641444.2020  0.0412 -4.3153 3  787.3254101  71510 3035046 4      5045 5        syn-C2H3C(O)NH2, v=0
  641444.2020  0.0412 -4.3153 3  787.3254101  71510 3035046 5      5045 6        syn-C2H3C(O)NH2, v=0
  641456.7113  0.0604 -5.2428 3 1680.7163197  71510 303984751      984652        syn-C2H3C(O)NH2, v=0
  641456.7113  0.0604 -5.2428 3 1680.7163197  71510 303984752      984653        syn-C2H3C(O)NH2, v=0
  641551.8638  0.0415 -4.3830 3  775.1841 99  71510 3034946 3      4945 4        syn-C2H3C(O)NH2, v=0
  641551.8638  0.0415 -4.3830 3  775.1841 99  71510 3034946 4      4945 5        syn-C2H3C(O)NH2, v=0
  641603.1864  0.0020 -5.2926 3  200.8511 71  71510 303351718      351421        syn-C2H3C(O)NH2, v=0
  641605.5989  0.0020 -5.2926 3  200.8510 71  71510 303351719      351422        syn-C2H3C(O)NH2, v=0
  641654.4687  0.0169 -3.9965 3  964.6694169  71510 303842065      831964        syn-C2H3C(O)NH2, v=0
  641654.8051  0.0418 -4.4792 3  763.2872 97  71510 3034846 2      4845 3        syn-C2H3C(O)NH2, v=0
  641654.8051  0.0418 -4.4792 3  763.2872 97  71510 3034846 3      4845 4        syn-C2H3C(O)NH2, v=0
  641751.0397  0.1577 -5.6032 3 1734.2300245  71510 303C210B2      C2 9B3        syn-C2H3C(O)NH2, v=0
  641751.0397  0.1577 -5.6032 3 1734.2300245  71510 303C211B2      C210B3        syn-C2H3C(O)NH2, v=0
  641753.1825  0.0421 -4.6269 3  751.6345 95  71510 3034746 1      4745 2        syn-C2H3C(O)NH2, v=0
  641753.1825  0.0421 -4.6269 3  751.6345 95  71510 3034746 2      4745 3        syn-C2H3C(O)NH2, v=0
  641832.3344  0.0040 -4.9076 3  369.1493107  71510 303531242      53 945        syn-C2H3C(O)NH2, v=0
  641847.1492  0.0424 -4.8998 3  740.2260 93  71510 3034646 0      4645 1        syn-C2H3C(O)NH2, v=0
  641847.1492  0.0424 -4.8998 3  740.2260 93  71510 3034646 1      4645 2        syn-C2H3C(O)NH2, v=0
  641931.8008  0.0156 -3.9552 3  901.9121163  71510 303812062      801961        syn-C2H3C(O)NH2, v=0
  641933.2278  0.0017 -3.1266 3  448.9085113  71510 303561839      551738        syn-C2H3C(O)NH2, v=0
  642024.4197  0.0591 -5.1999 3 1656.7153195  71510 303974750      974651        syn-C2H3C(O)NH2, v=0
  642024.4197  0.0591 -5.1999 3 1656.7153195  71510 303974751      974652        syn-C2H3C(O)NH2, v=0
  642111.5085  0.0212 -4.0384 3 1007.3798173  71510 303861967      852066        syn-C2H3C(O)NH2, v=0
  642126.7308  0.1466 -5.3534 3 1540.5714235  71510 303B7 7B0      B7 6B1        syn-C2H3C(O)NH2, v=0
  642126.7308  0.1466 -5.3534 3 1540.5714235  71510 303B7 8B0      B7 7B1        syn-C2H3C(O)NH2, v=0
  642146.1333  0.0038 -5.6526 3  216.7457 79  71510 303391425      39 930        syn-C2H3C(O)NH2, v=0
  642221.7452  0.0156 -5.6459 3  929.2340165  71510 303822062      812061        syn-C2H3C(O)NH2, v=0
  642224.7121  0.0451 -4.3176 3 1068.9099177  71510 303882167      872266        syn-C2H3C(O)NH2, v=0
  642249.7231  0.0204 -5.7692 3  990.1857169  71510 303842362      832361        syn-C2H3C(O)NH2, v=0
  642265.0724  0.1542 -5.2755 3 1243.1723219  71510 303A9 2A7      A9 1A8        syn-C2H3C(O)NH2, v=0
  642265.0724  0.1542 -5.2755 3 1243.1723219  71510 303A9 3A7      A9 2A8        syn-C2H3C(O)NH2, v=0
  642333.6604  0.0026 -4.8179 3  356.1014 99  71510 303491832      491535        syn-C2H3C(O)NH2, v=0
  642375.8470  0.0214 -3.9837 3 1018.9982175  71510 303871869      861968        syn-C2H3C(O)NH2, v=0
  642411.9288  0.2066 -5.1020 3 1365.9599199  71510 303992574      982673        syn-C2H3C(O)NH2, v=0
  642546.0567  0.0021 -4.6856 3  126.6813 61  71510 303301218      29 921        syn-C2H3C(O)NH2, v=0
  642575.6189  0.0579 -5.1575 3 1632.9651193  71510 303964749      964650        syn-C2H3C(O)NH2, v=0
  642575.6189  0.0579 -5.1575 3 1632.9651193  71510 303964750      964651        syn-C2H3C(O)NH2, v=0
  642594.8566  0.0214 -5.8083 3 1018.9982175  71510 303871969      861968        syn-C2H3C(O)NH2, v=0
  642695.8922  0.0086 -5.6166 3  100.2253 59  71510 30329 722      28 425        syn-C2H3C(O)NH2, v=0
  642712.4875  0.0195 -5.7486 3  981.7405169  71510 303842263      832262        syn-C2H3C(O)NH2, v=0
  642733.4647  0.0213 -5.8081 3 1018.9863175  71510 303871869      861868        syn-C2H3C(O)NH2, v=0
  642939.2963  0.1530 -4.8996 3 1282.2469193  71510 303962472      952571        syn-C2H3C(O)NH2, v=0
  642952.4743  0.0213 -3.9829 3 1018.9863175  71510 303871969      861868        syn-C2H3C(O)NH2, v=0
  642995.3491  0.1533 -5.4825 3 1263.1913191  71510 303952570      952273        syn-C2H3C(O)NH2, v=0
  643110.0956  0.0026 -2.5697 3  311.6706 63  71510 3033130 1      3029 2        syn-C2H3C(O)NH2, v=0
  643110.0956  0.0026 -2.5697 3  311.6706 63  71510 3033130 2      3029 1        syn-C2H3C(O)NH2, v=0
  643110.7091  0.0567 -5.1159 3 1609.4655191  71510 303954748      954649        syn-C2H3C(O)NH2, v=0
  643110.7091  0.0567 -5.1159 3 1609.4655191  71510 303954749      954650        syn-C2H3C(O)NH2, v=0
  643226.2144  0.0016 -2.9343 3  398.2488103  71510 303512032      501931        syn-C2H3C(O)NH2, v=0
  643226.6890  0.0016 -2.9343 3  398.2488103  71510 303512031      501932        syn-C2H3C(O)NH2, v=0
  643281.0234  0.0016 -3.1250 3  448.8717113  71510 303561838      551739        syn-C2H3C(O)NH2, v=0
  643358.5807  0.1669 -5.7168 3 1809.5967249  71510 303C411B3      C410B4        syn-C2H3C(O)NH2, v=0
  643358.5807  0.1669 -5.7168 3 1809.5967249  71510 303C412B3      C411B4        syn-C2H3C(O)NH2, v=0
  643404.4491  0.0020 -3.2618 3  470.8262117  71510 303581741      571642        syn-C2H3C(O)NH2, v=0
  643533.8734  0.1543 -5.5837 3 1346.3997197  71510 303982672      982375        syn-C2H3C(O)NH2, v=0
  643543.1220  0.0021 -5.3554 3  192.1759 69  71510 303341717      341420        syn-C2H3C(O)NH2, v=0
  643544.1919  0.0021 -5.3554 3  192.1758 69  71510 303341718      341421        syn-C2H3C(O)NH2, v=0
  643547.3334  0.0022 -2.5903 3  313.5619 67  71510 3033329 4      3228 5        syn-C2H3C(O)NH2, v=0
  643547.3334  0.0022 -2.5903 3  313.5619 67  71510 3033329 5      3228 4        syn-C2H3C(O)NH2, v=0
  643593.4685  0.0049 -3.6119 3  321.4369 99  71510 303491237      481138        syn-C2H3C(O)NH2, v=0
  643630.0800  0.0556 -5.0750 3 1586.2163189  71510 303944747      944648        syn-C2H3C(O)NH2, v=0
  643630.0800  0.0556 -5.0750 3 1586.2163189  71510 303944748      944649        syn-C2H3C(O)NH2, v=0
  643735.3994  0.0026 -3.6584 3  253.6105 89  71510 303441134      43 835        syn-C2H3C(O)NH2, v=0
  643736.3422  0.1481 -5.2536 3 1423.9058229  71510 303B4 5A9      B4 4B0        syn-C2H3C(O)NH2, v=0
  643736.3422  0.1481 -5.2536 3 1423.9058229  71510 303B4 6A9      B4 5B0        syn-C2H3C(O)NH2, v=0
  643791.2208  0.0695 -5.5901 3 1354.6973197  71510 303982771      982474        syn-C2H3C(O)NH2, v=0
  643836.4790  0.0402 -3.8071 3 1123.3398201  71510 303A0 694      99 793        syn-C2H3C(O)NH2, v=0
  643836.4790  0.0402 -3.8071 3 1123.3398201  71510 303A0 794      99 693        syn-C2H3C(O)NH2, v=0
  643836.9663  0.0421 -3.7951 3 1126.4704203  71510 303A1 596      A0 695        syn-C2H3C(O)NH2, v=0
  643836.9663  0.0421 -3.7951 3 1126.4704203  71510 303A1 696      A0 595        syn-C2H3C(O)NH2, v=0
  643844.7834  0.0444 -3.7829 3 1129.0744205  71510 303A2 498      A1 597        syn-C2H3C(O)NH2, v=0
  643844.7834  0.0444 -3.7829 3 1129.0744205  71510 303A2 598      A1 497        syn-C2H3C(O)NH2, v=0
  643847.0642  0.0385 -3.8190 3 1119.6765199  71510 30399 792      98 891        syn-C2H3C(O)NH2, v=0
  643847.0642  0.0385 -3.8190 3 1119.6765199  71510 30399 892      98 791        syn-C2H3C(O)NH2, v=0
  643856.9182  0.0473 -3.7703 3 1131.1573207  71510 303A3 3A0      A2 499        syn-C2H3C(O)NH2, v=0
  643856.9182  0.0473 -3.7703 3 1131.1573207  71510 303A3 4A0      A2 399        syn-C2H3C(O)NH2, v=0
  643870.9222  0.0509 -3.7574 3 1132.7238209  71510 303A4 2A2      A3 3A1        syn-C2H3C(O)NH2, v=0
  643870.9222  0.0509 -3.7574 3 1132.7238209  71510 303A4 3A2      A3 2A1        syn-C2H3C(O)NH2, v=0
  643873.4220  0.0369 -3.8308 3 1115.4730197  71510 30398 890      97 989        syn-C2H3C(O)NH2, v=0
  643873.4220  0.0369 -3.8308 3 1115.4730197  71510 30398 990      97 889        syn-C2H3C(O)NH2, v=0
  643884.7875  0.0555 -3.7440 3 1133.7779211  71510 303A5 1A4      A4 2A3        syn-C2H3C(O)NH2, v=0
  643884.7875  0.0555 -3.7440 3 1133.7779211  71510 303A5 2A4      A4 1A3        syn-C2H3C(O)NH2, v=0
  643896.8530  0.0614 -3.7301 3 1134.3230213  71510 303A6 0A6      A5 1A5        syn-C2H3C(O)NH2, v=0
  643896.8530  0.0614 -3.7301 3 1134.3230213  71510 303A6 1A6      A5 0A5        syn-C2H3C(O)NH2, v=0
  643921.5279  0.0354 -3.8426 3 1110.7206195  71510 30397 988      961087        syn-C2H3C(O)NH2, v=0
  643921.5279  0.0354 -3.8426 3 1110.7206195  71510 303971088      96 987        syn-C2H3C(O)NH2, v=0
  643952.0131  0.0040 -4.3046 3  160.0315 77  71510 30338 434      37 335        syn-C2H3C(O)NH2, v=0
  643952.4400  0.0040 -4.3046 3  160.0315 77  71510 30338 534      37 235        syn-C2H3C(O)NH2, v=0
  643970.9589  0.0019 -2.6132 3  316.9213 71  71510 3033528 7      3427 8        syn-C2H3C(O)NH2, v=0
  643970.9589  0.0019 -2.6132 3  316.9213 71  71510 3033528 8      3427 7        syn-C2H3C(O)NH2, v=0
  643999.0855  0.0340 -3.8546 3 1105.4091193  71510 303961086      951185        syn-C2H3C(O)NH2, v=0
  643999.0855  0.0340 -3.8546 3 1105.4091193  71510 303961186      951085        syn-C2H3C(O)NH2, v=0
  644116.1894  0.0326 -3.8671 3 1099.5261191  71510 303951184      941283        syn-C2H3C(O)NH2, v=0
  644116.1894  0.0326 -3.8671 3 1099.5261191  71510 303951284      941183        syn-C2H3C(O)NH2, v=0
  644126.5921  0.0038 -4.9880 3  336.8199103  71510 303511041      51 744        syn-C2H3C(O)NH2, v=0
  644129.3215  0.1517 -5.4435 3 1612.7532239  71510 303B9 8B1      B9 7B2        syn-C2H3C(O)NH2, v=0
  644129.3215  0.1517 -5.4435 3 1612.7532239  71510 303B9 9B1      B9 8B2        syn-C2H3C(O)NH2, v=0
  644134.1121  0.0546 -5.0348 3 1563.2173187  71510 303934746      934647        syn-C2H3C(O)NH2, v=0
  644134.1121  0.0546 -5.0348 3 1563.2173187  71510 303934747      934648        syn-C2H3C(O)NH2, v=0
  644286.3270  0.0311 -3.8801 3 1093.0568189  71510 303941282      931381        syn-C2H3C(O)NH2, v=0
  644286.3271  0.0311 -3.8801 3 1093.0568189  71510 303941382      931281        syn-C2H3C(O)NH2, v=0
  644370.0495  0.0018 -2.6388 3  321.7562 75  71510 303372710      362611        syn-C2H3C(O)NH2, v=0
  644370.0495  0.0018 -2.6388 3  321.7562 75  71510 303372711      362610        syn-C2H3C(O)NH2, v=0
  644435.9266  0.0016 -2.8737 3  382.5550 99  71510 303492129      482028        syn-C2H3C(O)NH2, v=0
  644435.9326  0.0016 -2.8737 3  382.5550 99  71510 303492128      482029        syn-C2H3C(O)NH2, v=0
  644511.8865  0.0182 -4.0124 3  985.8812171  71510 303852066      841965        syn-C2H3C(O)NH2, v=0
  644520.5980  0.0204 -5.7873 3 1007.3798173  71510 303862067      852066        syn-C2H3C(O)NH2, v=0
  644527.9484  0.0297 -3.8942 3 1085.9826187  71510 303931380      921479        syn-C2H3C(O)NH2, v=0
  644527.9485  0.0297 -3.8942 3 1085.9826187  71510 303931480      921379        syn-C2H3C(O)NH2, v=0
  644606.0805  0.0042 -5.3611 3  247.3138 91  71510 30345 738      45 441        syn-C2H3C(O)NH2, v=0
  644623.1763  0.0536 -4.9952 3 1540.4684185  71510 303924745      924646        syn-C2H3C(O)NH2, v=0
  644623.1763  0.0536 -4.9952 3 1540.4684185  71510 303924746      924647        syn-C2H3C(O)NH2, v=0
  644629.9123  0.0042 -5.3611 3  247.3138 91  71510 30345 838      45 541        syn-C2H3C(O)NH2, v=0
  644643.3211  0.0079 -5.2324 3  118.3943 63  71510 30331 823      30 526        syn-C2H3C(O)NH2, v=0
  644728.1732  0.0017 -2.6675 3  328.0763 79  71510 303392613      382514        syn-C2H3C(O)NH2, v=0
  644728.1732  0.0017 -2.6675 3  328.0763 79  71510 303392614      382513        syn-C2H3C(O)NH2, v=0
  644867.0410  0.0283 -3.9096 3 1078.2808185  71510 303921478      911577        syn-C2H3C(O)NH2, v=0
  644867.0439  0.0283 -3.9096 3 1078.2808185  71510 303921578      911477        syn-C2H3C(O)NH2, v=0
  644868.1647  0.1540 -5.2361 3 1310.1574223  71510 303B1 3A8      B1 2A9        syn-C2H3C(O)NH2, v=0
  644868.1647  0.1540 -5.2361 3 1310.1574223  71510 303B1 4A8      B1 3A9        syn-C2H3C(O)NH2, v=0
  644904.2715  0.0024 -5.5148 3   80.1355 45  71510 303221310      211011        syn-C2H3C(O)NH2, v=0
  644905.5144  0.0024 -5.5148 3   80.1354 45  71510 3032213 9      211012        syn-C2H3C(O)NH2, v=0
  644953.4896  0.0026 -5.5077 3   95.0534 55  71510 303271018      26 521        syn-C2H3C(O)NH2, v=0
  645015.3286  0.0036 -4.7375 3  485.5710117  71510 303581940      581643        syn-C2H3C(O)NH2, v=0
  645020.7580  0.0017 -2.6995 3  335.8939 83  71510 303412516      402417        syn-C2H3C(O)NH2, v=0
  645020.7580  0.0017 -2.6995 3  335.8939 83  71510 303412517      402416        syn-C2H3C(O)NH2, v=0
  645030.6377  0.0016 -2.8215 3  368.5215 95  71510 303472225      462126        syn-C2H3C(O)NH2, v=0
  645030.6377  0.0016 -2.8215 3  368.5215 95  71510 303472226      462125        syn-C2H3C(O)NH2, v=0
  645062.9430  0.0037 -4.9870 3  336.8200103  71510 303511141      51 844        syn-C2H3C(O)NH2, v=0
  645097.6349  0.0527 -4.9564 3 1517.9693183  71510 303914744      914645        syn-C2H3C(O)NH2, v=0
  645097.6349  0.0527 -4.9564 3 1517.9693183  71510 303914745      914646        syn-C2H3C(O)NH2, v=0
  645210.9724  0.0017 -2.7354 3  345.2252 87  71510 303432419      422320        syn-C2H3C(O)NH2, v=0
  645210.9724  0.0017 -2.7354 3  345.2252 87  71510 303432420      422319        syn-C2H3C(O)NH2, v=0
  645243.0201  0.0016 -2.7758 3  356.0915 91  71510 303452322      442223        syn-C2H3C(O)NH2, v=0
  645243.0201  0.0016 -2.7758 3  356.0915 91  71510 303452323      442222        syn-C2H3C(O)NH2, v=0
  645301.5010  0.0051 -4.7891 3  487.9550121  71510 303601546      601249        syn-C2H3C(O)NH2, v=0
  645304.5118  0.0021 -5.4225 3  183.7594 67  71510 303331716      331419        syn-C2H3C(O)NH2, v=0
  645304.9716  0.0021 -5.4225 3  183.7594 67  71510 303331717      331420        syn-C2H3C(O)NH2, v=0
  645341.5802  0.0269 -3.9271 3 1069.9218183  71510 303911576      901675        syn-C2H3C(O)NH2, v=0
  645341.6512  0.0269 -3.9271 3 1069.9218183  71510 303911676      901575        syn-C2H3C(O)NH2, v=0
  645400.0461  0.0027 -3.7057 3  237.5095 87  71510 303431034      42 735        syn-C2H3C(O)NH2, v=0
  645548.0965  0.1637 -5.4803 3 1199.3591217  71510 303A8 1A7      A8 0A8        syn-C2H3C(O)NH2, v=0
  645548.0965  0.1637 -5.4803 3 1199.3591217  71510 303A8 2A7      A8 1A8        syn-C2H3C(O)NH2, v=0
  645557.8413  0.0518 -4.9183 3 1495.7199181  71510 303904743      904644        syn-C2H3C(O)NH2, v=0
  645557.8413  0.0518 -4.9183 3 1495.7199181  71510 303904744      904645        syn-C2H3C(O)NH2, v=0
  645595.2161  0.0026 -4.3716 3  162.8473 71  71510 303351124      34 827        syn-C2H3C(O)NH2, v=0
  645663.2252  0.0070 -4.7721 3  646.1020137  71510 303681950      681653        syn-C2H3C(O)NH2, v=0
  645681.9267  0.0197 -5.7653 3  994.8195171  71510 303852165      842164        syn-C2H3C(O)NH2, v=0
  645853.4558  0.0202 -5.7852 3 1007.2549173  71510 303861967      851966        syn-C2H3C(O)NH2, v=0
  645986.9516  0.1509 -5.3182 3 1494.1420233  71510 303B6 6B0      B6 5B1        syn-C2H3C(O)NH2, v=0
  645986.9516  0.1509 -5.3182 3 1494.1420233  71510 303B6 7B0      B6 6B1        syn-C2H3C(O)NH2, v=0
  646004.1409  0.0510 -4.8809 3 1473.7201179  71510 303894742      894643        syn-C2H3C(O)NH2, v=0
  646004.1409  0.0510 -4.8809 3 1473.7201179  71510 303894743      894644        syn-C2H3C(O)NH2, v=0
  646004.3099  0.1582 -5.5431 3 1686.2010243  71510 303C1 9B2      C1 8B3        syn-C2H3C(O)NH2, v=0
  646004.3099  0.1582 -5.5431 3 1686.2010243  71510 303C110B2      C1 9B3        syn-C2H3C(O)NH2, v=0
  646009.3605  0.0256 -3.9476 3 1060.8668181  71510 303901674      891773        syn-C2H3C(O)NH2, v=0
  646010.8175  0.0256 -3.9476 3 1060.8668181  71510 303901774      891673        syn-C2H3C(O)NH2, v=0
  646109.6063  0.0026 -4.8459 3  343.7839 97  71510 303481830      481533        syn-C2H3C(O)NH2, v=0
  646181.6618  0.0160 -3.9419 3  881.2580161  71510 303802061      791960        syn-C2H3C(O)NH2, v=0
  646217.1544  0.0039 -4.7751 3  456.7200113  71510 303561937      561640        syn-C2H3C(O)NH2, v=0
  646269.1526  0.0036 -5.0859 3  305.7301 99  71510 30349 940      49 643        syn-C2H3C(O)NH2, v=0
  646299.7063  0.0037 -5.2081 3  275.8912 95  71510 30347 839      47 542        syn-C2H3C(O)NH2, v=0
  646358.2818  0.0165 -5.6807 3  950.6562167  71510 303832063      822062        syn-C2H3C(O)NH2, v=0
  646388.8859  0.0037 -5.2080 3  275.8912 95  71510 30347 939      47 642        syn-C2H3C(O)NH2, v=0
  646436.8711  0.0503 -4.8443 3 1451.9695177  71510 303884741      884642        syn-C2H3C(O)NH2, v=0
  646436.8711  0.0503 -4.8443 3 1451.9695177  71510 303884742      884643        syn-C2H3C(O)NH2, v=0
  646543.9642  0.1403 -5.3952 3 1182.5110185  71510 303922468      922171        syn-C2H3C(O)NH2, v=0
  646571.6474  0.0036 -5.0856 3  305.7302 99  71510 303491040      49 743        syn-C2H3C(O)NH2, v=0
  646633.7193  0.0029 -3.7747 3  221.5676 85  71510 30342 834      41 735        syn-C2H3C(O)NH2, v=0
  646681.8161  0.0053 -3.5092 3  587.7264131  71510 303651848      641747        syn-C2H3C(O)NH2, v=0
  646856.3616  0.0496 -4.8084 3 1430.4681175  71510 303874740      874641        syn-C2H3C(O)NH2, v=0
  646856.3616  0.0496 -4.8084 3 1430.4681175  71510 303874741      874642        syn-C2H3C(O)NH2, v=0
  646901.7304  0.0022 -5.4942 3  175.6007 65  71510 303321715      321418        syn-C2H3C(O)NH2, v=0
  646901.9216  0.0022 -5.4942 3  175.6007 65  71510 303321716      321419        syn-C2H3C(O)NH2, v=0
  646956.2658  0.0243 -3.9726 3 1051.0625179  71510 303891772      881871        syn-C2H3C(O)NH2, v=0
  646981.2586  0.0243 -3.9726 3 1051.0619179  71510 303891872      881771        syn-C2H3C(O)NH2, v=0
  646996.4220  0.0036 -4.1144 3  175.0373 79  71510 30339 534      38 435        syn-C2H3C(O)NH2, v=0
  647000.7095  0.0036 -4.1144 3  175.0373 79  71510 30339 634      38 335        syn-C2H3C(O)NH2, v=0
  647097.7431  0.0021 -4.6183 3  134.2277 63  71510 303311219      30 922        syn-C2H3C(O)NH2, v=0
  647115.1839  0.0017 -3.1565 3  463.0734115  71510 303571840      561739        syn-C2H3C(O)NH2, v=0
  647262.9348  0.0489 -4.7732 3 1409.2157173  71510 303864739      864640        syn-C2H3C(O)NH2, v=0
  647262.9348  0.0489 -4.7732 3 1409.2157173  71510 303864740      864641        syn-C2H3C(O)NH2, v=0
  647355.0575  0.1547 -5.2506 3 1378.4307227  71510 303B3 4A9      B3 3B0        syn-C2H3C(O)NH2, v=0
  647355.0575  0.1547 -5.2506 3 1378.4307227  71510 303B3 5A9      B3 4B0        syn-C2H3C(O)NH2, v=0
  647391.8425  0.0016 -3.0291 3  428.9433109  71510 303541936      531835        syn-C2H3C(O)NH2, v=0
  647429.5501  0.0025 -4.8444 3  343.7398 97  71510 303481831      481534        syn-C2H3C(O)NH2, v=0
  647438.1044  0.0016 -3.0290 3  428.9420109  71510 303541935      531836        syn-C2H3C(O)NH2, v=0
  647539.8503  0.0035 -3.6712 3  264.2919 91  71510 303451035      44 936        syn-C2H3C(O)NH2, v=0
  647656.9058  0.0483 -4.7388 3 1388.2121171  71510 303854738      854639        syn-C2H3C(O)NH2, v=0
  647656.9058  0.0483 -4.7388 3 1388.2121171  71510 303854739      854640        syn-C2H3C(O)NH2, v=0
  647749.4172  0.1663 -5.6509 3 1760.9102247  71510 303C310B3      C3 9B4        syn-C2H3C(O)NH2, v=0
  647749.4172  0.1663 -5.6509 3 1760.9102247  71510 303C311B3      C310B4        syn-C2H3C(O)NH2, v=0
  647923.5844  0.0028 -3.7734 3  221.5669 85  71510 30342 934      41 635        syn-C2H3C(O)NH2, v=0
  647986.1346  0.0224 -5.8219 3 1020.5505171  71510 303852462      842461        syn-C2H3C(O)NH2, v=0
  647990.0934  0.0057 -4.8014 3  554.5414125  71510 303622042      621745        syn-C2H3C(O)NH2, v=0
  648030.9344  0.0043 -5.2187 3  292.2228 93  71510 303461432      46 937        syn-C2H3C(O)NH2, v=0
  648038.5830  0.0477 -4.7052 3 1367.4571169  71510 303844737      844638        syn-C2H3C(O)NH2, v=0
  648038.5830  0.0477 -4.7052 3 1367.4571169  71510 303844738      844639        syn-C2H3C(O)NH2, v=0
  648115.1768  0.1549 -5.3978 3 1565.6530237  71510 303B8 7B1      B8 6B2        syn-C2H3C(O)NH2, v=0
  648115.1768  0.1549 -5.3978 3 1565.6530237  71510 303B8 8B1      B8 7B2        syn-C2H3C(O)NH2, v=0
  648178.5822  0.0335 -5.0058 3  798.5157153  71510 303761957      761660        syn-C2H3C(O)NH2, v=0
  648218.2536  0.0231 -4.0052 3 1040.4329177  71510 303881870      871969        syn-C2H3C(O)NH2, v=0
  648260.9206  0.1627 -5.3145 3 1265.6528221  71510 303B0 2A8      B0 1A9        syn-C2H3C(O)NH2, v=0
  648260.9206  0.1627 -5.3145 3 1265.6528221  71510 303B0 3A8      B0 2A9        syn-C2H3C(O)NH2, v=0
  648262.5453  0.0198 -4.0297 3 1007.2549173  71510 303862067      851966        syn-C2H3C(O)NH2, v=0
  648347.7839  0.0022 -5.5712 3  167.6986 63  71510 303311714      311417        syn-C2H3C(O)NH2, v=0
  648347.8606  0.0022 -5.5712 3  167.6986 63  71510 303311715      311418        syn-C2H3C(O)NH2, v=0
  648359.8763  0.0023 -3.6462 3  269.7915 91  71510 303451234      44 935        syn-C2H3C(O)NH2, v=0
  648408.2682  0.0472 -4.6724 3 1346.9507167  71510 303834736      834637        syn-C2H3C(O)NH2, v=0
  648408.2682  0.0472 -4.6724 3 1346.9507167  71510 303834737      834638        syn-C2H3C(O)NH2, v=0
  648462.4951  0.0067 -4.8782 3  137.8065 67  71510 30333 924      32 627        syn-C2H3C(O)NH2, v=0
  648566.5727  0.0196 -5.6476 3  934.6008165  71510 303822161      812160        syn-C2H3C(O)NH2, v=0
  648570.3977  0.0230 -4.0048 3 1040.4256177  71510 303881970      871869        syn-C2H3C(O)NH2, v=0
  648705.7965  0.0225 -4.0538 3 1028.8787175  71510 303871968      862067        syn-C2H3C(O)NH2, v=0
  648766.2564  0.0468 -4.6404 3 1326.6926165  71510 303824735      824636        syn-C2H3C(O)NH2, v=0
  648766.2564  0.0468 -4.6404 3 1326.6926165  71510 303824736      824637        syn-C2H3C(O)NH2, v=0
  648797.1089  0.0032 -3.9716 3  190.3071 81  71510 30340 634      39 535        syn-C2H3C(O)NH2, v=0
  648831.9165  0.0032 -3.9716 3  190.3071 81  71510 30340 734      39 435        syn-C2H3C(O)NH2, v=0
  648879.2808  0.0042 -3.6439 3  292.2697 95  71510 303471136      461037        syn-C2H3C(O)NH2, v=0
  648883.3439  0.0273 -4.1543 3 1038.0986175  71510 303872067      862166        syn-C2H3C(O)NH2, v=0
  648946.0265  0.0048 -3.4622 3  430.0451113  71510 303561541      551442        syn-C2H3C(O)NH2, v=0
  648964.7586  0.0030 -3.8609 3  205.8239 83  71510 30341 734      40 635        syn-C2H3C(O)NH2, v=0
  649084.5310  0.0063 -4.8374 3  502.6550123  71510 303611447      611150        syn-C2H3C(O)NH2, v=0
  649112.8368  0.0464 -4.6092 3 1306.6826163  71510 303814734      814635        syn-C2H3C(O)NH2, v=0
  649112.8368  0.0464 -4.6092 3 1306.6826163  71510 303814735      814636        syn-C2H3C(O)NH2, v=0
  649135.9208  0.0854 -5.7896 3 1982.4882219  71510 303A94861      A94762        syn-C2H3C(O)NH2, v=0
  649135.9208  0.0854 -5.7896 3 1982.4882219  71510 303A94862      A94763        syn-C2H3C(O)NH2, v=0
  649197.5080  0.0029 -3.8606 3  205.8238 83  71510 30341 834      40 535        syn-C2H3C(O)NH2, v=0
  649208.0200  0.1388 -5.7018 3 1432.1176203  71510 303A12774      A12477        syn-C2H3C(O)NH2, v=0
  649362.2162  0.1758 -5.7658 3 1836.8761251  71510 303C511B4      C510B5        syn-C2H3C(O)NH2, v=0
  649362.2162  0.1758 -5.7658 3 1836.8761251  71510 303C512B4      C511B5        syn-C2H3C(O)NH2, v=0
  649428.1329  0.0017 -3.1538 3  463.0108115  71510 303571839      561740        syn-C2H3C(O)NH2, v=0
  649448.2923  0.0460 -4.5789 3 1286.9207161  71510 303804733      804634        syn-C2H3C(O)NH2, v=0
  649448.2923  0.0460 -4.5789 3 1286.9207161  71510 303804734      804635        syn-C2H3C(O)NH2, v=0
  649654.5359  0.0023 -5.6540 3  160.0521 61  71510 303301713      301416        syn-C2H3C(O)NH2, v=0
  649654.5656  0.0023 -5.6540 3  160.0521 61  71510 303301714      301417        syn-C2H3C(O)NH2, v=0
  649724.1316  0.1564 -5.2960 3 1447.9877231  71510 303B5 5B0      B5 4B1        syn-C2H3C(O)NH2, v=0
  649724.1316  0.1564 -5.2960 3 1447.9877231  71510 303B5 6B0      B5 5B1        syn-C2H3C(O)NH2, v=0
  649725.9793  0.0246 -5.7600 3  990.7054169  71510 303842361      832360        syn-C2H3C(O)NH2, v=0
  649772.9001  0.0456 -4.5494 3 1267.4067159  71510 303794732      794633        syn-C2H3C(O)NH2, v=0
  649772.9001  0.0456 -4.5494 3 1267.4067159  71510 303794733      794634        syn-C2H3C(O)NH2, v=0
  649849.1579  0.0429 -3.8388 3 1144.8159203  71510 303A1 695      A0 794        syn-C2H3C(O)NH2, v=0
  649849.1579  0.0429 -3.8388 3 1144.8159203  71510 303A1 795      A0 694        syn-C2H3C(O)NH2, v=0
  649850.4700  0.0450 -3.8270 3 1147.9465205  71510 303A2 597      A1 696        syn-C2H3C(O)NH2, v=0
  649850.4700  0.0450 -3.8270 3 1147.9465205  71510 303A2 697      A1 596        syn-C2H3C(O)NH2, v=0
  649858.5180  0.0411 -3.8504 3 1141.1529201  71510 303A0 793      99 892        syn-C2H3C(O)NH2, v=0
  649858.5180  0.0411 -3.8504 3 1141.1529201  71510 303A0 893      99 792        syn-C2H3C(O)NH2, v=0
  649858.8229  0.0474 -3.8149 3 1150.5508207  71510 303A3 499      A2 598        syn-C2H3C(O)NH2, v=0
  649858.8229  0.0474 -3.8149 3 1150.5508207  71510 303A3 599      A2 498        syn-C2H3C(O)NH2, v=0
  649869.5878  0.0832 -5.7396 3 1955.7404217  71510 303A84860      A84761        syn-C2H3C(O)NH2, v=0
  649869.5878  0.0832 -5.7396 3 1955.7404217  71510 303A84861      A84762        syn-C2H3C(O)NH2, v=0
  649871.2855  0.0505 -3.8026 3 1152.6341209  71510 303A4 3A1      A3 4A0        syn-C2H3C(O)NH2, v=0
  649871.2855  0.0505 -3.8026 3 1152.6341209  71510 303A4 4A1      A3 3A0        syn-C2H3C(O)NH2, v=0
  649883.0969  0.0394 -3.8619 3 1136.9503199  71510 30399 891      98 990        syn-C2H3C(O)NH2, v=0
  649883.0969  0.0394 -3.8619 3 1136.9503199  71510 30399 991      98 890        syn-C2H3C(O)NH2, v=0
  649885.4687  0.0543 -3.7898 3 1154.2010211  71510 303A5 2A3      A4 3A2        syn-C2H3C(O)NH2, v=0
  649885.4687  0.0543 -3.7898 3 1154.2010211  71510 303A5 3A3      A4 2A2        syn-C2H3C(O)NH2, v=0
  649899.4083  0.0591 -3.7766 3 1155.2556213  71510 303A6 1A5      A5 2A4        syn-C2H3C(O)NH2, v=0
  649899.4083  0.0591 -3.7766 3 1155.2556213  71510 303A6 2A5      A5 1A4        syn-C2H3C(O)NH2, v=0
  649911.4753  0.0652 -3.7629 3 1155.8011215  71510 303A7 0A7      A6 1A6        syn-C2H3C(O)NH2, v=0
  649911.4753  0.0652 -3.7629 3 1155.8011215  71510 303A7 1A7      A6 0A6        syn-C2H3C(O)NH2, v=0
  649928.6550  0.0379 -3.8734 3 1132.1995197  71510 30398 989      971088        syn-C2H3C(O)NH2, v=0
  649928.6550  0.0379 -3.8734 3 1132.1995197  71510 303981089      97 988        syn-C2H3C(O)NH2, v=0
  649959.3196  0.0210 -5.7782 3 1003.1791171  71510 303852264      842263        syn-C2H3C(O)NH2, v=0
  649970.2362  0.0016 -2.9535 3  410.9260105  71510 303522033      511932        syn-C2H3C(O)NH2, v=0
  649971.2363  0.0016 -2.9535 3  410.9260105  71510 303522032      511933        syn-C2H3C(O)NH2, v=0
  650002.5912  0.0363 -3.8851 3 1126.8906195  71510 303971087      961186        syn-C2H3C(O)NH2, v=0
  650002.5912  0.0363 -3.8851 3 1126.8906195  71510 303971187      961086        syn-C2H3C(O)NH2, v=0
  650086.9315  0.0453 -4.5208 3 1248.1404157  71510 303784731      784632        syn-C2H3C(O)NH2, v=0
  650086.9315  0.0453 -4.5208 3 1248.1404157  71510 303784732      784633        syn-C2H3C(O)NH2, v=0
  650114.5595  0.0348 -3.8972 3 1121.0115193  71510 303961185      951284        syn-C2H3C(O)NH2, v=0
  650114.5595  0.0348 -3.8972 3 1121.0115193  71510 303961285      951184        syn-C2H3C(O)NH2, v=0
  650119.0492  0.1602 -5.4891 3 1638.4345241  71510 303C0 8B2      C0 7B3        syn-C2H3C(O)NH2, v=0
  650119.0492  0.1602 -5.4891 3 1638.4345241  71510 303C0 9B2      C0 8B3        syn-C2H3C(O)NH2, v=0
  650151.4877  0.0177 -5.7161 3  972.2164169  71510 303842064      832063        syn-C2H3C(O)NH2, v=0
  650239.9166  0.0219 -5.8195 3 1028.8787175  71510 303872068      862067        syn-C2H3C(O)NH2, v=0
  650277.3955  0.0333 -3.9098 3 1114.5478191  71510 303951283      941382        syn-C2H3C(O)NH2, v=0
  650277.3955  0.0333 -3.9098 3 1114.5478191  71510 303951383      941282        syn-C2H3C(O)NH2, v=0
  650375.9415  0.0025 -2.5768 3  319.2114 65  71510 3033230 2      3129 3        syn-C2H3C(O)NH2, v=0
  650375.9415  0.0025 -2.5768 3  319.2114 65  71510 3033230 3      3129 2        syn-C2H3C(O)NH2, v=0
  650384.3164  0.0221 -5.7973 3 1011.6089171  71510 303852363      842362        syn-C2H3C(O)NH2, v=0
  650390.6525  0.0451 -4.4931 3 1229.1216155  71510 303774730      774631        syn-C2H3C(O)NH2, v=0
  650390.6525  0.0451 -4.4931 3 1229.1216155  71510 303774731      774632        syn-C2H3C(O)NH2, v=0
  650508.5551  0.0318 -3.9233 3 1107.4818189  71510 303941381      931480        syn-C2H3C(O)NH2, v=0
  650508.5552  0.0318 -3.9233 3 1107.4818189  71510 303941481      931380        syn-C2H3C(O)NH2, v=0
  650583.1788  0.0811 -5.6902 3 1929.2450215  71510 303A74859      A74760        syn-C2H3C(O)NH2, v=0
  650583.1788  0.0811 -5.6902 3 1929.2450215  71510 303A74860      A74761        syn-C2H3C(O)NH2, v=0
  650649.1013  0.0243 -5.8187 3 1020.7076171  71510 303852461      842460        syn-C2H3C(O)NH2, v=0
  650684.3238  0.0448 -4.4663 3 1210.3503153  71510 303764729      764630        syn-C2H3C(O)NH2, v=0
  650684.3238  0.0448 -4.4663 3 1210.3503153  71510 303764730      764631        syn-C2H3C(O)NH2, v=0
  650809.9233  0.0021 -2.5980 3  321.5962 69  71510 3033429 5      3328 6        syn-C2H3C(O)NH2, v=0
  650809.9233  0.0021 -2.5980 3  321.5962 69  71510 3033429 6      3328 5        syn-C2H3C(O)NH2, v=0
  650832.4517  0.0304 -3.9381 3 1099.7912187  71510 303931479      921578        syn-C2H3C(O)NH2, v=0
  650832.4533  0.0304 -3.9381 3 1099.7912187  71510 303931579      921478        syn-C2H3C(O)NH2, v=0
  650832.8776  0.0024 -5.7432 3  152.6604 59  71510 303291712      291415        syn-C2H3C(O)NH2, v=0
  650832.8886  0.0024 -5.7432 3  152.6604 59  71510 303291713      291416        syn-C2H3C(O)NH2, v=0
  650859.9526  0.1625 -5.2763 3 1333.2388225  71510 303B2 3A9      B2 2B0        syn-C2H3C(O)NH2, v=0
  650859.9526  0.1625 -5.2763 3 1333.2388225  71510 303B2 4A9      B2 3B0        syn-C2H3C(O)NH2, v=0
  650895.0957  0.0239 -5.7001 3  961.9915167  71510 303832261      822260        syn-C2H3C(O)NH2, v=0
  650968.2006  0.0446 -4.4405 3 1191.8263151  71510 303754728      754629        syn-C2H3C(O)NH2, v=0
  650968.2006  0.0446 -4.4405 3 1191.8263151  71510 303754729      754630        syn-C2H3C(O)NH2, v=0
  650981.1593  0.0100 -3.7403 3  717.7806145  71510 303721954      711853        syn-C2H3C(O)NH2, v=0
  651114.8860  0.0218 -5.8181 3 1028.7983175  71510 303871968      861967        syn-C2H3C(O)NH2, v=0
  651123.3512  0.0034 -4.7502 3  470.8262115  71510 303571939      571642        syn-C2H3C(O)NH2, v=0
  651227.4627  0.0019 -2.6216 3  325.4511 73  71510 3033628 8      3527 9        syn-C2H3C(O)NH2, v=0
  651227.4627  0.0019 -2.6216 3  325.4511 73  71510 3033628 9      3527 8        syn-C2H3C(O)NH2, v=0
  651242.5332  0.0445 -4.4157 3 1173.5495149  71510 303744727      744628        syn-C2H3C(O)NH2, v=0
  651242.5332  0.0445 -4.4157 3 1173.5495149  71510 303744728      744629        syn-C2H3C(O)NH2, v=0
  651243.3094  0.0024 -5.4051 3   85.5630 47  71510 303231311      221012        syn-C2H3C(O)NH2, v=0
  651246.5455  0.0024 -5.4051 3   85.5628 47  71510 303231310      221013        syn-C2H3C(O)NH2, v=0
  651277.1803  0.0791 -5.6415 3 1903.0019213  71510 303A64858      A64759        syn-C2H3C(O)NH2, v=0
  651277.1803  0.0791 -5.6415 3 1903.0019213  71510 303A64859      A64760        syn-C2H3C(O)NH2, v=0
  651284.4509  0.0289 -3.9547 3 1091.4481185  71510 303921577      911676        syn-C2H3C(O)NH2, v=0
  651284.4903  0.0289 -3.9547 3 1091.4481185  71510 303921677      911576        syn-C2H3C(O)NH2, v=0
  651361.6875  0.0016 -2.8906 3  394.6795101  71510 303502130      492029        syn-C2H3C(O)NH2, v=0
  651361.7015  0.0016 -2.8906 3  394.6795101  71510 303502129      492030        syn-C2H3C(O)NH2, v=0
  651441.1111  0.0025 -4.8737 3  331.6769 95  71510 303471829      471532        syn-C2H3C(O)NH2, v=0
  651507.5672  0.0443 -4.3919 3 1155.5196147  71510 303734726      734627        syn-C2H3C(O)NH2, v=0
  651507.5672  0.0443 -4.3919 3 1155.5196147  71510 303734727      734628        syn-C2H3C(O)NH2, v=0
  651547.9832  0.1725 -5.5185 3 1221.4390219  71510 303A9 1A8      A9 0A9        syn-C2H3C(O)NH2, v=0
  651547.9832  0.1725 -5.5185 3 1221.4390219  71510 303A9 2A8      A9 1A9        syn-C2H3C(O)NH2, v=0
  651616.4401  0.0018 -2.6480 3  330.7842 77  71510 303382711      372612        syn-C2H3C(O)NH2, v=0
  651616.4401  0.0018 -2.6480 3  330.7842 77  71510 303382712      372611        syn-C2H3C(O)NH2, v=0
  651700.2187  0.0048 -4.8261 3  451.3603117  71510 303581445      581148        syn-C2H3C(O)NH2, v=0
  651763.5430  0.0442 -4.3692 3 1137.7367145  71510 303724725      724626        syn-C2H3C(O)NH2, v=0
  651763.5430  0.0442 -4.3692 3 1137.7367145  71510 303724726      724627        syn-C2H3C(O)NH2, v=0
  651774.2609  0.0018 -3.1888 3  477.5304117  71510 303581841      571740        syn-C2H3C(O)NH2, v=0
  651794.1933  0.0212 -5.7970 3 1016.3571173  71510 303862166      852165        syn-C2H3C(O)NH2, v=0
  651800.7503  0.0021 -4.5550 3  142.0310 65  71510 303321220      31 923        syn-C2H3C(O)NH2, v=0
  651917.9372  0.0275 -3.9742 3 1082.4154183  71510 303911675      901774        syn-C2H3C(O)NH2, v=0
  651918.7647  0.0275 -3.9742 3 1082.4153183  71510 303911775      901674        syn-C2H3C(O)NH2, v=0
  651952.0650  0.0772 -5.5934 3 1877.0108211  71510 303A54857      A54758        syn-C2H3C(O)NH2, v=0
  651952.0650  0.0772 -5.5934 3 1877.0108211  71510 303A54858      A54759        syn-C2H3C(O)NH2, v=0
  651958.7535  0.0018 -2.6776 3  337.6056 81  71510 303402614      392515        syn-C2H3C(O)NH2, v=0
  651958.7535  0.0018 -2.6776 3  337.6056 81  71510 303402615      392514        syn-C2H3C(O)NH2, v=0
  651973.6735  0.1594 -5.3618 3 1518.8239235  71510 303B7 6B1      B7 5B2        syn-C2H3C(O)NH2, v=0
  651973.6735  0.1594 -5.3618 3 1518.8239235  71510 303B7 7B1      B7 6B2        syn-C2H3C(O)NH2, v=0
  651996.4781  0.1669 -5.5900 3 1712.4817245  71510 303C2 9B3      C2 8B4        syn-C2H3C(O)NH2, v=0
  651996.4781  0.1669 -5.5900 3 1712.4817245  71510 303C210B3      C2 9B4        syn-C2H3C(O)NH2, v=0
  652006.1244  0.0037 -3.3943 3  464.6628117  71510 303581642      571543        syn-C2H3C(O)NH2, v=0
  652010.6966  0.0442 -4.3476 3 1120.2004143  71510 303714724      714625        syn-C2H3C(O)NH2, v=0
  652010.6966  0.0442 -4.3476 3 1120.2004143  71510 303714725      714626        syn-C2H3C(O)NH2, v=0
  652072.6054  0.0016 -2.8366 3  380.1092 97  71510 303482227      472126        syn-C2H3C(O)NH2, v=0
  652072.6056  0.0016 -2.8366 3  380.1092 97  71510 303482226      472127        syn-C2H3C(O)NH2, v=0
  652194.0725  0.0024 -4.8729 3  331.6517 95  71510 303471830      471533        syn-C2H3C(O)NH2, v=0
  652227.4581  0.0017 -2.7106 3  345.9286 85  71510 303422517      412418        syn-C2H3C(O)NH2, v=0
  652227.4581  0.0017 -2.7106 3  345.9286 85  71510 303422518      412417        syn-C2H3C(O)NH2, v=0
  652249.2593  0.0441 -4.3271 3 1102.9108141  71510 303704723      704624        syn-C2H3C(O)NH2, v=0
  652249.2593  0.0441 -4.3271 3 1102.9108141  71510 303704724      704625        syn-C2H3C(O)NH2, v=0
  652345.8542  0.0069 -4.7840 3  621.4104135  71510 303671850      671553        syn-C2H3C(O)NH2, v=0
  652362.1572  0.0017 -2.7894 3  367.1537 93  71510 303462323      452224        syn-C2H3C(O)NH2, v=0
  652362.1572  0.0017 -2.7894 3  367.1537 93  71510 303462324      452223        syn-C2H3C(O)NH2, v=0
  652382.2643  0.0017 -2.7477 3  355.7704 89  71510 303442420      432321        syn-C2H3C(O)NH2, v=0
  652382.2643  0.0017 -2.7477 3  355.7704 89  71510 303442421      432320        syn-C2H3C(O)NH2, v=0
  652479.4579  0.0441 -4.3079 3 1085.8677139  71510 303694722      694623        syn-C2H3C(O)NH2, v=0
  652479.4579  0.0441 -4.3079 3 1085.8677139  71510 303694723      694624        syn-C2H3C(O)NH2, v=0
  652608.2923  0.0754 -5.5459 3 1851.2715209  71510 303A44856      A44757        syn-C2H3C(O)NH2, v=0
  652608.2923  0.0754 -5.5459 3 1851.2715209  71510 303A44857      A44758        syn-C2H3C(O)NH2, v=0
  652649.0062  0.0215 -4.0482 3 1028.7983175  71510 303872068      861967        syn-C2H3C(O)NH2, v=0
  652701.5149  0.0441 -4.2899 3 1069.0709137  71510 303684721      684622        syn-C2H3C(O)NH2, v=0
  652701.5149  0.0441 -4.2899 3 1069.0709137  71510 303684722      684623        syn-C2H3C(O)NH2, v=0
  652813.8816  0.0261 -3.9977 3 1072.6429181  71510 303901773      891872        syn-C2H3C(O)NH2, v=0
  652828.5068  0.0261 -3.9977 3 1072.6426181  71510 303901873      891772        syn-C2H3C(O)NH2, v=0
  652851.6977  0.0165 -3.9270 3  860.7341159  71510 303792060      781959        syn-C2H3C(O)NH2, v=0
  652915.6487  0.0441 -4.2733 3 1052.5203135  71510 303674720      674621        syn-C2H3C(O)NH2, v=0
  652915.6487  0.0441 -4.2733 3 1052.5203135  71510 303674721      674622        syn-C2H3C(O)NH2, v=0
  652992.4108  0.1200 -5.3180 3 1104.3751179  71510 303892366      892069        syn-C2H3C(O)NH2, v=0
  653093.2560  0.0023 -3.3036 3  485.5710119  71510 303591742      581643        syn-C2H3C(O)NH2, v=0
  653109.2350  0.0047 -4.8794 3  415.9699113  71510 303561244      56 947        syn-C2H3C(O)NH2, v=0
  653122.0732  0.0442 -4.2581 3 1036.2159133  71510 303664719      664620        syn-C2H3C(O)NH2, v=0
  653122.0732  0.0442 -4.2581 3 1036.2159133  71510 303664720      664621        syn-C2H3C(O)NH2, v=0
  653136.2583  0.0052 -5.0271 3  138.2452 75  71510 30337 235      36 136        syn-C2H3C(O)NH2, v=0
  653136.2592  0.0052 -5.0271 3  138.2452 75  71510 30337 335      36 036        syn-C2H3C(O)NH2, v=0
  653246.3091  0.0736 -5.4992 3 1825.7839207  71510 303A34855      A34756        syn-C2H3C(O)NH2, v=0
  653246.3091  0.0736 -5.4992 3 1825.7839207  71510 303A34856      A34757        syn-C2H3C(O)NH2, v=0
  653320.9984  0.0443 -4.2445 3 1020.1574131  71510 303654718      654619        syn-C2H3C(O)NH2, v=0
  653320.9984  0.0443 -4.2445 3 1020.1574131  71510 303654719      654620        syn-C2H3C(O)NH2, v=0
  653343.6904  0.1633 -5.2922 3 1402.1126229  71510 303B4 4B0      B4 3B1        syn-C2H3C(O)NH2, v=0
  653343.6904  0.1633 -5.2922 3 1402.1126229  71510 303B4 5B0      B4 4B1        syn-C2H3C(O)NH2, v=0
  653397.5999  0.0045 -3.4555 3  570.9613129  71510 303641847      631746        syn-C2H3C(O)NH2, v=0
  653512.6303  0.0444 -4.2325 3 1004.3448129  71510 303644717      644618        syn-C2H3C(O)NH2, v=0
  653512.6303  0.0444 -4.2325 3 1004.3448129  71510 303644718      644619        syn-C2H3C(O)NH2, v=0
  653571.1500  0.0223 -4.9580 3  734.1168147  71510 303731855      731558        syn-C2H3C(O)NH2, v=0
  653613.0702  0.0042 -5.8017 3  206.6398 77  71510 303381424      38 929        syn-C2H3C(O)NH2, v=0
  653613.4609  0.0055 -5.3620 3  275.1378 91  71510 303451332      45 837        syn-C2H3C(O)NH2, v=0
  653697.1709  0.0445 -4.2223 3  988.7780127  71510 303634716      634617        syn-C2H3C(O)NH2, v=0
  653697.1709  0.0445 -4.2223 3  988.7780127  71510 303634717      634618        syn-C2H3C(O)NH2, v=0
  653724.1755  0.0016 -3.0526 3  442.4667111  71510 303551937      541836        syn-C2H3C(O)NH2, v=0
  653745.2402  0.1752 -5.6991 3 1787.7901249  71510 303C410B4      C4 9B5        syn-C2H3C(O)NH2, v=0
  653745.2402  0.1752 -5.6991 3 1787.7901249  71510 303C411B4      C410B5        syn-C2H3C(O)NH2, v=0
  653811.5495  0.0016 -3.0525 3  442.4642111  71510 303551936      541837        syn-C2H3C(O)NH2, v=0
  653866.5502  0.0720 -5.4530 3 1800.5477205  71510 303A24854      A24755        syn-C2H3C(O)NH2, v=0
  653866.5502  0.0720 -5.4530 3 1800.5477205  71510 303A24855      A24756        syn-C2H3C(O)NH2, v=0
  653874.8184  0.0447 -4.2141 3  973.4567125  71510 303624715      624616        syn-C2H3C(O)NH2, v=0
  653874.8184  0.0447 -4.2141 3  973.4567125  71510 303624716      624617        syn-C2H3C(O)NH2, v=0
  653894.5466  0.0061 -4.7847 3  580.6554131  71510 303651749      651452        syn-C2H3C(O)NH2, v=0
  653908.5122  0.0190 -5.7517 3  993.9031171  71510 303852065      842064        syn-C2H3C(O)NH2, v=0
  654041.8425  0.0248 -4.0280 3 1062.0595179  71510 303891871      881970        syn-C2H3C(O)NH2, v=0
  654045.7672  0.0448 -4.2080 3  958.3810123  71510 303614714      614615        syn-C2H3C(O)NH2, v=0
  654045.7672  0.0448 -4.2080 3  958.3810123  71510 303614715      614616        syn-C2H3C(O)NH2, v=0
  654101.8688  0.1635 -5.4427 3 1590.9347239  71510 303B9 7B2      B9 6B3        syn-C2H3C(O)NH2, v=0
  654101.8688  0.1635 -5.4427 3 1590.9347239  71510 303B9 8B2      B9 7B3        syn-C2H3C(O)NH2, v=0
  654210.2080  0.0450 -4.2042 3  943.5507121  71510 303604713      604614        syn-C2H3C(O)NH2, v=0
  654210.2080  0.0450 -4.2042 3  943.5507121  71510 303604714      604615        syn-C2H3C(O)NH2, v=0
  654255.3470  0.0248 -4.0277 3 1062.0551179  71510 303891971      881870        syn-C2H3C(O)NH2, v=0
  654255.7819  0.1715 -5.3540 3 1288.3338223  71510 303B1 2A9      B1 1B0        syn-C2H3C(O)NH2, v=0
  654255.7819  0.1715 -5.3540 3 1288.3338223  71510 303B1 3A9      B1 2B0        syn-C2H3C(O)NH2, v=0
  654368.3276  0.0452 -4.2031 3  928.9657119  71510 303594712      594613        syn-C2H3C(O)NH2, v=0
  654368.3276  0.0452 -4.2031 3  928.9657119  71510 303594713      594614        syn-C2H3C(O)NH2, v=0
  654372.8196  0.0055 -3.5380 3  396.6737109  71510 303541440      531341        syn-C2H3C(O)NH2, v=0
  654469.4388  0.0704 -5.4076 3 1775.5627203  71510 303A14853      A14754        syn-C2H3C(O)NH2, v=0
  654469.4388  0.0704 -5.4076 3 1775.5627203  71510 303A14854      A14755        syn-C2H3C(O)NH2, v=0
  654520.3095  0.0454 -4.2050 3  914.6259117  71510 303584711      584612        syn-C2H3C(O)NH2, v=0
  654520.3095  0.0454 -4.2050 3  914.6259117  71510 303584712      584613        syn-C2H3C(O)NH2, v=0
  654564.7645  0.0074 -4.8523 3  556.5854129  71510 303641549      641252        syn-C2H3C(O)NH2, v=0
  654666.3335  0.0457 -4.2104 3  900.5311115  71510 303574710      574611        syn-C2H3C(O)NH2, v=0
  654666.3335  0.0457 -4.2104 3  900.5311115  71510 303574711      574612        syn-C2H3C(O)NH2, v=0
  654738.6414  0.0877 -5.4181 3 1198.1160185  71510 303922666      922369        syn-C2H3C(O)NH2, v=0
  654806.5759  0.0459 -4.2198 3  886.6814113  71510 3035647 9      564610        syn-C2H3C(O)NH2, v=0
  654806.5759  0.0459 -4.2198 3  886.6814113  71510 303564710      564611        syn-C2H3C(O)NH2, v=0
  654885.0010  0.0028 -5.4016 3  101.7066 57  71510 303281019      27 522        syn-C2H3C(O)NH2, v=0
  654902.0717  0.0056 -4.7741 3  636.2359135  71510 303672048      671751        syn-C2H3C(O)NH2, v=0
  654911.1143  0.0061 -4.7820 3  653.4558137  71510 303682049      681752        syn-C2H3C(O)NH2, v=0
  654941.2095  0.0462 -4.2340 3  873.0765111  71510 3035547 8      5546 9        syn-C2H3C(O)NH2, v=0
  654941.2095  0.0462 -4.2340 3  873.0765111  71510 3035547 9      554610        syn-C2H3C(O)NH2, v=0
  654977.9277  0.0240 -4.0716 3 1050.5683177  71510 303881969      872068        syn-C2H3C(O)NH2, v=0
  655005.1566  0.0688 -4.4882 3 1145.5971183  71510 303912269      902368        syn-C2H3C(O)NH2, v=0
  655055.3873  0.0689 -5.3628 3 1750.8287201  71510 303A04852      A04753        syn-C2H3C(O)NH2, v=0
  655055.3873  0.0689 -5.3628 3 1750.8287201  71510 303A04853      A04754        syn-C2H3C(O)NH2, v=0
  655070.4038  0.0464 -4.2540 3  859.7164109  71510 3035447 7      5446 8        syn-C2H3C(O)NH2, v=0
  655070.4038  0.0464 -4.2540 3  859.7164109  71510 3035447 8      5446 9        syn-C2H3C(O)NH2, v=0
  655194.3248  0.0467 -4.2812 3  846.6009107  71510 3035347 6      5346 7        syn-C2H3C(O)NH2, v=0
  655194.3248  0.0467 -4.2812 3  846.6009107  71510 3035347 7      5346 8        syn-C2H3C(O)NH2, v=0
  655313.1353  0.0470 -4.3178 3  833.7301105  71510 3035247 5      5246 6        syn-C2H3C(O)NH2, v=0
  655313.1353  0.0470 -4.3178 3  833.7301105  71510 3035247 6      5246 7        syn-C2H3C(O)NH2, v=0
  655362.9687  0.1851 -5.8153 3 1864.3550253  71510 303C611B5      C610B6        syn-C2H3C(O)NH2, v=0
  655362.9687  0.1851 -5.8153 3 1864.3550253  71510 303C612B5      C611B6        syn-C2H3C(O)NH2, v=0
  655386.0508  0.0060 -5.6583 3   93.8521 57  71510 30328 821      27 324        syn-C2H3C(O)NH2, v=0
  655426.9945  0.0473 -4.3670 3  821.1037103  71510 3035147 4      5146 5        syn-C2H3C(O)NH2, v=0
  655426.9945  0.0473 -4.3670 3  821.1037103  71510 3035147 5      5146 6        syn-C2H3C(O)NH2, v=0
  655536.0587  0.0476 -4.4343 3  808.7217101  71510 3035047 3      5046 4        syn-C2H3C(O)NH2, v=0
  655536.0587  0.0476 -4.4343 3  808.7217101  71510 3035047 4      5046 5        syn-C2H3C(O)NH2, v=0
  655624.7972  0.0675 -5.3186 3 1726.3456199  71510 303994851      994752        syn-C2H3C(O)NH2, v=0
  655624.7972  0.0675 -5.3186 3 1726.3456199  71510 303994852      994753        syn-C2H3C(O)NH2, v=0
  655640.4808  0.0479 -4.5300 3  796.5840 99  71510 3034947 2      4946 3        syn-C2H3C(O)NH2, v=0
  655640.4808  0.0479 -4.5300 3  796.5840 99  71510 3034947 3      4946 4        syn-C2H3C(O)NH2, v=0
  655665.1775  0.0017 -3.1845 3  477.4261117  71510 303581840      571741        syn-C2H3C(O)NH2, v=0
  655705.2490  0.0019 -3.2239 3  492.2879119  71510 303591842      581741        syn-C2H3C(O)NH2, v=0
  655710.5476  0.1652 -5.3388 3 1472.2698233  71510 303B6 5B1      B6 4B2        syn-C2H3C(O)NH2, v=0
  655710.5476  0.1652 -5.3388 3 1472.2698233  71510 303B6 6B1      B6 5B2        syn-C2H3C(O)NH2, v=0
  655740.4104  0.0482 -4.6773 3  784.6905 97  71510 3034847 1      4846 2        syn-C2H3C(O)NH2, v=0
  655740.4104  0.0482 -4.6773 3  784.6905 97  71510 3034847 2      4846 3        syn-C2H3C(O)NH2, v=0
  655835.9941  0.0486 -4.9499 3  773.0411 95  71510 3034747 0      4746 1        syn-C2H3C(O)NH2, v=0
  655835.9941  0.0486 -4.9499 3  773.0411 95  71510 3034747 1      4746 2        syn-C2H3C(O)NH2, v=0
  655861.0052  0.0458 -3.8710 3 1166.4925205  71510 303A2 696      A1 795        syn-C2H3C(O)NH2, v=0
  655861.0052  0.0458 -3.8710 3 1166.4925205  71510 303A2 796      A1 695        syn-C2H3C(O)NH2, v=0
  655863.1193  0.0479 -3.8594 3 1169.6231207  71510 303A3 598      A2 697        syn-C2H3C(O)NH2, v=0
  655863.1193  0.0479 -3.8594 3 1169.6231207  71510 303A3 698      A2 597        syn-C2H3C(O)NH2, v=0
  655869.1775  0.0438 -3.8824 3 1162.8299203  71510 303A1 794      A0 893        syn-C2H3C(O)NH2, v=0
  655869.1775  0.0438 -3.8824 3 1162.8299203  71510 303A1 894      A0 793        syn-C2H3C(O)NH2, v=0
  655871.9946  0.0506 -3.8476 3 1172.2277209  71510 303A4 4A0      A3 599        syn-C2H3C(O)NH2, v=0
  655871.9946  0.0506 -3.8476 3 1172.2277209  71510 303A4 5A0      A3 499        syn-C2H3C(O)NH2, v=0
  655884.7776  0.0538 -3.8354 3 1174.3115211  71510 303A5 3A2      A4 4A1        syn-C2H3C(O)NH2, v=0
  655884.7776  0.0538 -3.8354 3 1174.3115211  71510 303A5 4A2      A4 3A1        syn-C2H3C(O)NH2, v=0
  655892.0365  0.0421 -3.8936 3 1158.6281201  71510 303A0 892      99 991        syn-C2H3C(O)NH2, v=0
  655892.0365  0.0421 -3.8936 3 1158.6281201  71510 303A0 992      99 891        syn-C2H3C(O)NH2, v=0
  655899.1364  0.0578 -3.8228 3 1175.8789213  71510 303A6 2A4      A5 3A3        syn-C2H3C(O)NH2, v=0
  655899.1364  0.0578 -3.8228 3 1175.8789213  71510 303A6 3A4      A5 2A3        syn-C2H3C(O)NH2, v=0
  655913.1486  0.0628 -3.8097 3 1176.9339215  71510 303A7 1A6      A6 2A5        syn-C2H3C(O)NH2, v=0
  655913.1486  0.0628 -3.8097 3 1176.9339215  71510 303A7 2A6      A6 1A5        syn-C2H3C(O)NH2, v=0
  655925.2165  0.0692 -3.7962 3 1177.4798217  71510 303A8 0A8      A7 1A7        syn-C2H3C(O)NH2, v=0
  655925.2165  0.0692 -3.7962 3 1177.4798217  71510 303A8 1A8      A7 0A7        syn-C2H3C(O)NH2, v=0
  655935.1391  0.0404 -3.9048 3 1153.8788199  71510 30399 990      981089        syn-C2H3C(O)NH2, v=0
  655935.1391  0.0404 -3.9048 3 1153.8788199  71510 303991090      98 989        syn-C2H3C(O)NH2, v=0
  656005.5967  0.0388 -3.9162 3 1148.5724197  71510 303981088      971187        syn-C2H3C(O)NH2, v=0
  656005.5967  0.0388 -3.9162 3 1148.5724197  71510 303981188      971087        syn-C2H3C(O)NH2, v=0
  656106.7934  0.1690 -5.5353 3 1664.3157243  71510 303C1 8B3      C1 7B4        syn-C2H3C(O)NH2, v=0
  656106.7934  0.1690 -5.5353 3 1664.3157243  71510 303C1 9B3      C1 8B4        syn-C2H3C(O)NH2, v=0
  656112.6499  0.0372 -3.9279 3 1142.6970195  71510 303971186      961285        syn-C2H3C(O)NH2, v=0
  656112.6499  0.0372 -3.9279 3 1142.6970195  71510 303971286      961185        syn-C2H3C(O)NH2, v=0
  656178.0601  0.0661 -5.2752 3 1702.1130197  71510 303984850      984751        syn-C2H3C(O)NH2, v=0
  656178.0601  0.0661 -5.2752 3 1702.1130197  71510 303984851      984752        syn-C2H3C(O)NH2, v=0
  656199.8285  0.0024 -4.9037 3  319.8504 93  71510 303461828      461531        syn-C2H3C(O)NH2, v=0
  656268.5265  0.0356 -3.9400 3 1136.2388193  71510 303961284      951383        syn-C2H3C(O)NH2, v=0
  656268.5265  0.0356 -3.9400 3 1136.2388193  71510 303961384      951283        syn-C2H3C(O)NH2, v=0
  656299.9587  0.0079 -4.7990 3  663.3192139  71510 303691951      691654        syn-C2H3C(O)NH2, v=0
  656429.0924  0.0201 -5.6768 3  956.2346167  71510 303832162      822161        syn-C2H3C(O)NH2, v=0
  656471.0256  0.0663 -5.2768 3 1073.7989175  71510 303872562      872265        syn-C2H3C(O)NH2, v=0
  656489.7625  0.0341 -3.9530 3 1129.1804191  71510 303951382      941481        syn-C2H3C(O)NH2, v=0
  656489.7625  0.0341 -3.9530 3 1129.1804191  71510 303951482      941381        syn-C2H3C(O)NH2, v=0
  656500.2901  0.0035 -4.7873 3  442.3745111  71510 303551936      551639        syn-C2H3C(O)NH2, v=0
  656533.8254  0.0986 -5.5814 3 1329.1247195  71510 303972770      972473        syn-C2H3C(O)NH2, v=0
  656619.8396  0.0024 -4.9032 3  319.8363 93  71510 303461829      461532        syn-C2H3C(O)NH2, v=0
  656647.3772  0.0052 -4.7700 3  619.2370133  71510 303662047      661750        syn-C2H3C(O)NH2, v=0
  656661.7583  0.0016 -2.9736 3  423.8659107  71510 303532034      521933        syn-C2H3C(O)NH2, v=0
  656663.8255  0.0016 -2.9736 3  423.8659107  71510 303532033      521934        syn-C2H3C(O)NH2, v=0
  656709.9230  0.0145 -4.9151 3  672.3236141  71510 303701753      701456        syn-C2H3C(O)NH2, v=0
  656715.5576  0.0649 -5.2324 3 1678.1309195  71510 303974849      974750        syn-C2H3C(O)NH2, v=0
  656715.5576  0.0649 -5.2324 3 1678.1309195  71510 303974850      974751        syn-C2H3C(O)NH2, v=0
  656799.3280  0.0325 -3.9672 3 1121.5007189  71510 303941480      931579        syn-C2H3C(O)NH2, v=0
  656799.3289  0.0325 -3.9672 3 1121.5007189  71510 303941580      931479        syn-C2H3C(O)NH2, v=0
  656834.4274  0.0417 -4.3054 3 1091.2633179  71510 303892168      882267        syn-C2H3C(O)NH2, v=0
  656850.6445  0.1714 -5.3171 3 1356.5205227  71510 303B3 3B0      B3 2B1        syn-C2H3C(O)NH2, v=0
  656850.6445  0.1714 -5.3171 3 1356.5205227  71510 303B3 4B0      B3 3B1        syn-C2H3C(O)NH2, v=0
  656850.9281  0.0021 -4.4959 3  150.0866 67  71510 303331221      32 924        syn-C2H3C(O)NH2, v=0
  656892.8556  0.0068 -4.7942 3  670.8896139  71510 303692050      691753        syn-C2H3C(O)NH2, v=0
  656939.9711  0.0224 -5.8088 3 1024.8594173  71510 303862265      852264        syn-C2H3C(O)NH2, v=0
  657000.3162  0.0082 -4.8628 3  644.6077135  71510 303672146      671849        syn-C2H3C(O)NH2, v=0
  657113.6981  0.0098 -4.8790 3  613.1440135  71510 303671651      671354        syn-C2H3C(O)NH2, v=0
  657122.7104  0.0065 -5.5749 3  247.7460 87  71510 303431231      43 736        syn-C2H3C(O)NH2, v=0
  657199.6976  0.0030 -2.5647 3  325.5841 63  71510 3033131 0      3030 1        syn-C2H3C(O)NH2, v=0
  657199.6976  0.0030 -2.5647 3  325.5841 63  71510 3033131 1      3030 0        syn-C2H3C(O)NH2, v=0
  657230.2202  0.0310 -3.9831 3 1113.1726187  71510 303931578      921677        syn-C2H3C(O)NH2, v=0
  657230.2419  0.0310 -3.9831 3 1113.1726187  71510 303931678      921577        syn-C2H3C(O)NH2, v=0
  657237.6622  0.0636 -5.1903 3 1654.3991193  71510 303964848      964749        syn-C2H3C(O)NH2, v=0
  657237.6622  0.0636 -5.1903 3 1654.3991193  71510 303964849      964750        syn-C2H3C(O)NH2, v=0
  657380.0199  0.0033 -4.7645 3  456.3467113  71510 303561938      561641        syn-C2H3C(O)NH2, v=0
  657425.6013  0.0023 -5.3032 3   91.2464 49  71510 303241312      231013        syn-C2H3C(O)NH2, v=0
  657433.5924  0.0023 -5.3032 3   91.2462 49  71510 303241311      231014        syn-C2H3C(O)NH2, v=0
  657479.3661  0.0232 -4.0681 3 1050.5172177  71510 303882069      871968        syn-C2H3C(O)NH2, v=0
  657542.6265  0.0044 -4.8748 3  415.9702113  71510 303561344      561047        syn-C2H3C(O)NH2, v=0
  657546.9651  0.1817 -5.5572 3 1243.7194221  71510 303B0 1A9      B0 0B0        syn-C2H3C(O)NH2, v=0
  657546.9651  0.1817 -5.5572 3 1243.7194221  71510 303B0 2A9      B0 1B0        syn-C2H3C(O)NH2, v=0
  657640.2473  0.0024 -2.5843 3  326.9973 67  71510 3033330 3      3229 4        syn-C2H3C(O)NH2, v=0
  657640.2473  0.0024 -2.5843 3  326.9973 67  71510 3033330 4      3229 3        syn-C2H3C(O)NH2, v=0
  657734.1035  0.0274 -4.1611 3 1060.0391177  71510 303882068      872167        syn-C2H3C(O)NH2, v=0
  657744.7373  0.0625 -5.1489 3 1630.9173191  71510 303954847      954748        syn-C2H3C(O)NH2, v=0
  657744.7373  0.0625 -5.1489 3 1630.9173191  71510 303954848      954749        syn-C2H3C(O)NH2, v=0
  657831.8089  0.0295 -4.0015 3 1104.1610185  71510 303921676      911775        syn-C2H3C(O)NH2, v=0
  657832.2768  0.0295 -4.0015 3 1104.1610185  71510 303921776      911675        syn-C2H3C(O)NH2, v=0
  657846.9628  0.0205 -5.7872 3 1015.7152173  71510 303862066      852065        syn-C2H3C(O)NH2, v=0
  657873.5607  0.0037 -3.4022 3  554.5414127  71510 303631846      621745        syn-C2H3C(O)NH2, v=0
  657958.8470  0.1682 -5.4059 3 1543.7059237  71510 303B8 6B2      B8 5B3        syn-C2H3C(O)NH2, v=0
  657958.8470  0.1682 -5.4059 3 1543.7059237  71510 303B8 7B2      B8 6B3        syn-C2H3C(O)NH2, v=0
  657986.4052  0.1760 -5.6375 3 1738.9622247  71510 303C3 9B4      C3 8B5        syn-C2H3C(O)NH2, v=0
  657986.4052  0.1760 -5.6375 3 1738.9622247  71510 303C310B4      C3 9B5        syn-C2H3C(O)NH2, v=0
  658070.2070  0.0021 -2.6061 3  329.8761 71  71510 3033529 6      3428 7        syn-C2H3C(O)NH2, v=0
  658070.2070  0.0021 -2.6061 3  329.8761 71  71510 3033529 7      3428 6        syn-C2H3C(O)NH2, v=0
  658104.1663  0.0046 -4.5799 3  153.0853 77  71510 30338 335      37 236        syn-C2H3C(O)NH2, v=0
  658104.1828  0.0046 -4.5799 3  153.0853 77  71510 30338 435      37 136        syn-C2H3C(O)NH2, v=0
  658237.1376  0.0614 -5.1082 3 1607.6855189  71510 303944846      944747        syn-C2H3C(O)NH2, v=0
  658237.1376  0.0614 -5.1082 3 1607.6855189  71510 303944847      944748        syn-C2H3C(O)NH2, v=0
  658252.9598  0.0016 -2.9083 3  407.0624103  71510 303512131      502030        syn-C2H3C(O)NH2, v=0
  658252.9915  0.0016 -2.9083 3  407.0624103  71510 303512130      502031        syn-C2H3C(O)NH2, v=0
  658480.6319  0.0019 -2.6305 3  334.2273 75  71510 3033728 9      362710        syn-C2H3C(O)NH2, v=0
  658480.6319  0.0019 -2.6305 3  334.2273 75  71510 303372810      3627 9        syn-C2H3C(O)NH2, v=0
  658546.1846  0.0640 -5.7979 3 1493.4932207  71510 303A32875      A32578        syn-C2H3C(O)NH2, v=0
  658633.3785  0.0022 -3.2624 3  507.3558121  71510 303601843      591742        syn-C2H3C(O)NH2, v=0
  658679.6033  0.0280 -4.0237 3 1094.4186183  71510 303911774      901873        syn-C2H3C(O)NH2, v=0
  658688.1162  0.0280 -4.0237 3 1094.4184183  71510 303911874      901773        syn-C2H3C(O)NH2, v=0
  658715.2095  0.0604 -5.0682 3 1584.7033187  71510 303934845      934746        syn-C2H3C(O)NH2, v=0
  658715.2095  0.0604 -5.0682 3 1584.7033187  71510 303934846      934747        syn-C2H3C(O)NH2, v=0
  658858.1223  0.0018 -2.6578 3  340.0594 79  71510 303392712      382613        syn-C2H3C(O)NH2, v=0
  658858.1223  0.0018 -2.6578 3  340.0594 79  71510 303392713      382612        syn-C2H3C(O)NH2, v=0
  658972.2762  0.0055 -4.7984 3  541.0660127  71510 303631648      631351        syn-C2H3C(O)NH2, v=0
  659090.6176  0.0017 -2.8524 3  391.9522 99  71510 303492228      482127        syn-C2H3C(O)NH2, v=0
  659090.6179  0.0017 -2.8524 3  391.9522 99  71510 303492227      482128        syn-C2H3C(O)NH2, v=0
  659092.7352  0.0051 -4.5917 3  158.4459 71  71510 303351025      34 728        syn-C2H3C(O)NH2, v=0
  659179.2915  0.0595 -5.0289 3 1561.9707185  71510 303924844      924745        syn-C2H3C(O)NH2, v=0
  659179.2915  0.0595 -5.0289 3 1561.9707185  71510 303924845      924746        syn-C2H3C(O)NH2, v=0
  659182.7894  0.0018 -2.6883 3  347.3833 83  71510 303412615      402516        syn-C2H3C(O)NH2, v=0
  659182.7894  0.0018 -2.6883 3  347.3833 83  71510 303412616      402515        syn-C2H3C(O)NH2, v=0
  659331.0983  0.1723 -5.3342 3 1425.9948231  71510 303B5 4B1      B5 3B2        syn-C2H3C(O)NH2, v=0
  659331.0983  0.1723 -5.3342 3 1425.9948231  71510 303B5 5B1      B5 4B2        syn-C2H3C(O)NH2, v=0
  659425.1424  0.0017 -2.7224 3  356.2129 87  71510 303432518      422419        syn-C2H3C(O)NH2, v=0
  659425.1424  0.0017 -2.7224 3  356.2129 87  71510 303432519      422418        syn-C2H3C(O)NH2, v=0
  659464.1862  0.0017 -2.8037 3  378.4688 95  71510 303472324      462225        syn-C2H3C(O)NH2, v=0
  659464.1862  0.0017 -2.8037 3  378.4688 95  71510 303472325      462224        syn-C2H3C(O)NH2, v=0
  659493.1140  0.0438 -5.1524 3  956.2346165  71510 303822458      822161        syn-C2H3C(O)NH2, v=0
  659541.1663  0.0017 -2.7606 3  366.5667 91  71510 303452421      442322        syn-C2H3C(O)NH2, v=0
  659541.1663  0.0017 -2.7606 3  366.5667 91  71510 303452422      442321        syn-C2H3C(O)NH2, v=0
  659629.7143  0.0586 -4.9903 3 1539.4875183  71510 303914843      914744        syn-C2H3C(O)NH2, v=0
  659629.7143  0.0586 -4.9903 3 1539.4875183  71510 303914844      914745        syn-C2H3C(O)NH2, v=0
  659738.5343  0.1845 -5.7478 3 1814.8696251  71510 303C510B5      C5 9B6        syn-C2H3C(O)NH2, v=0
  659738.5343  0.1845 -5.7478 3 1814.8696251  71510 303C511B5      C510B6        syn-C2H3C(O)NH2, v=0
  659859.3307  0.0267 -4.0519 3 1083.8787181  71510 303901872      891971        syn-C2H3C(O)NH2, v=0
  659889.9798  0.0048 -4.7691 3  602.4670131  71510 303652046      651749        syn-C2H3C(O)NH2, v=0
  659942.1183  0.0016 -3.0773 3  456.2613113  71510 303561938      551837        syn-C2H3C(O)NH2, v=0
  659987.9007  0.0266 -4.0518 3 1083.8760181  71510 303901972      891871        syn-C2H3C(O)NH2, v=0
  659997.4019  0.0049 -5.5777 3  229.6079 89  71510 30344 638      44 341        syn-C2H3C(O)NH2, v=0
  660000.4898  0.0049 -5.5777 3  229.6079 89  71510 30344 738      44 441        syn-C2H3C(O)NH2, v=0
  660066.8012  0.0577 -4.9525 3 1517.2534181  71510 303904842      904743        syn-C2H3C(O)NH2, v=0
  660066.8012  0.0577 -4.9525 3 1517.2534181  71510 303904843      904744        syn-C2H3C(O)NH2, v=0
  660078.2764  0.0031 -3.3515 3  538.4712125  71510 303621845      611744        syn-C2H3C(O)NH2, v=0
  660086.8133  0.1725 -5.4881 3 1616.4164241  71510 303C0 7B3      C0 6B4        syn-C2H3C(O)NH2, v=0
  660086.8133  0.1725 -5.4881 3 1616.4164241  71510 303C0 8B3      C0 7B4        syn-C2H3C(O)NH2, v=0
  660104.1869  0.0016 -3.0771 3  456.2567113  71510 303561937      551838        syn-C2H3C(O)NH2, v=0
  660217.0295  0.0025 -3.3049 3  522.7461123  71510 303611844      601743        syn-C2H3C(O)NH2, v=0
  660249.6491  0.1808 -5.3939 3 1311.2152225  71510 303B2 2B0      B2 1B1        syn-C2H3C(O)NH2, v=0
  660249.6491  0.1808 -5.3939 3 1311.2152225  71510 303B2 3B0      B2 2B1        syn-C2H3C(O)NH2, v=0
  660397.4302  0.0041 -4.9386 3  381.7976109  71510 303541143      54 846        syn-C2H3C(O)NH2, v=0
  660483.2710  0.0023 -4.9360 3  308.3001 91  71510 303451827      451530        syn-C2H3C(O)NH2, v=0
  660490.8682  0.0569 -4.9153 3 1495.2684179  71510 303894841      894742        syn-C2H3C(O)NH2, v=0
  660490.8682  0.0569 -4.9153 3 1495.2684179  71510 303894842      894743        syn-C2H3C(O)NH2, v=0
  660557.0801  0.0279 -5.7848 3 1012.3780171  71510 303852362      842361        syn-C2H3C(O)NH2, v=0
  660712.4085  0.0023 -4.9357 3  308.2925 91  71510 303451828      451531        syn-C2H3C(O)NH2, v=0
  660833.4888  0.0029 -3.7160 3  247.7485 89  71510 30344 935      43 836        syn-C2H3C(O)NH2, v=0
  660902.2245  0.0562 -4.8790 3 1473.5323177  71510 303884840      884741        syn-C2H3C(O)NH2, v=0
  660902.2245  0.0562 -4.8790 3 1473.5323177  71510 303884841      884742        syn-C2H3C(O)NH2, v=0
  661013.1385  0.0077 -4.8108 3  688.5314141  71510 303702051      701754        syn-C2H3C(O)NH2, v=0
  661044.1882  0.0256 -4.0914 3 1072.4483179  71510 303891970      882069        syn-C2H3C(O)NH2, v=0
  661101.5921  0.0968 -5.2475 3 1028.7983173  71510 303862264      861967        syn-C2H3C(O)NH2, v=0
  661102.6572  0.0031 -4.3764 3  171.4707 73  71510 303361125      35 828        syn-C2H3C(O)NH2, v=0
  661301.1727  0.0555 -4.8433 3 1452.0449175  71510 303874839      874740        syn-C2H3C(O)NH2, v=0
  661301.1727  0.0555 -4.8433 3 1452.0449175  71510 303874840      874741        syn-C2H3C(O)NH2, v=0
  661317.1898  0.0142 -4.9443 3  741.5945145  71510 303722250      721953        syn-C2H3C(O)NH2, v=0
  661398.8624  0.0047 -5.3941 3  104.6195 59  71510 30329 921      28 424        syn-C2H3C(O)NH2, v=0
  661465.0773  0.0257 -5.7250 3  983.7030169  71510 303842262      832261        syn-C2H3C(O)NH2, v=0
  661656.9028  0.0048 -5.2387 3  303.7188 95  71510 303471433      47 938        syn-C2H3C(O)NH2, v=0
  661660.3291  0.0025 -3.8321 3  263.0918 89  71510 303441332      431033        syn-C2H3C(O)NH2, v=0
  661688.0086  0.0549 -4.8085 3 1430.8060173  71510 303864838      864739        syn-C2H3C(O)NH2, v=0
  661688.0086  0.0549 -4.8085 3 1430.8060173  71510 303864839      864740        syn-C2H3C(O)NH2, v=0
  661695.5889  0.1743 -5.3821 3 1496.7521235  71510 303B7 5B2      B7 4B3        syn-C2H3C(O)NH2, v=0
  661695.5889  0.1743 -5.3821 3 1496.7521235  71510 303B7 6B2      B7 5B3        syn-C2H3C(O)NH2, v=0
  661704.5142  0.0258 -5.0416 3  845.4827155  71510 303772354      772057        syn-C2H3C(O)NH2, v=0
  661789.8818  0.0166 -3.9082 3  840.3527157  71510 303782059      771958        syn-C2H3C(O)NH2, v=0
  661872.0104  0.0488 -3.9038 3 1188.3697207  71510 303A3 697      A2 796        syn-C2H3C(O)NH2, v=0
  661872.0104  0.0488 -3.9038 3 1188.3697207  71510 303A3 797      A2 696        syn-C2H3C(O)NH2, v=0
  661874.9049  0.0511 -3.8924 3 1191.5004209  71510 303A4 599      A3 698        syn-C2H3C(O)NH2, v=0
  661874.9049  0.0511 -3.8924 3 1191.5004209  71510 303A4 699      A3 598        syn-C2H3C(O)NH2, v=0
  661879.0303  0.0467 -3.9149 3 1184.7073205  71510 303A2 795      A1 894        syn-C2H3C(O)NH2, v=0
  661879.0303  0.0467 -3.9149 3 1184.7073205  71510 303A2 895      A1 794        syn-C2H3C(O)NH2, v=0
  661884.2898  0.0539 -3.8807 3 1194.1053211  71510 303A5 4A1      A4 5A0        syn-C2H3C(O)NH2, v=0
  661884.2898  0.0539 -3.8807 3 1194.1053211  71510 303A5 5A1      A4 4A0        syn-C2H3C(O)NH2, v=0
  661897.3862  0.0572 -3.8687 3 1196.1894213  71510 303A6 3A3      A5 4A2        syn-C2H3C(O)NH2, v=0
  661897.3862  0.0572 -3.8687 3 1196.1894213  71510 303A6 4A3      A5 3A2        syn-C2H3C(O)NH2, v=0
  661900.2255  0.0449 -3.9259 3 1180.5063203  71510 303A1 893      A0 992        syn-C2H3C(O)NH2, v=0
  661900.2255  0.0449 -3.9259 3 1180.5063203  71510 303A1 993      A0 892        syn-C2H3C(O)NH2, v=0
  661911.9169  0.0615 -3.8563 3 1197.7573215  71510 303A7 2A5      A6 3A4        syn-C2H3C(O)NH2, v=0
  661911.9169  0.0615 -3.8563 3 1197.7573215  71510 303A7 3A5      A6 2A4        syn-C2H3C(O)NH2, v=0
  661926.0003  0.0667 -3.8434 3 1198.8128217  71510 303A8 1A7      A7 2A6        syn-C2H3C(O)NH2, v=0
  661926.0003  0.0667 -3.8434 3 1198.8128217  71510 303A8 2A7      A7 1A6        syn-C2H3C(O)NH2, v=0
  661933.8913  0.0027 -3.6628 3  264.2768 91  71510 303451135      44 836        syn-C2H3C(O)NH2, v=0
  661938.0684  0.0733 -3.8300 3 1199.3591219  71510 303A9 0A9      A8 1A8        syn-C2H3C(O)NH2, v=0
  661938.0684  0.0733 -3.8300 3 1199.3591219  71510 303A9 1A9      A8 0A8        syn-C2H3C(O)NH2, v=0
  661940.9600  0.0431 -3.9368 3 1175.7585201  71510 303A0 991      991090        syn-C2H3C(O)NH2, v=0
  661940.9600  0.0431 -3.9368 3 1175.7585201  71510 303A01091      99 990        syn-C2H3C(O)NH2, v=0
  662008.0736  0.0414 -3.9479 3 1170.4544199  71510 303991089      981188        syn-C2H3C(O)NH2, v=0
  662008.0736  0.0414 -3.9479 3 1170.4544199  71510 303991189      981088        syn-C2H3C(O)NH2, v=0
  662050.5385  0.0040 -4.9369 3  381.7977109  71510 303541243      54 946        syn-C2H3C(O)NH2, v=0
  662063.0222  0.0543 -4.7744 3 1409.8156171  71510 303854837      854738        syn-C2H3C(O)NH2, v=0
  662063.0222  0.0543 -4.7744 3 1409.8156171  71510 303854838      854739        syn-C2H3C(O)NH2, v=0
  662092.5655  0.1782 -5.5819 3 1690.3967245  71510 303C2 8B4      C2 7B5        syn-C2H3C(O)NH2, v=0
  662092.5655  0.1782 -5.5819 3 1690.3967245  71510 303C2 9B4      C2 8B5        syn-C2H3C(O)NH2, v=0
  662110.4186  0.0397 -3.9592 3 1164.5826197  71510 303981187      971286        syn-C2H3C(O)NH2, v=0
  662110.4186  0.0397 -3.9592 3 1164.5826197  71510 303981287      971186        syn-C2H3C(O)NH2, v=0
  662115.9118  0.0018 -3.2172 3  492.1176119  71510 303591841      581742        syn-C2H3C(O)NH2, v=0
  662244.0306  0.0041 -4.3099 3  168.2170 79  71510 30339 435      38 336        syn-C2H3C(O)NH2, v=0
  662244.2506  0.0041 -4.3099 3  168.2170 79  71510 30339 535      38 236        syn-C2H3C(O)NH2, v=0
  662259.6553  0.0381 -3.9709 3 1158.1295195  71510 303971285      961384        syn-C2H3C(O)NH2, v=0
  662259.6553  0.0381 -3.9709 3 1158.1295195  71510 303971385      961284        syn-C2H3C(O)NH2, v=0
  662426.4970  0.0538 -4.7411 3 1389.0734169  71510 303844836      844737        syn-C2H3C(O)NH2, v=0
  662426.4970  0.0538 -4.7411 3 1389.0734169  71510 303844837      844738        syn-C2H3C(O)NH2, v=0
  662451.4607  0.0092 -3.7012 3  699.0489143  71510 303711953      701852        syn-C2H3C(O)NH2, v=0
  662460.6911  0.4343 -5.7096 3 1660.4056219  71510 303A92881      A82980        syn-C2H3C(O)NH2, v=0
  662471.4672  0.0364 -3.9834 3 1151.0785193  71510 303961383      951482        syn-C2H3C(O)NH2, v=0
  662471.4672  0.0364 -3.9834 3 1151.0785193  71510 303961483      951382        syn-C2H3C(O)NH2, v=0
  662485.2062  0.0020 -4.4419 3  158.3887 69  71510 303341222      33 925        syn-C2H3C(O)NH2, v=0
  662510.7422  0.0029 -3.9137 3  251.9405 87  71510 303431331      421032        syn-C2H3C(O)NH2, v=0
  662615.9379  0.0251 -4.0892 3 1072.4160179  71510 303892070      881969        syn-C2H3C(O)NH2, v=0
  662767.4983  0.0348 -3.9970 3 1143.4091191  71510 303951481      941580        syn-C2H3C(O)NH2, v=0
  662767.4987  0.0348 -3.9970 3 1143.4091191  71510 303951581      941480        syn-C2H3C(O)NH2, v=0
  662778.7109  0.0533 -4.7086 3 1368.5793167  71510 303834835      834736        syn-C2H3C(O)NH2, v=0
  662778.7109  0.0533 -4.7086 3 1368.5793167  71510 303834836      834737        syn-C2H3C(O)NH2, v=0
  662840.2346  0.1807 -5.3584 3 1380.0026229  71510 303B4 3B1      B4 2B2        syn-C2H3C(O)NH2, v=0
  662840.2346  0.1807 -5.3584 3 1380.0026229  71510 303B4 4B1      B4 3B2        syn-C2H3C(O)NH2, v=0
  663119.9361  0.0529 -4.6769 3 1348.3331165  71510 303824834      824735        syn-C2H3C(O)NH2, v=0
  663119.9361  0.0529 -4.6769 3 1348.3331165  71510 303824835      824736        syn-C2H3C(O)NH2, v=0
  663132.1885  0.0205 -5.7087 3  978.1307169  71510 303842163      832162        syn-C2H3C(O)NH2, v=0
  663178.5921  0.0332 -4.0121 3 1135.0954189  71510 303941579      931678        syn-C2H3C(O)NH2, v=0
  663178.6040  0.0332 -4.0121 3 1135.0954189  71510 303941679      931578        syn-C2H3C(O)NH2, v=0
  663217.2707  0.0050 -4.8050 3  538.4712123  71510 303612041      611744        syn-C2H3C(O)NH2, v=0
  663295.7782  0.0016 -2.9947 3  437.0696109  71510 303542035      531934        syn-C2H3C(O)NH2, v=0
  663299.9709  0.0016 -2.9947 3  437.0695109  71510 303542034      531935        syn-C2H3C(O)NH2, v=0
  663366.8820  0.0025 -3.6395 3  280.9151 93  71510 303461235      45 936        syn-C2H3C(O)NH2, v=0
  663410.7275  0.0042 -5.3844 3  257.5205 93  71510 30346 739      46 442        syn-C2H3C(O)NH2, v=0
  663423.9606  0.0042 -5.3844 3  257.5205 93  71510 30346 839      46 542        syn-C2H3C(O)NH2, v=0
  663429.5048  0.0023 -5.2080 3   97.1874 51  71510 303251313      241014        syn-C2H3C(O)NH2, v=0
  663448.3053  0.0023 -5.2080 3   97.1867 51  71510 303251312      241015        syn-C2H3C(O)NH2, v=0
  663450.4392  0.0525 -4.6461 3 1328.3347163  71510 303814833      814734        syn-C2H3C(O)NH2, v=0
  663450.4392  0.0525 -4.6461 3 1328.3347163  71510 303814834      814735        syn-C2H3C(O)NH2, v=0
  663545.0347  0.1912 -5.5964 3 1266.2003223  71510 303B1 1B0      B1 0B1        syn-C2H3C(O)NH2, v=0
  663545.0347  0.1912 -5.5964 3 1266.2003223  71510 303B1 2B0      B1 1B1        syn-C2H3C(O)NH2, v=0
  663613.7087  0.0032 -4.7802 3  442.1368111  71510 303551937      551640        syn-C2H3C(O)NH2, v=0
  663750.4780  0.0316 -4.0296 3 1126.1039187  71510 303931677      921776        syn-C2H3C(O)NH2, v=0
  663750.7415  0.0316 -4.0296 3 1126.1039187  71510 303931777      921676        syn-C2H3C(O)NH2, v=0
  663770.4815  0.0522 -4.6162 3 1308.5840161  71510 303804832      804733        syn-C2H3C(O)NH2, v=0
  663770.4815  0.0522 -4.6162 3 1308.5840161  71510 303804833      804734        syn-C2H3C(O)NH2, v=0
  663773.0389  0.0023 -3.7637 3  274.4117 91  71510 303451333      441034        syn-C2H3C(O)NH2, v=0
  663942.4740  0.1774 -5.4505 3 1568.7880239  71510 303B9 6B3      B9 5B4        syn-C2H3C(O)NH2, v=0
  663942.4740  0.1774 -5.4505 3 1568.7880239  71510 303B9 7B3      B9 6B4        syn-C2H3C(O)NH2, v=0
  663974.1084  0.1855 -5.6854 3 1765.6423249  71510 303C4 9B5      C4 8B6        syn-C2H3C(O)NH2, v=0
  663974.1084  0.1855 -5.6854 3 1765.6423249  71510 303C410B5      C4 9B6        syn-C2H3C(O)NH2, v=0
  664017.6759  0.0888 -5.7724 3 1466.7696205  71510 303A22874      A22577        syn-C2H3C(O)NH2, v=0
  664032.0620  0.0054 -3.5981 3  364.5115105  71510 303521339      511240        syn-C2H3C(O)NH2, v=0
  664080.3191  0.0519 -4.5871 3 1289.0808159  71510 303794831      794732        syn-C2H3C(O)NH2, v=0
  664080.3191  0.0519 -4.5871 3 1289.0808159  71510 303794832      794733        syn-C2H3C(O)NH2, v=0
  664321.6573  0.0037 -5.0154 3  348.8552105  71510 303521042      52 745        syn-C2H3C(O)NH2, v=0
  664350.0507  0.0046 -4.7710 3  585.9338129  71510 303642045      641748        syn-C2H3C(O)NH2, v=0
  664363.1431  0.0022 -4.9705 3  297.0228 89  71510 303441826      441529        syn-C2H3C(O)NH2, v=0
  664380.2030  0.0516 -4.5589 3 1269.8249157  71510 303784830      784731        syn-C2H3C(O)NH2, v=0
  664380.2030  0.0516 -4.5589 3 1269.8249157  71510 303784831      784732        syn-C2H3C(O)NH2, v=0
  664384.2154  0.1027 -4.6719 3 1224.8829189  71510 303942371      932470        syn-C2H3C(O)NH2, v=0
  664464.7074  0.0029 -2.5722 3  333.1225 65  71510 3033231 1      3130 2        syn-C2H3C(O)NH2, v=0
  664464.7074  0.0029 -2.5722 3  333.1225 65  71510 3033231 2      3130 1        syn-C2H3C(O)NH2, v=0
  664485.3946  0.0022 -4.9703 3  297.0187 89  71510 303441827      441530        syn-C2H3C(O)NH2, v=0
  664553.1597  0.0301 -4.0505 3 1116.3899185  71510 303921775      911874        syn-C2H3C(O)NH2, v=0
  664558.0896  0.0301 -4.0505 3 1116.3898185  71510 303921875      911774        syn-C2H3C(O)NH2, v=0
  664559.4205  0.0027 -3.7127 3  247.7460 89  71510 303441035      43 736        syn-C2H3C(O)NH2, v=0
  664660.5388  0.0027 -3.3504 3  500.5754121  71510 303601743      591644        syn-C2H3C(O)NH2, v=0
  664670.3794  0.0513 -4.5316 3 1250.8163155  71510 303774829      774730        syn-C2H3C(O)NH2, v=0
  664670.3794  0.0513 -4.5316 3 1250.8163155  71510 303774830      774731        syn-C2H3C(O)NH2, v=0
  664856.5515  0.0895 -5.7716 3 1977.4177217  71510 303A84959      A84860        syn-C2H3C(O)NH2, v=0
  664856.5515  0.0895 -5.7716 3 1977.4177217  71510 303A84960      A84861        syn-C2H3C(O)NH2, v=0
  664886.9517  0.0037 -5.0148 3  348.8553105  71510 303521142      52 845        syn-C2H3C(O)NH2, v=0
  664902.7877  0.0024 -2.5923 3  335.0284 69  71510 3033430 4      3329 5        syn-C2H3C(O)NH2, v=0
  664902.7877  0.0024 -2.5923 3  335.0284 69  71510 3033430 5      3329 4        syn-C2H3C(O)NH2, v=0
  664951.0896  0.0511 -4.5053 3 1232.0548153  71510 303764828      764729        syn-C2H3C(O)NH2, v=0
  664951.0896  0.0511 -4.5053 3 1232.0548153  71510 303764829      764730        syn-C2H3C(O)NH2, v=0
  665107.0052  0.0016 -2.9269 3  419.7046105  71510 303522132      512031        syn-C2H3C(O)NH2, v=0
  665107.0757  0.0016 -2.9269 3  419.7046105  71510 303522131      512032        syn-C2H3C(O)NH2, v=0
  665179.3918  0.0053 -4.8658 3  465.4406119  71510 303591346      591049        syn-C2H3C(O)NH2, v=0
  665222.5704  0.0510 -4.4800 3 1213.5403151  71510 303754827      754728        syn-C2H3C(O)NH2, v=0
  665222.5704  0.0510 -4.4800 3 1213.5403151  71510 303754828      754729        syn-C2H3C(O)NH2, v=0
  665278.9282  0.0032 -4.8020 3  428.3469109  71510 303541935      541638        syn-C2H3C(O)NH2, v=0
  665317.2774  0.1817 -5.3767 3 1450.0772233  71510 303B6 4B2      B6 3B3        syn-C2H3C(O)NH2, v=0
  665317.2774  0.1817 -5.3767 3 1450.0772233  71510 303B6 5B2      B6 4B3        syn-C2H3C(O)NH2, v=0
  665327.9020  0.0021 -2.6148 3  338.4019 73  71510 3033629 7      3528 8        syn-C2H3C(O)NH2, v=0
  665327.9020  0.0021 -2.6148 3  338.4019 73  71510 3033629 8      3528 7        syn-C2H3C(O)NH2, v=0
  665414.3469  0.0036 -4.1204 3  183.6280 81  71510 30340 535      39 436        syn-C2H3C(O)NH2, v=0
  665415.5215  0.0037 -5.2328 3  286.7060 97  71510 30348 840      48 543        syn-C2H3C(O)NH2, v=0
  665416.6325  0.0036 -4.1204 3  183.6280 81  71510 30340 635      39 336        syn-C2H3C(O)NH2, v=0
  665466.3845  0.0037 -5.2328 3  286.7060 97  71510 30348 940      48 643        syn-C2H3C(O)NH2, v=0
  665485.0538  0.0508 -4.4558 3 1195.2726149  71510 303744826      744727        syn-C2H3C(O)NH2, v=0
  665485.0538  0.0508 -4.4558 3 1195.2726149  71510 303744827      744728        syn-C2H3C(O)NH2, v=0
  665530.8303  0.0874 -5.7224 3 1950.9461215  71510 303A74958      A74859        syn-C2H3C(O)NH2, v=0
  665530.8303  0.0874 -5.7224 3 1950.9461215  71510 303A74959      A74860        syn-C2H3C(O)NH2, v=0
  665546.4484  0.0280 -4.1726 3 1082.1749179  71510 303892069      882168        syn-C2H3C(O)NH2, v=0
  665647.3144  0.0051 -4.8233 3  502.6565123  71510 303611547      611250        syn-C2H3C(O)NH2, v=0
  665678.1842  0.0286 -4.0769 3 1105.8909183  71510 303911873      901972        syn-C2H3C(O)NH2, v=0
  665729.3237  0.1942 -5.7970 3 1842.1487253  71510 303C610B6      C6 9B7        syn-C2H3C(O)NH2, v=0
  665729.3237  0.1942 -5.7970 3 1842.1487253  71510 303C611B6      C610B7        syn-C2H3C(O)NH2, v=0
  665730.1130  0.0019 -2.6400 3  343.2501 77  71510 303382810      372711        syn-C2H3C(O)NH2, v=0
  665730.1130  0.0019 -2.6400 3  343.2501 77  71510 303382811      372710        syn-C2H3C(O)NH2, v=0
  665738.7676  0.0507 -4.4326 3 1177.2516147  71510 303734825      734726        syn-C2H3C(O)NH2, v=0
  665738.7676  0.0507 -4.4326 3 1177.2516147  71510 303734826      734727        syn-C2H3C(O)NH2, v=0
  665755.1116  0.0286 -4.0768 3 1105.8893183  71510 303911973      901872        syn-C2H3C(O)NH2, v=0
  665820.0925  0.0035 -5.1120 3  317.1544101  71510 30350 941      50 644        syn-C2H3C(O)NH2, v=0
  665886.2885  0.0033 -4.0032 3  240.9746 85  71510 303421330      411031        syn-C2H3C(O)NH2, v=0
  665983.9352  0.0507 -4.4105 3 1159.4771145  71510 303724824      724725        syn-C2H3C(O)NH2, v=0
  665983.9352  0.0507 -4.4105 3 1159.4771145  71510 303724825      724726        syn-C2H3C(O)NH2, v=0
  665997.4542  0.0035 -5.1118 3  317.1544101  71510 303501041      50 744        syn-C2H3C(O)NH2, v=0
  666020.9382  0.0017 -3.1034 3  470.3293115  71510 303571939      561838        syn-C2H3C(O)NH2, v=0
  666070.0162  0.1819 -5.5339 3 1642.0980243  71510 303C1 7B4      C1 6B5        syn-C2H3C(O)NH2, v=0
  666070.0162  0.1819 -5.5339 3 1642.0980243  71510 303C1 8B4      C1 7B5        syn-C2H3C(O)NH2, v=0
  666082.8920  0.0017 -2.8691 3  404.0511101  71510 303502229      492128        syn-C2H3C(O)NH2, v=0
  666082.8928  0.0017 -2.8691 3  404.0511101  71510 303502228      492129        syn-C2H3C(O)NH2, v=0
  666094.6536  0.0018 -2.6681 3  349.5821 81  71510 303402713      392614        syn-C2H3C(O)NH2, v=0
  666094.6536  0.0018 -2.6681 3  349.5821 81  71510 303402714      392613        syn-C2H3C(O)NH2, v=0
  666186.9139  0.0854 -5.6739 3 1924.7261213  71510 303A64957      A64858        syn-C2H3C(O)NH2, v=0
  666186.9139  0.0854 -5.6739 3 1924.7261213  71510 303A64958      A64859        syn-C2H3C(O)NH2, v=0
  666220.7758  0.0506 -4.3895 3 1141.9492143  71510 303714823      714724        syn-C2H3C(O)NH2, v=0
  666220.7758  0.0506 -4.3895 3 1141.9492143  71510 303714824      714725        syn-C2H3C(O)NH2, v=0
  666242.5154  0.1904 -5.4344 3 1334.2971227  71510 303B3 2B1      B3 1B2        syn-C2H3C(O)NH2, v=0
  666242.5154  0.1904 -5.4344 3 1334.2971227  71510 303B3 3B1      B3 2B2        syn-C2H3C(O)NH2, v=0
  666285.9794  0.0028 -3.7815 3  231.3856 87  71510 30343 835      42 736        syn-C2H3C(O)NH2, v=0
  666316.2239  0.0017 -3.1031 3  470.3211115  71510 303571938      561839        syn-C2H3C(O)NH2, v=0
  666399.7227  0.0018 -2.6996 3  357.4095 85  71510 303422616      412517        syn-C2H3C(O)NH2, v=0
  666399.7227  0.0018 -2.6996 3  357.4095 85  71510 303422617      412516        syn-C2H3C(O)NH2, v=0
  666449.5045  0.0506 -4.3698 3 1124.6675141  71510 303704822      704723        syn-C2H3C(O)NH2, v=0
  666449.5045  0.0506 -4.3698 3 1124.6675141  71510 303704823      704724        syn-C2H3C(O)NH2, v=0
  666491.6486  0.2097 -5.7699 3 1458.1614205  71510 303A22775      A22478        syn-C2H3C(O)NH2, v=0
  666547.8515  0.0017 -2.8187 3  390.0374 97  71510 303482325      472226        syn-C2H3C(O)NH2, v=0
  666547.8515  0.0017 -2.8187 3  390.0374 97  71510 303482326      472225        syn-C2H3C(O)NH2, v=0
  666613.0979  0.0018 -2.7348 3  366.7471 89  71510 303442519      432420        syn-C2H3C(O)NH2, v=0
  666613.0979  0.0018 -2.7348 3  366.7471 89  71510 303442520      432419        syn-C2H3C(O)NH2, v=0
  666670.3323  0.0506 -4.3513 3 1107.6320139  71510 303694821      694722        syn-C2H3C(O)NH2, v=0
  666670.3323  0.0506 -4.3513 3 1107.6320139  71510 303694822      694723        syn-C2H3C(O)NH2, v=0
  666686.7477  0.0017 -2.7743 3  377.6145 93  71510 303462422      452323        syn-C2H3C(O)NH2, v=0
  666686.7477  0.0017 -2.7743 3  377.6145 93  71510 303462423      452322        syn-C2H3C(O)NH2, v=0
  666825.2274  0.0835 -5.6260 3 1898.7576211  71510 303A54956      A54857        syn-C2H3C(O)NH2, v=0
  666825.2274  0.0835 -5.6260 3 1898.7576211  71510 303A54957      A54858        syn-C2H3C(O)NH2, v=0
  666883.4662  0.0507 -4.3343 3 1090.8427137  71510 303684820      684721        syn-C2H3C(O)NH2, v=0
  666883.4662  0.0507 -4.3343 3 1090.8427137  71510 303684821      684722        syn-C2H3C(O)NH2, v=0
  666983.5796  0.0274 -4.1129 3 1094.5185181  71510 303901971      892070        syn-C2H3C(O)NH2, v=0
  667002.4131  0.2108 -5.6602 3 1371.5556199  71510 303992673      992376        syn-C2H3C(O)NH2, v=0
  667061.2639  0.0027 -3.7808 3  231.3853 87  71510 30343 935      42 636        syn-C2H3C(O)NH2, v=0
  667089.1095  0.0508 -4.3186 3 1074.2993135  71510 303674819      674720        syn-C2H3C(O)NH2, v=0
  667089.1095  0.0508 -4.3186 3 1074.2993135  71510 303674820      674721        syn-C2H3C(O)NH2, v=0
  667255.9817  0.0031 -5.3246 3  108.5428 59  71510 303291020      28 523        syn-C2H3C(O)NH2, v=0
  667287.4616  0.0509 -4.3045 3 1058.0017133  71510 303664818      664719        syn-C2H3C(O)NH2, v=0
  667287.4616  0.0509 -4.3045 3 1058.0017133  71510 303664819      664720        syn-C2H3C(O)NH2, v=0
  667374.8252  0.0088 -4.8320 3  706.3761143  71510 303712052      711755        syn-C2H3C(O)NH2, v=0
  667415.2509  0.0032 -3.9782 3  199.3043 83  71510 30341 635      40 536        syn-C2H3C(O)NH2, v=0
  667434.4842  0.0032 -3.9782 3  199.3043 83  71510 30341 735      40 436        syn-C2H3C(O)NH2, v=0
  667446.1850  0.0817 -5.5787 3 1873.0402209  71510 303A44955      A44856        syn-C2H3C(O)NH2, v=0
  667446.1850  0.0817 -5.5787 3 1873.0402209  71510 303A44956      A44857        syn-C2H3C(O)NH2, v=0
  667478.7182  0.0510 -4.2920 3 1041.9499131  71510 303654817      654718        syn-C2H3C(O)NH2, v=0
  667478.7182  0.0510 -4.2920 3 1041.9499131  71510 303654818      654719        syn-C2H3C(O)NH2, v=0
  667663.0713  0.0511 -4.2814 3 1026.1437129  71510 303644816      644717        syn-C2H3C(O)NH2, v=0
  667663.0713  0.0511 -4.2814 3 1026.1437129  71510 303644817      644718        syn-C2H3C(O)NH2, v=0
  667679.2541  0.1837 -5.4259 3 1521.4345237  71510 303B8 5B3      B8 4B4        syn-C2H3C(O)NH2, v=0
  667679.2541  0.1837 -5.4259 3 1521.4345237  71510 303B8 6B3      B8 5B4        syn-C2H3C(O)NH2, v=0
  667840.7093  0.0513 -4.2727 3 1010.5830127  71510 303634815      634716        syn-C2H3C(O)NH2, v=0
  667840.7093  0.0513 -4.2727 3 1010.5830127  71510 303634816      634717        syn-C2H3C(O)NH2, v=0
  667882.1633  0.0519 -3.9371 3 1210.4474209  71510 303A4 698      A3 797        syn-C2H3C(O)NH2, v=0
  667882.1633  0.0519 -3.9371 3 1210.4474209  71510 303A4 798      A3 697        syn-C2H3C(O)NH2, v=0
  667885.8173  0.0544 -3.9259 3 1213.5782211  71510 303A5 5A0      A4 699        syn-C2H3C(O)NH2, v=0
  667885.8173  0.0544 -3.9259 3 1213.5782211  71510 303A5 6A0      A4 599        syn-C2H3C(O)NH2, v=0
  667888.0643  0.0497 -3.9480 3 1206.7852207  71510 303A3 796      A2 895        syn-C2H3C(O)NH2, v=0
  667888.0643  0.0497 -3.9480 3 1206.7852207  71510 303A3 896      A2 795        syn-C2H3C(O)NH2, v=0
  667893.0553  0.0022 -5.0074 3  286.0157 87  71510 303431825      431528        syn-C2H3C(O)NH2, v=0
  667895.6997  0.0573 -3.9144 3 1216.1833213  71510 303A6 4A2      A5 5A1        syn-C2H3C(O)NH2, v=0
  667895.6997  0.0573 -3.9144 3 1216.1833213  71510 303A6 5A2      A5 4A1        syn-C2H3C(O)NH2, v=0
  667907.6491  0.0478 -3.9587 3 1202.5849205  71510 303A2 894      A1 993        syn-C2H3C(O)NH2, v=0
  667907.6491  0.0478 -3.9587 3 1202.5849205  71510 303A2 994      A1 893        syn-C2H3C(O)NH2, v=0
  667909.1027  0.0609 -3.9026 3 1218.2679215  71510 303A7 3A4      A6 4A3        syn-C2H3C(O)NH2, v=0
  667909.1027  0.0609 -3.9026 3 1218.2679215  71510 303A7 4A4      A6 3A3        syn-C2H3C(O)NH2, v=0
  667919.4672  0.3522 -5.4951 3 1568.0767213  71510 303A62779      A52878        syn-C2H3C(O)NH2, v=0
  667923.8021  0.0653 -3.8903 3 1219.8363217  71510 303A8 2A6      A7 3A5        syn-C2H3C(O)NH2, v=0
  667923.8021  0.0653 -3.8903 3 1219.8363217  71510 303A8 3A6      A7 2A5        syn-C2H3C(O)NH2, v=0
  667924.6505  0.0029 -3.8679 3  215.2299 85  71510 30342 735      41 636        syn-C2H3C(O)NH2, v=0
  667937.9550  0.0708 -3.8775 3 1220.8922219  71510 303A9 1A8      A8 2A7        syn-C2H3C(O)NH2, v=0
  667937.9550  0.0708 -3.8775 3 1220.8922219  71510 303A9 2A8      A8 1A7        syn-C2H3C(O)NH2, v=0
  667946.0981  0.0459 -3.9694 3 1197.8384203  71510 303A1 992      A01091        syn-C2H3C(O)NH2, v=0
  667946.0981  0.0459 -3.9694 3 1197.8384203  71510 303A11092      A0 991        syn-C2H3C(O)NH2, v=0
  667950.0227  0.0777 -3.8643 3 1221.4390221  71510 303B0 0B0      A9 1A9        syn-C2H3C(O)NH2, v=0
  667950.0227  0.0777 -3.8643 3 1221.4390221  71510 303B0 1B0      A9 0A9        syn-C2H3C(O)NH2, v=0
  667956.8272  0.0022 -5.0073 3  286.0135 87  71510 303431826      431529        syn-C2H3C(O)NH2, v=0
  667962.5459  0.0271 -4.1116 3 1094.4984181  71510 303902071      891970        syn-C2H3C(O)NH2, v=0
  668009.9946  0.0441 -3.9801 3 1192.5366201  71510 303A01090      991189        syn-C2H3C(O)NH2, v=0
  668009.9946  0.0441 -3.9801 3 1192.5366201  71510 303A01190      991089        syn-C2H3C(O)NH2, v=0
  668011.8173  0.0514 -4.2661 3  995.2677125  71510 303624814      624715        syn-C2H3C(O)NH2, v=0
  668011.8173  0.0514 -4.2661 3  995.2677125  71510 303624815      624716        syn-C2H3C(O)NH2, v=0
  668050.1899  0.0799 -5.5321 3 1847.5739207  71510 303A34954      A34855        syn-C2H3C(O)NH2, v=0
  668050.1899  0.0799 -5.5321 3 1847.5739207  71510 303A34955      A34856        syn-C2H3C(O)NH2, v=0
  668058.4036  0.0029 -3.8677 3  215.2299 85  71510 30342 835      41 536        syn-C2H3C(O)NH2, v=0
  668076.3762  0.1878 -5.6290 3 1716.6775247  71510 303C3 8B5      C3 7B6        syn-C2H3C(O)NH2, v=0
  668076.3762  0.1878 -5.6290 3 1716.6775247  71510 303C3 9B5      C3 8B6        syn-C2H3C(O)NH2, v=0
  668107.8259  0.0424 -3.9910 3 1186.6682199  71510 303991188      981287        syn-C2H3C(O)NH2, v=0
  668107.8259  0.0424 -3.9910 3 1186.6682199  71510 303991288      981187        syn-C2H3C(O)NH2, v=0
  668176.5766  0.0516 -4.2619 3  980.1977123  71510 303614813      614714        syn-C2H3C(O)NH2, v=0
  668176.5766  0.0516 -4.2619 3  980.1977123  71510 303614814      614715        syn-C2H3C(O)NH2, v=0
  668250.7216  0.0406 -4.0024 3 1180.2201197  71510 303981286      971385        syn-C2H3C(O)NH2, v=0
  668250.7216  0.0406 -4.0024 3 1180.2201197  71510 303981386      971285        syn-C2H3C(O)NH2, v=0
  668335.1653  0.0518 -4.2603 3  965.3728121  71510 303604812      604713        syn-C2H3C(O)NH2, v=0
  668335.1653  0.0518 -4.2603 3  965.3728121  71510 303604813      604714        syn-C2H3C(O)NH2, v=0
  668453.5737  0.0389 -4.0144 3 1173.1762195  71510 303971384      961483        syn-C2H3C(O)NH2, v=0
  668453.5737  0.0389 -4.0144 3 1173.1762195  71510 303971484      961383        syn-C2H3C(O)NH2, v=0
  668487.7580  0.0521 -4.2618 3  950.7931119  71510 303594811      594712        syn-C2H3C(O)NH2, v=0
  668487.7580  0.0521 -4.2618 3  950.7931119  71510 303594812      594713        syn-C2H3C(O)NH2, v=0
  668497.4035  0.0076 -4.8183 3  638.1903137  71510 303681851      681554        syn-C2H3C(O)NH2, v=0
  668634.5262  0.0523 -4.2667 3  936.4583117  71510 303584810      584711        syn-C2H3C(O)NH2, v=0
  668634.5262  0.0523 -4.2667 3  936.4583117  71510 303584811      584712        syn-C2H3C(O)NH2, v=0
  668637.6353  0.0783 -5.4862 3 1822.3583205  71510 303A24953      A24854        syn-C2H3C(O)NH2, v=0
  668637.6353  0.0783 -5.4862 3 1822.3583205  71510 303A24954      A24855        syn-C2H3C(O)NH2, v=0
  668727.8582  0.0210 -5.7432 3 1000.2505171  71510 303852164      842163        syn-C2H3C(O)NH2, v=0
  668736.8055  0.0372 -4.0274 3 1165.5167193  71510 303961482      951581        syn-C2H3C(O)NH2, v=0
  668736.8058  0.0372 -4.0274 3 1165.5167193  71510 303961582      951481        syn-C2H3C(O)NH2, v=0
  668775.6378  0.0526 -4.2756 3  922.3685115  71510 3035748 9      574710        syn-C2H3C(O)NH2, v=0
  668775.6378  0.0526 -4.2756 3  922.3685115  71510 303574810      574711        syn-C2H3C(O)NH2, v=0
  668828.7173  0.1904 -5.4001 3 1403.6851231  71510 303B5 3B2      B5 2B3        syn-C2H3C(O)NH2, v=0
  668828.7173  0.1904 -5.4001 3 1403.6851231  71510 303B5 4B2      B5 3B3        syn-C2H3C(O)NH2, v=0
  668911.2578  0.0529 -4.2894 3  908.5234113  71510 3035648 8      5647 9        syn-C2H3C(O)NH2, v=0
  668911.2578  0.0529 -4.2894 3  908.5234113  71510 3035648 9      564710        syn-C2H3C(O)NH2, v=0
  668964.7388  0.0019 -3.2521 3  507.0844121  71510 303601842      591743        syn-C2H3C(O)NH2, v=0
  668977.3100  0.0021 -4.3941 3  166.9310 71  71510 303351223      34 926        syn-C2H3C(O)NH2, v=0
  669003.0730  0.0022 -3.7113 3  285.8915 93  71510 303461334      451035        syn-C2H3C(O)NH2, v=0
  669041.5477  0.0531 -4.3089 3  894.9230111  71510 3035548 7      5547 8        syn-C2H3C(O)NH2, v=0
  669041.5477  0.0531 -4.3089 3  894.9230111  71510 3035548 8      5547 9        syn-C2H3C(O)NH2, v=0
  669044.0250  0.0089 -4.8298 3  680.7318141  71510 303701952      701655        syn-C2H3C(O)NH2, v=0
  669053.5242  0.0392 -4.3021 3 1113.8257181  71510 303902169      892268        syn-C2H3C(O)NH2, v=0
  669129.2982  0.0355 -4.0418 3 1157.2167191  71510 303951580      941679        syn-C2H3C(O)NH2, v=0
  669129.3047  0.0355 -4.0418 3 1157.2167191  71510 303951680      941579        syn-C2H3C(O)NH2, v=0
  669131.3347  0.0036 -5.2853 3  297.5305 93  71510 303461531      461036        syn-C2H3C(O)NH2, v=0
  669166.6660  0.0534 -4.3357 3  881.5672109  71510 3035448 6      5447 7        syn-C2H3C(O)NH2, v=0
  669166.6660  0.0534 -4.3357 3  881.5672109  71510 3035448 7      5447 8        syn-C2H3C(O)NH2, v=0
  669208.9044  0.0767 -5.4409 3 1797.3935203  71510 303A14952      A14853        syn-C2H3C(O)NH2, v=0
  669208.9044  0.0767 -5.4409 3 1797.3935203  71510 303A14953      A14854        syn-C2H3C(O)NH2, v=0
  669228.9434  0.0022 -5.1188 3  103.3874 53  71510 303261314      251015        syn-C2H3C(O)NH2, v=0
  669271.2430  0.0022 -5.1187 3  103.3860 53  71510 303261313      251016        syn-C2H3C(O)NH2, v=0
  669286.7682  0.0538 -4.3718 3  868.4559107  71510 3035348 5      5347 6        syn-C2H3C(O)NH2, v=0
  669286.7682  0.0538 -4.3718 3  868.4559107  71510 3035348 6      5347 7        syn-C2H3C(O)NH2, v=0
  669402.0066  0.0541 -4.4206 3  855.5889105  71510 3035248 4      5247 5        syn-C2H3C(O)NH2, v=0
  669402.0066  0.0541 -4.4206 3  855.5889105  71510 3035248 5      5247 6        syn-C2H3C(O)NH2, v=0
  669512.5302  0.0544 -4.4874 3  842.9664103  71510 3035148 3      5147 4        syn-C2H3C(O)NH2, v=0
  669512.5302  0.0544 -4.4874 3  842.9664103  71510 3035148 4      5147 5        syn-C2H3C(O)NH2, v=0
  669542.1843  0.2012 -5.6360 3 1288.8817225  71510 303B2 1B1      B2 0B2        syn-C2H3C(O)NH2, v=0
  669542.1843  0.2012 -5.6360 3 1288.8817225  71510 303B2 2B1      B2 1B2        syn-C2H3C(O)NH2, v=0
  669618.4854  0.0547 -4.5827 3  830.5880101  71510 3035048 2      5047 3        syn-C2H3C(O)NH2, v=0
  669618.4854  0.0547 -4.5827 3  830.5880101  71510 3035048 3      5047 4        syn-C2H3C(O)NH2, v=0
  669664.7924  0.0739 -5.1814 3  955.7931167  71510 303832162      831865        syn-C2H3C(O)NH2, v=0
  669673.4849  0.0338 -4.0584 3 1148.2443189  71510 303941678      931777        syn-C2H3C(O)NH2, v=0
  669673.6327  0.0338 -4.0584 3 1148.2443189  71510 303941778      931677        syn-C2H3C(O)NH2, v=0
  669693.7720  0.0030 -4.7974 3  428.1994109  71510 303541936      541639        syn-C2H3C(O)NH2, v=0
  669720.0154  0.0551 -4.7296 3  818.4538 99  71510 3034948 1      4947 2        syn-C2H3C(O)NH2, v=0
  669720.0154  0.0551 -4.7296 3  818.4538 99  71510 3034948 2      4947 3        syn-C2H3C(O)NH2, v=0
  669741.5922  0.0043 -4.7753 3  569.6457127  71510 303632044      631747        syn-C2H3C(O)NH2, v=0
  669764.3710  0.0753 -5.3963 3 1772.6790201  71510 303A04951      A04852        syn-C2H3C(O)NH2, v=0
  669764.3710  0.0753 -5.3963 3 1772.6790201  71510 303A04952      A04853        syn-C2H3C(O)NH2, v=0
  669817.2603  0.0554 -5.0017 3  806.5636 97  71510 3034848 0      4847 1        syn-C2H3C(O)NH2, v=0
  669817.2603  0.0554 -5.0017 3  806.5636 97  71510 3034848 1      4847 2        syn-C2H3C(O)NH2, v=0
  669850.2521  0.0037 -5.2347 3  309.3331 95  71510 303471532      471037        syn-C2H3C(O)NH2, v=0
  669866.4812  0.0016 -3.0168 3  450.5382111  71510 303552036      541935        syn-C2H3C(O)NH2, v=0
  669874.8307  0.0016 -3.0168 3  450.5380111  71510 303552035      541936        syn-C2H3C(O)NH2, v=0
  669924.5560  0.1871 -5.4956 3 1594.0701241  71510 303C0 6B4      C0 5B5        syn-C2H3C(O)NH2, v=0
  669924.5560  0.1871 -5.4956 3 1594.0701241  71510 303C0 7B4      C0 6B5        syn-C2H3C(O)NH2, v=0
  669959.6042  0.1953 -5.7338 3 1792.5221251  71510 303C5 9B6      C5 8B7        syn-C2H3C(O)NH2, v=0
  669959.6042  0.1953 -5.7338 3 1792.5221251  71510 303C510B6      C5 9B7        syn-C2H3C(O)NH2, v=0
  670168.9247  0.1482 -4.8671 3 1306.7703195  71510 303972473      962572        syn-C2H3C(O)NH2, v=0
  670304.3998  0.0739 -5.3524 3 1748.2149199  71510 303994950      994851        syn-C2H3C(O)NH2, v=0
  670304.3998  0.0739 -5.3524 3 1748.2149199  71510 303994951      994852        syn-C2H3C(O)NH2, v=0
  670434.0862  0.0322 -4.0782 3 1138.5571187  71510 303931776      921875        syn-C2H3C(O)NH2, v=0
  670436.9272  0.0322 -4.0782 3 1138.5570187  71510 303931876      921775        syn-C2H3C(O)NH2, v=0
  670829.3467  0.0725 -5.3092 3 1724.0008197  71510 303984949      984850        syn-C2H3C(O)NH2, v=0
  670829.3467  0.0725 -5.3092 3 1724.0008197  71510 303984950      984851        syn-C2H3C(O)NH2, v=0
  670950.6993  0.0224 -4.1228 3 1037.6586175  71510 303872167      862066        syn-C2H3C(O)NH2, v=0
  671037.8854  0.0220 -4.1062 3 1015.7152173  71510 303862166      852065        syn-C2H3C(O)NH2, v=0
  671051.7936  0.0033 -3.6764 3  275.1467 93  71510 303461036      45 937        syn-C2H3C(O)NH2, v=0
  671114.1171  0.0021 -5.0467 3  275.2766 85  71510 303421824      421527        syn-C2H3C(O)NH2, v=0
  671127.9279  0.0036 -4.0942 3  230.2171 83  71510 303411329      401030        syn-C2H3C(O)NH2, v=0
  671146.6294  0.0021 -5.0467 3  275.2755 85  71510 303421825      421528        syn-C2H3C(O)NH2, v=0
  671302.2237  0.1914 -5.4198 3 1474.3599235  71510 303B7 4B3      B7 3B4        syn-C2H3C(O)NH2, v=0
  671302.2237  0.1914 -5.4198 3 1474.3599235  71510 303B7 5B3      B7 4B4        syn-C2H3C(O)NH2, v=0
  671303.8595  0.0053 -5.0315 3  145.8247 77  71510 30338 236      37 137        syn-C2H3C(O)NH2, v=0
  671303.8599  0.0053 -5.0315 3  145.8247 77  71510 30338 336      37 037        syn-C2H3C(O)NH2, v=0
  671332.7845  0.0270 -5.7519 3 1005.7671171  71510 303852263      842262        syn-C2H3C(O)NH2, v=0
  671339.5593  0.0713 -5.2666 3 1700.0366195  71510 303974948      974849        syn-C2H3C(O)NH2, v=0
  671339.5593  0.0713 -5.2666 3 1700.0366195  71510 303974949      974850        syn-C2H3C(O)NH2, v=0
  671487.2542  0.2748 -5.2816 3 1478.3634207  71510 303A32677      A22776        syn-C2H3C(O)NH2, v=0
  671502.5470  0.0307 -4.1029 3 1128.0965185  71510 303921874      911973        syn-C2H3C(O)NH2, v=0
  671513.7518  0.0046 -3.4556 3  479.3740119  71510 303591643      581544        syn-C2H3C(O)NH2, v=0
  671548.2956  0.0307 -4.1028 3 1128.0955185  71510 303921974      911873        syn-C2H3C(O)NH2, v=0
  671641.4563  0.1957 -5.5635 3 1287.4727193  71510 303962571      962274        syn-C2H3C(O)NH2, v=0
  671728.3737  0.0029 -2.5801 3  340.9056 67  71510 3033331 2      3230 3        syn-C2H3C(O)NH2, v=0
  671728.3737  0.0029 -2.5801 3  340.9056 67  71510 3033331 3      3230 2        syn-C2H3C(O)NH2, v=0
  671792.2018  0.0036 -5.3581 3  285.8915 91  71510 303451530      451035        syn-C2H3C(O)NH2, v=0
  671835.3770  0.0701 -5.2247 3 1676.3222193  71510 303964947      964848        syn-C2H3C(O)NH2, v=0
  671835.3770  0.0701 -5.2247 3 1676.3222193  71510 303964948      964849        syn-C2H3C(O)NH2, v=0
  671920.8325  0.0016 -2.9464 3  432.6067107  71510 303532133      522032        syn-C2H3C(O)NH2, v=0
  671920.9858  0.0016 -2.9464 3  432.6067107  71510 303532132      522033        syn-C2H3C(O)NH2, v=0
  671925.0802  0.0017 -3.1310 3  484.6734117  71510 303581940      571839        syn-C2H3C(O)NH2, v=0
  672051.4829  0.1917 -5.5803 3 1667.9795245  71510 303C2 7B5      C2 6B6        syn-C2H3C(O)NH2, v=0
  672051.4829  0.1917 -5.5803 3 1667.9795245  71510 303C2 8B5      C2 7B6        syn-C2H3C(O)NH2, v=0
  672163.3252  0.0023 -2.6008 3  343.3049 71  71510 3033530 5      3429 6        syn-C2H3C(O)NH2, v=0
  672163.3252  0.0023 -2.6008 3  343.3049 71  71510 3033530 6      3429 5        syn-C2H3C(O)NH2, v=0
  672234.3737  0.2004 -5.4753 3 1357.5793229  71510 303B4 2B2      B4 1B3        syn-C2H3C(O)NH2, v=0
  672234.3737  0.2004 -5.4753 3 1357.5793229  71510 303B4 3B2      B4 2B3        syn-C2H3C(O)NH2, v=0
  672317.1316  0.0690 -5.1836 3 1652.8573191  71510 303954946      954847        syn-C2H3C(O)NH2, v=0
  672317.1316  0.0690 -5.1836 3 1652.8573191  71510 303954947      954848        syn-C2H3C(O)NH2, v=0
  672353.7611  0.0048 -4.8588 3  465.4410119  71510 303591446      591149        syn-C2H3C(O)NH2, v=0
  672425.5213  0.2059 -5.0713 3 1391.2625201  71510 303A02575      992674        syn-C2H3C(O)NH2, v=0
  672453.5717  0.0017 -3.1304 3  484.6588117  71510 303581939      571840        syn-C2H3C(O)NH2, v=0
  672483.7225  0.0048 -3.6325 3  333.5377101  71510 303501238      491139        syn-C2H3C(O)NH2, v=0
  672490.2268  0.0235 -4.1404 3 1059.7430177  71510 303882168      872067        syn-C2H3C(O)NH2, v=0
  672506.2651  0.0063 -4.8205 3  596.8047133  71510 303661750      661453        syn-C2H3C(O)NH2, v=0
  672549.1175  0.0629 -4.4703 3 1168.7605185  71510 303922270      912369        syn-C2H3C(O)NH2, v=0
  672551.9008  0.0162 -3.8835 3  820.1366155  71510 303772058      761957        syn-C2H3C(O)NH2, v=0
  672582.7117  0.0020 -2.6240 3  347.1737 75  71510 3033729 8      3628 9        syn-C2H3C(O)NH2, v=0
  672582.7117  0.0020 -2.6240 3  347.1737 75  71510 3033729 9      3628 8        syn-C2H3C(O)NH2, v=0
  672630.5265  0.0292 -4.1880 3 1104.5033181  71510 303902070      892169        syn-C2H3C(O)NH2, v=0
  672785.1473  0.0679 -5.1431 3 1629.6419189  71510 303944945      944846        syn-C2H3C(O)NH2, v=0
  672785.1473  0.0679 -5.1431 3 1629.6419189  71510 303944946      944847        syn-C2H3C(O)NH2, v=0
  672848.4581  0.0293 -4.1359 3 1116.7792183  71510 303911972      902071        syn-C2H3C(O)NH2, v=0
  672853.7266  0.0030 -4.8190 3  414.6256107  71510 303531934      531637        syn-C2H3C(O)NH2, v=0
  672975.5360  0.0019 -2.6500 3  352.5198 79  71510 303392811      382712        syn-C2H3C(O)NH2, v=0
  672975.5360  0.0019 -2.6500 3  352.5198 79  71510 303392812      382711        syn-C2H3C(O)NH2, v=0
  673047.5194  0.0017 -2.8865 3  416.4066103  71510 303512230      502129        syn-C2H3C(O)NH2, v=0
  673047.5213  0.0017 -2.8865 3  416.4066103  71510 303512229      502130        syn-C2H3C(O)NH2, v=0
  673152.2043  0.0225 -4.0903 3  993.9031171  71510 303852165      842064        syn-C2H3C(O)NH2, v=0
  673239.7411  0.0669 -5.1033 3 1606.6757187  71510 303934944      934845        syn-C2H3C(O)NH2, v=0
  673239.7411  0.0669 -5.1033 3 1606.6757187  71510 303934945      934846        syn-C2H3C(O)NH2, v=0
  673325.5711  0.0018 -2.6790 3  359.3526 83  71510 303412714      402615        syn-C2H3C(O)NH2, v=0
  673325.5711  0.0018 -2.6790 3  359.3526 83  71510 303412715      402614        syn-C2H3C(O)NH2, v=0
  673331.1445  0.0082 -3.6541 3  680.5888141  71510 303701952      691851        syn-C2H3C(O)NH2, v=0
  673387.6397  0.0218 -5.7795 3 1022.5568173  71510 303862165      852164        syn-C2H3C(O)NH2, v=0
  673453.2733  0.0291 -4.1351 3 1116.7667183  71510 303912072      901971        syn-C2H3C(O)NH2, v=0
  673608.9698  0.0018 -2.7115 3  367.6846 87  71510 303432617      422518        syn-C2H3C(O)NH2, v=0
  673608.9698  0.0018 -2.7115 3  367.6846 87  71510 303432618      422517        syn-C2H3C(O)NH2, v=0
  673611.8229  0.0017 -2.8345 3  401.8600 99  71510 303492326      482227        syn-C2H3C(O)NH2, v=0
  673611.8229  0.0017 -2.8345 3  401.8600 99  71510 303492327      482226        syn-C2H3C(O)NH2, v=0
  673661.5413  0.1936 -5.4702 3 1546.3170239  71510 303B9 5B4      B9 4B5        syn-C2H3C(O)NH2, v=0
  673661.5413  0.1936 -5.4702 3 1546.3170239  71510 303B9 6B4      B9 5B5        syn-C2H3C(O)NH2, v=0
  673681.2229  0.0660 -5.0642 3 1583.9586185  71510 303924943      924844        syn-C2H3C(O)NH2, v=0
  673681.2229  0.0660 -5.0642 3 1583.9586185  71510 303924944      924845        syn-C2H3C(O)NH2, v=0
  673790.5777  0.0018 -2.7478 3  377.5315 91  71510 303452520      442421        syn-C2H3C(O)NH2, v=0
  673790.5777  0.0018 -2.7478 3  377.5315 91  71510 303452521      442420        syn-C2H3C(O)NH2, v=0
  673818.0296  0.0017 -2.7886 3  388.9141 95  71510 303472423      462324        syn-C2H3C(O)NH2, v=0
  673818.0296  0.0017 -2.7886 3  388.9141 95  71510 303472424      462323        syn-C2H3C(O)NH2, v=0
  673879.1730  0.0040 -5.2047 3  321.3057 97  71510 303481533      481038        syn-C2H3C(O)NH2, v=0
  673891.4535  0.0552 -3.9709 3 1232.7255211  71510 303A5 699      A4 798        syn-C2H3C(O)NH2, v=0
  673891.4535  0.0552 -3.9709 3 1232.7255211  71510 303A5 799      A4 698        syn-C2H3C(O)NH2, v=0
  673895.8475  0.0578 -3.9600 3 1235.8564213  71510 303A6 5A1      A5 6A0        syn-C2H3C(O)NH2, v=0
  673895.8475  0.0578 -3.9600 3 1235.8564213  71510 303A6 6A1      A5 5A0        syn-C2H3C(O)NH2, v=0
  673896.2679  0.0529 -3.9816 3 1229.0636209  71510 303A4 797      A3 896        syn-C2H3C(O)NH2, v=0
  673896.2679  0.0529 -3.9816 3 1229.0636209  71510 303A4 897      A3 796        syn-C2H3C(O)NH2, v=0
  673906.2157  0.0609 -3.9487 3 1238.4619215  71510 303A7 4A3      A6 5A2        syn-C2H3C(O)NH2, v=0
  673906.2157  0.0609 -3.9487 3 1238.4619215  71510 303A7 5A3      A6 4A2        syn-C2H3C(O)NH2, v=0
  673914.2927  0.0508 -3.9921 3 1224.8639207  71510 303A3 895      A2 994        syn-C2H3C(O)NH2, v=0
  673914.2927  0.0508 -3.9921 3 1224.8639207  71510 303A3 995      A2 894        syn-C2H3C(O)NH2, v=0
  673919.9188  0.0647 -3.9370 3 1240.5470217  71510 303A8 3A5      A7 4A4        syn-C2H3C(O)NH2, v=0
  673919.9188  0.0647 -3.9370 3 1240.5470217  71510 303A8 4A5      A7 3A4        syn-C2H3C(O)NH2, v=0
  673934.7835  0.0693 -3.9249 3 1242.1159219  71510 303A9 2A7      A8 3A6        syn-C2H3C(O)NH2, v=0
  673934.7835  0.0693 -3.9249 3 1242.1159219  71510 303A9 3A7      A8 2A6        syn-C2H3C(O)NH2, v=0
  673949.0046  0.0751 -3.9123 3 1243.1723221  71510 303B0 1A9      A9 2A8        syn-C2H3C(O)NH2, v=0
  673949.0046  0.0751 -3.9123 3 1243.1723221  71510 303B0 2A9      A9 1A8        syn-C2H3C(O)NH2, v=0
  673950.5346  0.0489 -4.0025 3 1220.1187205  71510 303A2 993      A11092        syn-C2H3C(O)NH2, v=0
  673950.5346  0.0489 -4.0025 3 1220.1187205  71510 303A21093      A1 992        syn-C2H3C(O)NH2, v=0
  673961.0712  0.0823 -3.8991 3 1243.7194223  71510 303B1 0B1      B0 1B0        syn-C2H3C(O)NH2, v=0
  673961.0712  0.0823 -3.8991 3 1243.7194223  71510 303B1 1B1      B0 0B0        syn-C2H3C(O)NH2, v=0
  674011.3339  0.0470 -4.0129 3 1214.8190203  71510 303A11091      A01190        syn-C2H3C(O)NH2, v=0
  674011.3339  0.0470 -4.0129 3 1214.8190203  71510 303A11191      A01090        syn-C2H3C(O)NH2, v=0
  674023.1055  0.0055 -3.5250 3  444.1816115  71510 303571542      561443        syn-C2H3C(O)NH2, v=0
  674058.2354  0.1978 -5.6767 3 1743.1581249  71510 303C4 8B6      C4 7B7        syn-C2H3C(O)NH2, v=0
  674058.2354  0.1978 -5.6767 3 1743.1581249  71510 303C4 9B6      C4 8B7        syn-C2H3C(O)NH2, v=0
  674058.8144  0.0021 -5.0887 3  264.8036 83  71510 303411823      411526        syn-C2H3C(O)NH2, v=0
  674075.0051  0.0021 -5.0887 3  264.8030 83  71510 303411824      411527        syn-C2H3C(O)NH2, v=0
  674104.8344  0.0451 -4.0235 3 1208.9539201  71510 303A01189      991288        syn-C2H3C(O)NH2, v=0
  674104.8344  0.0451 -4.0235 3 1208.9539201  71510 303A01289      991188        syn-C2H3C(O)NH2, v=0
  674109.8960  0.0651 -5.0259 3 1561.4903183  71510 303914942      914843        syn-C2H3C(O)NH2, v=0
  674109.8960  0.0651 -5.0259 3 1561.4903183  71510 303914943      914844        syn-C2H3C(O)NH2, v=0
  674241.6689  0.0433 -4.0345 3 1202.5106199  71510 303991287      981386        syn-C2H3C(O)NH2, v=0
  674241.6689  0.0433 -4.0345 3 1202.5106199  71510 303991387      981286        syn-C2H3C(O)NH2, v=0
  674435.9934  0.0415 -4.0460 3 1195.4734197  71510 303981385      971484        syn-C2H3C(O)NH2, v=0
  674435.9934  0.0415 -4.0460 3 1195.4734197  71510 303981485      971384        syn-C2H3C(O)NH2, v=0
  674526.0573  0.0643 -4.9883 3 1539.2709181  71510 303904941      904842        syn-C2H3C(O)NH2, v=0
  674526.0573  0.0643 -4.9883 3 1539.2709181  71510 303904942      904843        syn-C2H3C(O)NH2, v=0
  674707.1056  0.0397 -4.0585 3 1187.8233195  71510 303971483      961582        syn-C2H3C(O)NH2, v=0
  674707.1057  0.0397 -4.0585 3 1187.8233195  71510 303971583      961482        syn-C2H3C(O)NH2, v=0
  674791.3001  0.0022 -5.0348 3  109.8486 55  71510 303271315      261016        syn-C2H3C(O)NH2, v=0
  674816.0864  0.2005 -5.4423 3 1427.5678233  71510 303B6 3B3      B6 2B4        syn-C2H3C(O)NH2, v=0
  674816.0864  0.2005 -5.4423 3 1427.5678233  71510 303B6 4B3      B6 3B4        syn-C2H3C(O)NH2, v=0
  674882.5918  0.0022 -5.0347 3  109.8455 55  71510 303271314      261017        syn-C2H3C(O)NH2, v=0
  674929.9970  0.0636 -4.9514 3 1517.3000179  71510 303894940      894841        syn-C2H3C(O)NH2, v=0
  674929.9970  0.0636 -4.9514 3 1517.3000179  71510 303894941      894842        syn-C2H3C(O)NH2, v=0
  675082.0946  0.0379 -4.0722 3 1179.5364193  71510 303961581      951680        syn-C2H3C(O)NH2, v=0
  675082.0982  0.0379 -4.0722 3 1179.5364193  71510 303961681      951580        syn-C2H3C(O)NH2, v=0
  675111.4778  0.0059 -4.8680 3  517.5547125  71510 303621448      621151        syn-C2H3C(O)NH2, v=0
  675122.3349  0.1203 -5.5806 3 1303.6930193  71510 303962769      962472        syn-C2H3C(O)NH2, v=0
  675229.5836  0.0046 -4.9089 3  429.4332115  71510 303571245      57 948        syn-C2H3C(O)NH2, v=0
  675268.0775  0.0251 -4.1593 3 1081.9787179  71510 303892169      882068        syn-C2H3C(O)NH2, v=0
  675321.9997  0.0629 -4.9153 3 1495.5776177  71510 303884939      884840        syn-C2H3C(O)NH2, v=0
  675321.9997  0.0629 -4.9153 3 1495.5776177  71510 303884940      884841        syn-C2H3C(O)NH2, v=0
  675333.2378  0.0040 -3.6522 3  303.7472 97  71510 303481137      471038        syn-C2H3C(O)NH2, v=0
  675528.1432  0.0029 -4.8161 3  414.5363107  71510 303531935      531638        syn-C2H3C(O)NH2, v=0
  675538.4063  0.2116 -5.6762 3 1311.7635227  71510 303B3 1B2      B3 0B3        syn-C2H3C(O)NH2, v=0
  675538.4063  0.2116 -5.6762 3 1311.7635227  71510 303B3 2B2      B3 1B3        syn-C2H3C(O)NH2, v=0
  675573.6422  0.0071 -4.8624 3  627.1295133  71510 303662145      661848        syn-C2H3C(O)NH2, v=0
  675600.4085  0.0362 -4.0880 3 1170.5822191  71510 303951679      941778        syn-C2H3C(O)NH2, v=0
  675600.4911  0.0362 -4.0880 3 1170.5822191  71510 303951779      941678        syn-C2H3C(O)NH2, v=0
  675702.3439  0.0622 -4.8800 3 1474.1035175  71510 303874938      874839        syn-C2H3C(O)NH2, v=0
  675702.3439  0.0622 -4.8800 3 1474.1035175  71510 303874939      874840        syn-C2H3C(O)NH2, v=0
  675788.2295  0.0041 -4.7814 3  553.6103125  71510 303622043      621746        syn-C2H3C(O)NH2, v=0
  675905.0943  0.1971 -5.5412 3 1619.5522243  71510 303C1 6B5      C1 5B6        syn-C2H3C(O)NH2, v=0
  675905.0943  0.1971 -5.5412 3 1619.5522243  71510 303C1 7B5      C1 6B6        syn-C2H3C(O)NH2, v=0
  675942.9078  0.2055 -5.7827 3 1819.6016253  71510 303C6 9B7      C6 8B8        syn-C2H3C(O)NH2, v=0
  675942.9078  0.2055 -5.7827 3 1819.6016253  71510 303C610B7      C6 9B8        syn-C2H3C(O)NH2, v=0
  676011.5669  0.0101 -4.8578 3  724.4200145  71510 303722053      721756        syn-C2H3C(O)NH2, v=0
  676071.3024  0.0616 -4.8454 3 1452.8776173  71510 303864937      864838        syn-C2H3C(O)NH2, v=0
  676071.3024  0.0616 -4.8454 3 1452.8776173  71510 303864938      864839        syn-C2H3C(O)NH2, v=0
  676262.2542  0.0044 -4.8098 3  522.7461121  71510 303602040      601743        syn-C2H3C(O)NH2, v=0
  676312.1522  0.0047 -4.5852 3  161.0687 79  71510 30339 336      38 237        syn-C2H3C(O)NH2, v=0
  676312.1605  0.0047 -4.5852 3  161.0687 79  71510 30339 436      38 137        syn-C2H3C(O)NH2, v=0
  676321.8345  0.0345 -4.1067 3 1160.9204189  71510 303941777      931876        syn-C2H3C(O)NH2, v=0
  676323.4641  0.0345 -4.1067 3 1160.9203189  71510 303941877      931776        syn-C2H3C(O)NH2, v=0
  676366.9427  0.0016 -3.0399 3  464.2730113  71510 303562037      551936        syn-C2H3C(O)NH2, v=0
  676383.2746  0.0016 -3.0399 3  464.2726113  71510 303562036      551937        syn-C2H3C(O)NH2, v=0
  676429.1424  0.0611 -4.8117 3 1431.8996171  71510 303854936      854837        syn-C2H3C(O)NH2, v=0
  676429.1424  0.0611 -4.8117 3 1431.8996171  71510 303854937      854838        syn-C2H3C(O)NH2, v=0
  676473.9819  0.0021 -3.2898 3  522.3245123  71510 303611843      601744        syn-C2H3C(O)NH2, v=0
  676610.7307  0.1297 -5.7595 3 1440.1628203  71510 303A12873      A12576        syn-C2H3C(O)NH2, v=0
  676633.0173  0.0021 -4.3541 3  175.7066 73  71510 303361224      35 927        syn-C2H3C(O)NH2, v=0
  676753.6247  0.0020 -5.1334 3  254.5951 81  71510 303401822      401525        syn-C2H3C(O)NH2, v=0
  676761.4950  0.0020 -5.1333 3  254.5948 81  71510 303401823      401526        syn-C2H3C(O)NH2, v=0
  676776.1258  0.0606 -4.7787 3 1411.1695169  71510 303844935      844836        syn-C2H3C(O)NH2, v=0
  676776.1258  0.0606 -4.7787 3 1411.1695169  71510 303844936      844837        syn-C2H3C(O)NH2, v=0
  677112.5095  0.0602 -4.7465 3 1390.6872167  71510 303834934      834835        syn-C2H3C(O)NH2, v=0
  677112.5095  0.0602 -4.7465 3 1390.6872167  71510 303834935      834836        syn-C2H3C(O)NH2, v=0
  677234.5233  0.0022 -3.6748 3  297.5305 95  71510 303471335      461036        syn-C2H3C(O)NH2, v=0
  677285.9327  0.2016 -5.4633 3 1498.8427237  71510 303B8 4B4      B8 3B5        syn-C2H3C(O)NH2, v=0
  677285.9327  0.2016 -5.4633 3 1498.8427237  71510 303B8 5B4      B8 4B5        syn-C2H3C(O)NH2, v=0
  677334.5090  0.0329 -4.1298 3 1150.4959187  71510 303931875      921974        syn-C2H3C(O)NH2, v=0
  677361.5585  0.0328 -4.1297 3 1150.4954187  71510 303931975      921874        syn-C2H3C(O)NH2, v=0
  677438.5450  0.0597 -4.7152 3 1370.4524165  71510 303824933      824834        syn-C2H3C(O)NH2, v=0
  677438.5450  0.0597 -4.7152 3 1370.4524165  71510 303824934      824835        syn-C2H3C(O)NH2, v=0
  677455.4420  0.0037 -4.1811 3  219.6943 81  71510 303401328      391029        syn-C2H3C(O)NH2, v=0
  677487.7110  0.0949 -5.4236 3 1173.9015183  71510 303912665      912368        syn-C2H3C(O)NH2, v=0
  677578.2805  0.0534 -5.1182 3  885.3706161  71510 303802060      801763        syn-C2H3C(O)NH2, v=0
  677602.6353  0.0018 -3.1601 3  499.2967119  71510 303591941      581840        syn-C2H3C(O)NH2, v=0
  677621.7653  0.0236 -4.0742 3  972.2164169  71510 303842164      832063        syn-C2H3C(O)NH2, v=0
  677637.8721  0.0062 -5.4372 3  286.1950 93  71510 303461333      46 838        syn-C2H3C(O)NH2, v=0
  677754.4792  0.0594 -4.6848 3 1350.4650163  71510 303814932      814833        syn-C2H3C(O)NH2, v=0
  677754.4792  0.0594 -4.6848 3 1350.4650163  71510 303814933      814834        syn-C2H3C(O)NH2, v=0
  677863.5964  0.0037 -5.4539 3  274.4117 89  71510 303441529      441034        syn-C2H3C(O)NH2, v=0
  678031.2181  0.2019 -5.6271 3 1694.0608247  71510 303C3 7B6      C3 6B7        syn-C2H3C(O)NH2, v=0
  678031.2181  0.2019 -5.6271 3 1694.0608247  71510 303C3 8B6      C3 7B7        syn-C2H3C(O)NH2, v=0
  678049.7223  0.0044 -4.9060 3  429.4334115  71510 303571345      571048        syn-C2H3C(O)NH2, v=0
  678060.5540  0.0591 -4.6552 3 1330.7250161  71510 303804931      804832        syn-C2H3C(O)NH2, v=0
  678060.5540  0.0591 -4.6552 3 1330.7250161  71510 303804932      804833        syn-C2H3C(O)NH2, v=0
  678225.2170  0.2108 -5.5168 3 1381.0619231  71510 303B5 2B3      B5 1B4        syn-C2H3C(O)NH2, v=0
  678225.2170  0.2108 -5.5168 3 1381.0619231  71510 303B5 3B3      B5 2B4        syn-C2H3C(O)NH2, v=0
  678357.0069  0.0588 -4.6266 3 1311.2321159  71510 303794930      794831        syn-C2H3C(O)NH2, v=0
  678357.0069  0.0588 -4.6266 3 1311.2321159  71510 303794931      794832        syn-C2H3C(O)NH2, v=0
  678531.7315  0.0018 -3.1591 3  499.2713119  71510 303591940      581841        syn-C2H3C(O)NH2, v=0
  678538.8719  0.0048 -5.5998 3  239.4092 91  71510 30345 639      45 342        syn-C2H3C(O)NH2, v=0
  678540.5312  0.0048 -5.5998 3  239.4092 91  71510 30345 739      45 442        syn-C2H3C(O)NH2, v=0
  678549.1762  0.0035 -2.5693 3  347.5060 65  71510 3033232 0      3131 1        syn-C2H3C(O)NH2, v=0
  678549.1762  0.0035 -2.5693 3  347.5060 65  71510 3033232 1      3131 0        syn-C2H3C(O)NH2, v=0
  678644.0706  0.0586 -4.5988 3 1291.9863157  71510 303784929      784830        syn-C2H3C(O)NH2, v=0
  678644.0706  0.0586 -4.5988 3 1291.9863157  71510 303784930      784831        syn-C2H3C(O)NH2, v=0
  678672.6928  0.0314 -4.1603 3 1139.2307185  71510 303921973      912072        syn-C2H3C(O)NH2, v=0
  678677.5326  0.0035 -3.4031 3  515.8330123  71510 303611744      601645        syn-C2H3C(O)NH2, v=0
  678691.1553  0.0017 -2.9667 3  445.7698109  71510 303542134      532033        syn-C2H3C(O)NH2, v=0
  678691.4825  0.0017 -2.9667 3  445.7698109  71510 303542133      532034        syn-C2H3C(O)NH2, v=0
  678791.7633  0.0054 -5.2779 3  315.4063 97  71510 303481434      48 939        syn-C2H3C(O)NH2, v=0
  678921.9736  0.0584 -4.5720 3 1272.9874155  71510 303774928      774829        syn-C2H3C(O)NH2, v=0
  678921.9736  0.0584 -4.5720 3 1272.9874155  71510 303774929      774830        syn-C2H3C(O)NH2, v=0
  678952.9865  0.0271 -4.1794 3 1104.3751181  71510 303902170      892069        syn-C2H3C(O)NH2, v=0
  678990.4967  0.0028 -2.5884 3  348.9338 69  71510 3033431 3      3330 4        syn-C2H3C(O)NH2, v=0
  678990.4967  0.0028 -2.5884 3  348.9338 69  71510 3033431 4      3330 3        syn-C2H3C(O)NH2, v=0
  679043.5322  0.0312 -4.1598 3 1139.2230185  71510 303922073      911972        syn-C2H3C(O)NH2, v=0
  679056.4992  0.0055 -4.8341 3  556.5883129  71510 303641649      641352        syn-C2H3C(O)NH2, v=0
  679188.1248  0.1704 -5.4763 3 1205.9292187  71510 303932469      932172        syn-C2H3C(O)NH2, v=0
  679190.9400  0.0582 -4.5463 3 1254.2352153  71510 303764927      764828        syn-C2H3C(O)NH2, v=0
  679190.9400  0.0582 -4.5463 3 1254.2352153  71510 303764928      764829        syn-C2H3C(O)NH2, v=0
  679219.4024  0.0308 -4.2063 3 1127.0225183  71510 303912071      902170        syn-C2H3C(O)NH2, v=0
  679220.7570  0.0020 -5.1810 3  244.6495 79  71510 303391821      391524        syn-C2H3C(O)NH2, v=0
  679224.4882  0.0020 -5.1810 3  244.6494 79  71510 303391822      391525        syn-C2H3C(O)NH2, v=0
  679365.4841  0.0377 -4.3061 3 1136.5908183  71510 303912170      902269        syn-C2H3C(O)NH2, v=0
  679421.6100  0.0023 -2.6098 3  351.8269 73  71510 3033630 6      3529 7        syn-C2H3C(O)NH2, v=0
  679421.6100  0.0023 -2.6098 3  351.8269 73  71510 3033630 7      3529 6        syn-C2H3C(O)NH2, v=0
  679451.1898  0.0581 -4.5215 3 1235.7297151  71510 303754926      754827        syn-C2H3C(O)NH2, v=0
  679451.1898  0.0581 -4.5215 3 1235.7297151  71510 303754927      754828        syn-C2H3C(O)NH2, v=0
  679474.5399  0.0029 -4.8381 3  401.2011105  71510 303521933      521636        syn-C2H3C(O)NH2, v=0
  679541.1526  0.0037 -4.4015 3  180.3007 75  71510 303371126      36 829        syn-C2H3C(O)NH2, v=0
  679642.4485  0.2039 -5.5150 3 1571.3997241  71510 303C0 5B5      C0 4B6        syn-C2H3C(O)NH2, v=0
  679642.4485  0.2039 -5.5150 3 1571.3997241  71510 303C0 6B5      C0 5B6        syn-C2H3C(O)NH2, v=0
  679702.9389  0.0580 -4.4978 3 1217.4708149  71510 303744925      744826        syn-C2H3C(O)NH2, v=0
  679702.9389  0.0580 -4.4978 3 1217.4708149  71510 303744926      744827        syn-C2H3C(O)NH2, v=0
  679815.7940  0.0027 -3.6393 3  292.2228 95  71510 303471236      46 937        syn-C2H3C(O)NH2, v=0
  679834.3250  0.0020 -2.6338 3  356.1918 77  71510 3033829 9      372810        syn-C2H3C(O)NH2, v=0
  679834.3250  0.0020 -2.6338 3  356.1918 77  71510 303382910      3728 9        syn-C2H3C(O)NH2, v=0
  679884.7365  0.0086 -5.6912 3  106.7991 61  71510 30330 723      29 426        syn-C2H3C(O)NH2, v=0
  679899.8711  0.0587 -4.0053 3 1255.2041213  71510 303A6 6A0      A5 799        syn-C2H3C(O)NH2, v=0
  679899.8711  0.0587 -4.0053 3 1255.2041213  71510 303A6 7A0      A5 699        syn-C2H3C(O)NH2, v=0
  679903.6294  0.0562 -4.0158 3 1251.5423211  71510 303A5 798      A4 897        syn-C2H3C(O)NH2, v=0
  679903.6294  0.0562 -4.0158 3 1251.5423211  71510 303A5 898      A4 797        syn-C2H3C(O)NH2, v=0
  679904.9861  0.0614 -3.9946 3 1258.3352215  71510 303A7 5A2      A6 6A1        syn-C2H3C(O)NH2, v=0
  679904.9861  0.0614 -3.9946 3 1258.3352215  71510 303A7 6A2      A6 5A1        syn-C2H3C(O)NH2, v=0
  679915.8289  0.0647 -3.9835 3 1260.9410217  71510 303A8 4A4      A7 5A3        syn-C2H3C(O)NH2, v=0
  679915.8289  0.0647 -3.9835 3 1260.9410217  71510 303A8 5A4      A7 4A3        syn-C2H3C(O)NH2, v=0
  679920.1424  0.0540 -4.0260 3 1247.3432209  71510 303A4 896      A3 995        syn-C2H3C(O)NH2, v=0
  679920.1424  0.0540 -4.0260 3 1247.3432209  71510 303A4 996      A3 895        syn-C2H3C(O)NH2, v=0
  679929.8261  0.0687 -3.9719 3 1263.0265219  71510 303A9 3A6      A8 4A5        syn-C2H3C(O)NH2, v=0
  679929.8261  0.0687 -3.9719 3 1263.0265219  71510 303A9 4A6      A8 3A5        syn-C2H3C(O)NH2, v=0
  679944.8529  0.0735 -3.9600 3 1264.5959221  71510 303B0 2A8      A9 3A7        syn-C2H3C(O)NH2, v=0
  679944.8529  0.0735 -3.9600 3 1264.5959221  71510 303B0 3A8      A9 2A7        syn-C2H3C(O)NH2, v=0
  679946.3992  0.0579 -4.4752 3 1199.4582147  71510 303734924      734825        syn-C2H3C(O)NH2, v=0
  679946.3992  0.0579 -4.4752 3 1199.4582147  71510 303734925      734826        syn-C2H3C(O)NH2, v=0
  679954.2512  0.0520 -4.0362 3 1242.5993207  71510 303A3 994      A21093        syn-C2H3C(O)NH2, v=0
  679954.2512  0.0520 -4.0362 3 1242.5993207  71510 303A31094      A2 993        syn-C2H3C(O)NH2, v=0
  679959.1408  0.0796 -3.9475 3 1265.6528223  71510 303B1 1B0      B0 2A9        syn-C2H3C(O)NH2, v=0
  679959.1408  0.0796 -3.9475 3 1265.6528223  71510 303B1 2B0      B0 1A9        syn-C2H3C(O)NH2, v=0
  679971.2058  0.0870 -3.9345 3 1266.2003225  71510 303B2 0B2      B1 1B1        syn-C2H3C(O)NH2, v=0
  679971.2058  0.0870 -3.9345 3 1266.2003225  71510 303B2 1B2      B1 0B1        syn-C2H3C(O)NH2, v=0
  679982.4487  0.0017 -2.9047 3  429.0194105  71510 303522231      512130        syn-C2H3C(O)NH2, v=0
  679982.4531  0.0017 -2.9047 3  429.0194105  71510 303522230      512131        syn-C2H3C(O)NH2, v=0
  680012.0666  0.0500 -4.0463 3 1237.3016205  71510 303A21092      A11191        syn-C2H3C(O)NH2, v=0
  680012.0666  0.0500 -4.0463 3 1237.3016205  71510 303A21192      A11091        syn-C2H3C(O)NH2, v=0
  680038.1522  0.2082 -5.7248 3 1769.8385251  71510 303C5 8B7      C5 7B8        syn-C2H3C(O)NH2, v=0
  680038.1522  0.2082 -5.7248 3 1769.8385251  71510 303C5 9B7      C5 8B8        syn-C2H3C(O)NH2, v=0
  680074.1022  0.0022 -4.9554 3  116.5731 57  71510 303281316      271017        syn-C2H3C(O)NH2, v=0
  680101.4084  0.0480 -4.0566 3 1231.4396203  71510 303A11190      A01289        syn-C2H3C(O)NH2, v=0
  680101.4084  0.0480 -4.0566 3 1231.4396203  71510 303A11290      A01189        syn-C2H3C(O)NH2, v=0
  680181.7785  0.0579 -4.4538 3 1181.6920145  71510 303724923      724824        syn-C2H3C(O)NH2, v=0
  680181.7785  0.0579 -4.4538 3 1181.6920145  71510 303724924      724825        syn-C2H3C(O)NH2, v=0
  680216.5141  0.0019 -2.6606 3  362.0365 81  71510 303402812      392713        syn-C2H3C(O)NH2, v=0
  680216.5141  0.0019 -2.6606 3  362.0365 81  71510 303402813      392712        syn-C2H3C(O)NH2, v=0
  680226.9638  0.0277 -5.7814 3 1028.1603173  71510 303862264      852263        syn-C2H3C(O)NH2, v=0
  680232.4440  0.0461 -4.0671 3 1225.0009201  71510 303A01288      991387        syn-C2H3C(O)NH2, v=0
  680232.4440  0.0461 -4.0671 3 1225.0009201  71510 303A01388      991287        syn-C2H3C(O)NH2, v=0
  680263.5604  0.0021 -4.9553 3  116.5668 57  71510 303281315      271018        syn-C2H3C(O)NH2, v=0
  680386.8230  0.0943 -5.7562 3 1973.1458215  71510 303A75057      A74958        syn-C2H3C(O)NH2, v=0
  680386.8230  0.0943 -5.7562 3 1973.1458215  71510 303A75058      A74959        syn-C2H3C(O)NH2, v=0
  680409.2812  0.0579 -4.4336 3 1164.1719143  71510 303714922      714823        syn-C2H3C(O)NH2, v=0
  680409.2812  0.0579 -4.4336 3 1164.1719143  71510 303714923      714824        syn-C2H3C(O)NH2, v=0
  680418.6439  0.0442 -4.0782 3 1217.9702199  71510 303991386      981485        syn-C2H3C(O)NH2, v=0
  680418.6439  0.0442 -4.0782 3 1217.9702199  71510 303991486      981385        syn-C2H3C(O)NH2, v=0
  680523.9890  0.0041 -4.3160 3  176.6045 81  71510 30340 436      39 337        syn-C2H3C(O)NH2, v=0
  680524.1018  0.0041 -4.3160 3  176.6045 81  71510 30340 536      39 237        syn-C2H3C(O)NH2, v=0
  680550.3913  0.0018 -2.6906 3  369.3712 85  71510 303422715      412616        syn-C2H3C(O)NH2, v=0
  680550.3913  0.0018 -2.6906 3  369.3712 85  71510 303422716      412615        syn-C2H3C(O)NH2, v=0
  680629.1075  0.0579 -4.4147 3 1146.8979141  71510 303704921      704822        syn-C2H3C(O)NH2, v=0
  680629.1075  0.0579 -4.4147 3 1146.8979141  71510 303704922      704823        syn-C2H3C(O)NH2, v=0
  680654.6885  0.0017 -2.8509 3  413.9371101  71510 303502328      492227        syn-C2H3C(O)NH2, v=0
  680654.6886  0.0017 -2.8509 3  413.9371101  71510 303502327      492228        syn-C2H3C(O)NH2, v=0
  680678.2659  0.0423 -4.0902 3 1210.3291197  71510 303981484      971583        syn-C2H3C(O)NH2, v=0
  680678.2660  0.0423 -4.0902 3 1210.3291197  71510 303981584      971483        syn-C2H3C(O)NH2, v=0
  680684.3119  0.0027 -3.6696 3  275.1378 93  71510 303461136      45 837        syn-C2H3C(O)NH2, v=0
  680802.3362  0.2109 -5.4850 3 1451.6507235  71510 303B7 3B4      B7 2B5        syn-C2H3C(O)NH2, v=0
  680802.3362  0.2109 -5.4850 3 1451.6507235  71510 303B7 4B4      B7 3B5        syn-C2H3C(O)NH2, v=0
  680809.9205  0.0018 -2.7241 3  378.2090 89  71510 303442618      432519        syn-C2H3C(O)NH2, v=0
  680809.9205  0.0018 -2.7241 3  378.2090 89  71510 303442619      432518        syn-C2H3C(O)NH2, v=0
  680841.4542  0.0579 -4.3971 3 1129.8698139  71510 303694920      694821        syn-C2H3C(O)NH2, v=0
  680841.4542  0.0579 -4.3971 3 1129.8698139  71510 303694921      694822        syn-C2H3C(O)NH2, v=0
  680933.9810  0.0018 -2.8036 3  400.4662 97  71510 303482424      472325        syn-C2H3C(O)NH2, v=0
  680933.9810  0.0018 -2.8036 3  400.4662 97  71510 303482425      472324        syn-C2H3C(O)NH2, v=0
  680956.7990  0.0018 -2.7616 3  388.5666 93  71510 303462521      452422        syn-C2H3C(O)NH2, v=0
  680956.7990  0.0018 -2.7616 3  388.5666 93  71510 303462522      452421        syn-C2H3C(O)NH2, v=0
  681008.7064  0.0923 -5.7079 3 1946.9477213  71510 303A65056      A64957        syn-C2H3C(O)NH2, v=0
  681008.7064  0.0923 -5.7079 3 1946.9477213  71510 303A65057      A64958        syn-C2H3C(O)NH2, v=0
  681036.7592  0.0404 -4.1033 3 1202.0547195  71510 303971582      961681        syn-C2H3C(O)NH2, v=0
  681036.7611  0.0404 -4.1033 3 1202.0547195  71510 303971682      961581        syn-C2H3C(O)NH2, v=0
  681046.5145  0.0580 -4.3810 3 1113.0875137  71510 303684919      684820        syn-C2H3C(O)NH2, v=0
  681046.5145  0.0580 -4.3810 3 1113.0875137  71510 303684920      684821        syn-C2H3C(O)NH2, v=0
  681058.2790  0.0028 -4.8364 3  401.1482105  71510 303521934      521637        syn-C2H3C(O)NH2, v=0
  681178.0706  0.0041 -4.9676 3  394.6461111  71510 303551144      55 847        syn-C2H3C(O)NH2, v=0
  681183.7400  0.0044 -5.1938 3  333.4551 99  71510 303491534      491039        syn-C2H3C(O)NH2, v=0
  681244.4781  0.0581 -4.3664 3 1096.5510135  71510 303674918      674819        syn-C2H3C(O)NH2, v=0
  681244.4781  0.0581 -4.3664 3 1096.5510135  71510 303674919      674820        syn-C2H3C(O)NH2, v=0
  681275.9790  0.0082 -5.3316 3  125.5798 65  71510 30332 824      31 527        syn-C2H3C(O)NH2, v=0
  681435.5310  0.0582 -4.3535 3 1080.2600133  71510 303664917      664818        syn-C2H3C(O)NH2, v=0
  681435.5310  0.0582 -4.3535 3 1080.2600133  71510 303664918      664819        syn-C2H3C(O)NH2, v=0
  681445.5624  0.0658 -5.2834 3 1050.8503173  71510 303862561      862264        syn-C2H3C(O)NH2, v=0
  681479.3013  0.0020 -5.2317 3  234.9656 77  71510 303381820      381523        syn-C2H3C(O)NH2, v=0
  681481.0249  0.0020 -5.2317 3  234.9656 77  71510 303381821      381524        syn-C2H3C(O)NH2, v=0
  681503.5228  0.0028 -3.7231 3  258.1826 91  71510 30345 936      44 837        syn-C2H3C(O)NH2, v=0
  681530.8659  0.0386 -4.1183 3 1193.1178193  71510 303961680      951779        syn-C2H3C(O)NH2, v=0
  681530.9118  0.0386 -4.1183 3 1193.1178193  71510 303961780      951679        syn-C2H3C(O)NH2, v=0
  681533.6929  0.2224 -5.7168 3 1334.8458229  71510 303B4 1B3      B4 0B4        syn-C2H3C(O)NH2, v=0
  681533.6929  0.2224 -5.7168 3 1334.8458229  71510 303B4 2B3      B4 1B4        syn-C2H3C(O)NH2, v=0
  681614.0170  0.0904 -5.6602 3 1921.0005211  71510 303A55055      A54956        syn-C2H3C(O)NH2, v=0
  681614.0170  0.0904 -5.6602 3 1921.0005211  71510 303A55056      A54957        syn-C2H3C(O)NH2, v=0
  681619.8560  0.0584 -4.3423 3 1064.2146131  71510 303654916      654817        syn-C2H3C(O)NH2, v=0
  681619.8560  0.0584 -4.3423 3 1064.2146131  71510 303654917      654818        syn-C2H3C(O)NH2, v=0
  681794.1685  0.0026 -5.7796 3   79.8609 43  71510 3032114 8      2011 9        syn-C2H3C(O)NH2, v=0
  681794.1834  0.0026 -5.7796 3   79.8609 43  71510 3032114 7      201110        syn-C2H3C(O)NH2, v=0
  681797.6326  0.0586 -4.3332 3 1048.4145129  71510 303644915      644816        syn-C2H3C(O)NH2, v=0
  681797.6326  0.0586 -4.3332 3 1048.4145129  71510 303644916      644817        syn-C2H3C(O)NH2, v=0
  681884.0896  0.2075 -5.5872 3 1645.2343245  71510 303C2 6B6      C2 5B7        syn-C2H3C(O)NH2, v=0
  681884.0896  0.2075 -5.5872 3 1645.2343245  71510 303C2 7B6      C2 6B7        syn-C2H3C(O)NH2, v=0
  681947.5501  0.0072 -4.9847 3  145.6064 69  71510 30334 925      33 628        syn-C2H3C(O)NH2, v=0
  681961.7536  0.0034 -5.2725 3  115.5666 61  71510 303301021      29 524        syn-C2H3C(O)NH2, v=0
  681969.0368  0.0588 -4.3261 3 1032.8597127  71510 303634914      634815        syn-C2H3C(O)NH2, v=0
  681969.0368  0.0588 -4.3261 3 1032.8597127  71510 303634915      634816        syn-C2H3C(O)NH2, v=0
  682134.2417  0.0590 -4.3214 3 1017.5501125  71510 303624913      624814        syn-C2H3C(O)NH2, v=0
  682134.2417  0.0590 -4.3214 3 1017.5501125  71510 303624914      624815        syn-C2H3C(O)NH2, v=0
  682161.5317  0.0041 -5.4081 3  267.9287 95  71510 30347 740      47 443        syn-C2H3C(O)NH2, v=0
  682168.8265  0.0041 -5.4081 3  267.9287 95  71510 30347 840      47 543        syn-C2H3C(O)NH2, v=0
  682194.9161  0.0040 -4.9665 3  394.6461111  71510 303551244      55 947        syn-C2H3C(O)NH2, v=0
  682203.1300  0.0886 -5.6131 3 1895.3038209  71510 303A45054      A44955        syn-C2H3C(O)NH2, v=0
  682203.1300  0.0886 -5.6131 3 1895.3038209  71510 303A45055      A44956        syn-C2H3C(O)NH2, v=0
  682215.8363  0.0368 -4.1359 3 1183.4801191  71510 303951778      941877        syn-C2H3C(O)NH2, v=0
  682216.7669  0.0368 -4.1359 3 1183.4801191  71510 303951878      941777        syn-C2H3C(O)NH2, v=0
  682236.7754  0.0039 -4.7891 3  537.8347123  71510 303612042      611745        syn-C2H3C(O)NH2, v=0
  682293.4169  0.0592 -4.3194 3 1002.4856123  71510 303614912      614813        syn-C2H3C(O)NH2, v=0
  682293.4169  0.0592 -4.3194 3 1002.4856123  71510 303614913      614814        syn-C2H3C(O)NH2, v=0
  682446.7289  0.0594 -4.3204 3  987.6661121  71510 303604911      604812        syn-C2H3C(O)NH2, v=0
  682446.7289  0.0594 -4.3204 3  987.6661121  71510 303604912      604813        syn-C2H3C(O)NH2, v=0
  682502.4260  0.0063 -5.6904 3  100.2248 59  71510 30329 822      28 325        syn-C2H3C(O)NH2, v=0
  682594.3413  0.0597 -4.3249 3  973.0914119  71510 303594910      594811        syn-C2H3C(O)NH2, v=0
  682594.3413  0.0597 -4.3249 3  973.0914119  71510 303594911      594812        syn-C2H3C(O)NH2, v=0
  682594.4890  0.0070 -4.8844 3  572.3054131  71510 303651550      651253        syn-C2H3C(O)NH2, v=0
  682736.4144  0.0600 -4.3334 3  958.7616117  71510 3035849 9      584810        syn-C2H3C(O)NH2, v=0
  682736.4144  0.0600 -4.3334 3  958.7616117  71510 303584910      584811        syn-C2H3C(O)NH2, v=0
  682776.4115  0.0869 -5.5667 3 1869.8576207  71510 303A35053      A34954        syn-C2H3C(O)NH2, v=0
  682776.4115  0.0869 -5.5667 3 1869.8576207  71510 303A35054      A34955        syn-C2H3C(O)NH2, v=0
  682788.6643  0.0017 -3.0641 3  478.2755115  71510 303572038      561937        syn-C2H3C(O)NH2, v=0
  682820.0535  0.0017 -3.0641 3  478.2746115  71510 303572037      561938        syn-C2H3C(O)NH2, v=0
  682866.2491  0.0070 -3.6010 3  662.4330139  71510 303691951      681850        syn-C2H3C(O)NH2, v=0
  682873.1056  0.0603 -4.3466 3  944.6764115  71510 3035749 8      5748 9        syn-C2H3C(O)NH2, v=0
  682873.1056  0.0603 -4.3466 3  944.6764115  71510 3035749 9      574810        syn-C2H3C(O)NH2, v=0
  682977.4359  0.0018 -3.1911 3  514.2034121  71510 303601942      591841        syn-C2H3C(O)NH2, v=0
  683004.5693  0.0606 -4.3657 3  930.8359113  71510 3035649 7      5648 8        syn-C2H3C(O)NH2, v=0
  683004.5693  0.0606 -4.3657 3  930.8359113  71510 3035649 8      5648 9        syn-C2H3C(O)NH2, v=0
  683035.9866  0.0120 -4.9430 3  722.7089143  71510 303712249      711952        syn-C2H3C(O)NH2, v=0
  683130.9570  0.0609 -4.3920 3  917.2398111  71510 3035549 6      5548 7        syn-C2H3C(O)NH2, v=0
  683130.9570  0.0609 -4.3920 3  917.2398111  71510 3035549 7      5548 8        syn-C2H3C(O)NH2, v=0
  683174.9219  0.0351 -4.1576 3 1173.0897189  71510 303941876      931975        syn-C2H3C(O)NH2, v=0
  683190.8273  0.0351 -4.1575 3 1173.0894189  71510 303941976      931875        syn-C2H3C(O)NH2, v=0
  683225.3596  0.0059 -3.5890 3  410.2116111  71510 303551441      541342        syn-C2H3C(O)NH2, v=0
  683252.4172  0.0612 -4.4277 3  903.8882109  71510 3035449 5      5448 6        syn-C2H3C(O)NH2, v=0
  683252.4172  0.0612 -4.4277 3  903.8882109  71510 3035449 6      5448 7        syn-C2H3C(O)NH2, v=0
  683268.4002  0.2122 -5.5073 3 1523.5257239  71510 303B9 4B5      B9 3B6        syn-C2H3C(O)NH2, v=0
  683268.4002  0.2122 -5.5073 3 1523.5257239  71510 303B9 5B5      B9 4B6        syn-C2H3C(O)NH2, v=0
  683284.4059  0.0292 -4.2008 3 1126.9398183  71510 303912171      902070        syn-C2H3C(O)NH2, v=0
  683334.2187  0.0853 -5.5210 3 1844.6617205  71510 303A25052      A24953        syn-C2H3C(O)NH2, v=0
  683334.2187  0.0853 -5.5210 3 1844.6617205  71510 303A25053      A24954        syn-C2H3C(O)NH2, v=0
  683369.0955  0.0616 -4.4760 3  890.7809107  71510 3035349 4      5348 5        syn-C2H3C(O)NH2, v=0
  683369.0955  0.0616 -4.4760 3  890.7809107  71510 3035349 5      5348 6        syn-C2H3C(O)NH2, v=0
  683481.1347  0.0619 -4.5425 3  877.9178105  71510 3035249 3      5248 4        syn-C2H3C(O)NH2, v=0
  683481.1347  0.0619 -4.5425 3  877.9178105  71510 3035249 4      5248 5        syn-C2H3C(O)NH2, v=0
  683545.9948  0.0020 -5.2857 3  225.5422 75  71510 303371819      371522        syn-C2H3C(O)NH2, v=0
  683546.7696  0.0020 -5.2857 3  225.5421 75  71510 303371820      371523        syn-C2H3C(O)NH2, v=0
  683588.6747  0.0623 -4.6374 3  865.2989103  71510 3035149 2      5148 3        syn-C2H3C(O)NH2, v=0
  683588.6747  0.0623 -4.6374 3  865.2989103  71510 3035149 3      5148 4        syn-C2H3C(O)NH2, v=0
  683691.8525  0.0626 -4.7838 3  852.9241101  71510 3035049 1      5048 2        syn-C2H3C(O)NH2, v=0
  683691.8525  0.0626 -4.7838 3  852.9241101  71510 3035049 2      5048 3        syn-C2H3C(O)NH2, v=0
  683740.0482  0.0101 -4.8639 3  698.3388143  71510 303711953      711656        syn-C2H3C(O)NH2, v=0
  683790.8026  0.0630 -5.0555 3  840.7932 99  71510 3034949 0      4948 1        syn-C2H3C(O)NH2, v=0
  683790.8026  0.0630 -5.0555 3  840.7932 99  71510 3034949 1      4948 2        syn-C2H3C(O)NH2, v=0
  683809.6146  0.0036 -4.1273 3  192.4204 83  71510 30341 536      40 437        syn-C2H3C(O)NH2, v=0
  683810.8254  0.0036 -4.1273 3  192.4204 83  71510 30341 636      40 337        syn-C2H3C(O)NH2, v=0
  683829.4878  0.0027 -3.7210 3  258.1812 91  71510 303451036      44 737        syn-C2H3C(O)NH2, v=0
  683876.9003  0.0838 -5.4759 3 1819.7159203  71510 303A15051      A14952        syn-C2H3C(O)NH2, v=0
  683876.9003  0.0838 -5.4759 3 1819.7159203  71510 303A15052      A14953        syn-C2H3C(O)NH2, v=0
  683900.1694  0.0365 -5.0583 3  817.5403155  71510 303771958      771661        syn-C2H3C(O)NH2, v=0
  684009.2261  0.2125 -5.6744 3 1720.3421249  71510 303C4 7B7      C4 6B8        syn-C2H3C(O)NH2, v=0
  684009.2261  0.2125 -5.6744 3 1720.3421249  71510 303C4 8B7      C4 7B8        syn-C2H3C(O)NH2, v=0
  684060.7547  0.0038 -4.2600 3  209.4324 79  71510 303391327      381028        syn-C2H3C(O)NH2, v=0
  684179.8211  0.0051 -5.4031 3  111.4059 61  71510 30330 922      29 425        syn-C2H3C(O)NH2, v=0
  684215.0380  0.2216 -5.5587 3 1404.7448233  71510 303B6 2B4      B6 1B5        syn-C2H3C(O)NH2, v=0
  684215.0380  0.2216 -5.5587 3 1404.7448233  71510 303B6 3B4      B6 2B5        syn-C2H3C(O)NH2, v=0
  684275.8591  0.0037 -5.0432 3  361.0912107  71510 303531043      53 746        syn-C2H3C(O)NH2, v=0
  684404.7968  0.0823 -5.4315 3 1795.0200201  71510 303A05050      A04951        syn-C2H3C(O)NH2, v=0
  684404.7968  0.0823 -5.4315 3 1795.0200201  71510 303A05051      A04952        syn-C2H3C(O)NH2, v=0
  684422.9878  0.0075 -4.8557 3  713.8788143  71510 303712151      711854        syn-C2H3C(O)NH2, v=0
  684437.9976  0.0084 -4.8675 3  732.1262145  71510 303722152      721855        syn-C2H3C(O)NH2, v=0
  684446.2612  0.0037 -5.2579 3  297.7221 99  71510 30349 841      49 544        syn-C2H3C(O)NH2, v=0
  684459.3502  0.0153 -3.8510 3  800.1169153  71510 303762057      751956        syn-C2H3C(O)NH2, v=0
  684475.0319  0.0037 -5.2579 3  297.7222 99  71510 30349 941      49 644        syn-C2H3C(O)NH2, v=0
  684477.6429  0.0336 -4.1858 3 1161.8735187  71510 303931974      922073        syn-C2H3C(O)NH2, v=0
  684581.5098  0.0018 -3.1894 3  514.1599121  71510 303601941      591842        syn-C2H3C(O)NH2, v=0
  684592.5531  0.0247 -4.0566 3  950.6562167  71510 303832163      822062        syn-C2H3C(O)NH2, v=0
  684613.3805  0.0037 -5.0429 3  361.0912107  71510 303531143      53 846        syn-C2H3C(O)NH2, v=0
  684703.4105  0.0335 -4.1855 3 1161.8688187  71510 303932074      921973        syn-C2H3C(O)NH2, v=0
  684849.1861  0.0406 -5.1565 3  934.6008163  71510 303812457      812160        syn-C2H3C(O)NH2, v=0
  684918.2410  0.0809 -5.3878 3 1770.5738199  71510 303995049      994950        syn-C2H3C(O)NH2, v=0
  684918.2410  0.0809 -5.3878 3 1770.5738199  71510 303995050      994951        syn-C2H3C(O)NH2, v=0
  684999.3033  0.0024 -3.3307 3  537.8347125  71510 303621844      611745        syn-C2H3C(O)NH2, v=0
  685019.9646  0.0021 -4.8804 3  123.5638 59  71510 303291317      281018        syn-C2H3C(O)NH2, v=0
  685225.9456  0.0943 -4.6486 3 1248.8497191  71510 303952372      942471        syn-C2H3C(O)NH2, v=0
  685231.7759  0.0035 -5.1386 3  328.7797103  71510 30351 942      51 645        syn-C2H3C(O)NH2, v=0
  685334.7872  0.0035 -5.1385 3  328.7797103  71510 303511042      51 745        syn-C2H3C(O)NH2, v=0
  685334.9533  0.0027 -4.8594 3  388.0657103  71510 303511932      511635        syn-C2H3C(O)NH2, v=0
  685398.7553  0.0021 -4.8801 3  123.5512 59  71510 303291316      281019        syn-C2H3C(O)NH2, v=0
  685414.3384  0.0017 -2.9879 3  459.1948111  71510 303552135      542034        syn-C2H3C(O)NH2, v=0
  685415.0239  0.0017 -2.9879 3  459.1948111  71510 303552134      542035        syn-C2H3C(O)NH2, v=0
  685417.5581  0.0796 -5.3448 3 1746.3772197  71510 303985048      984949        syn-C2H3C(O)NH2, v=0
  685417.5581  0.0796 -5.3448 3 1746.3772197  71510 303985049      984950        syn-C2H3C(O)NH2, v=0
  685435.7379  0.0020 -5.3434 3  216.3780 73  71510 303361818      361521        syn-C2H3C(O)NH2, v=0
  685436.0765  0.0020 -5.3434 3  216.3779 73  71510 303361819      361522        syn-C2H3C(O)NH2, v=0
  685481.3129  0.0326 -4.2269 3 1149.7317185  71510 303922072      912171        syn-C2H3C(O)NH2, v=0
  685621.9734  0.2146 -5.5603 3 1596.6823243  71510 303C1 5B6      C1 4B7        syn-C2H3C(O)NH2, v=0
  685621.9734  0.2146 -5.5603 3 1596.6823243  71510 303C1 6B6      C1 5B7        syn-C2H3C(O)NH2, v=0
  685705.2339  0.0027 -3.7895 3  241.4041 89  71510 30344 836      43 737        syn-C2H3C(O)NH2, v=0
  685786.8305  0.0022 -4.3236 3  184.7088 75  71510 303371225      36 928        syn-C2H3C(O)NH2, v=0
  685811.9496  0.0034 -2.5776 3  355.2866 67  71510 3033332 1      3231 2        syn-C2H3C(O)NH2, v=0
  685811.9496  0.0034 -2.5776 3  355.2866 67  71510 3033332 2      3231 1        syn-C2H3C(O)NH2, v=0
  685847.5702  0.0226 -5.0424 3  825.2068153  71510 303762353      762056        syn-C2H3C(O)NH2, v=0
  685903.0658  0.0784 -5.3024 3 1722.4301195  71510 303975047      974948        syn-C2H3C(O)NH2, v=0
  685903.0658  0.0784 -5.3024 3 1722.4301195  71510 303975048      974949        syn-C2H3C(O)NH2, v=0
  685907.4060  0.0623 -4.0403 3 1277.8832215  71510 303A7 6A1      A6 7A0        syn-C2H3C(O)NH2, v=0
  685907.4060  0.0623 -4.0403 3 1277.8832215  71510 303A7 7A1      A6 6A0        syn-C2H3C(O)NH2, v=0
  685910.1373  0.0597 -4.0505 3 1274.2215213  71510 303A6 799      A5 898        syn-C2H3C(O)NH2, v=0
  685910.1373  0.0597 -4.0505 3 1274.2215213  71510 303A6 899      A5 798        syn-C2H3C(O)NH2, v=0
  685913.2240  0.0652 -4.0297 3 1281.0144217  71510 303A8 5A3      A7 6A2        syn-C2H3C(O)NH2, v=0
  685913.2240  0.0652 -4.0297 3 1281.0144217  71510 303A8 6A3      A7 5A2        syn-C2H3C(O)NH2, v=0
  685924.5308  0.0687 -4.0188 3 1283.6206219  71510 303A9 4A5      A8 5A4        syn-C2H3C(O)NH2, v=0
  685924.5308  0.0687 -4.0188 3 1283.6206219  71510 303A9 5A5      A8 4A4        syn-C2H3C(O)NH2, v=0
  685925.1841  0.0574 -4.0605 3 1270.0229211  71510 303A5 897      A4 996        syn-C2H3C(O)NH2, v=0
  685925.1841  0.0574 -4.0605 3 1270.0229211  71510 303A5 997      A4 896        syn-C2H3C(O)NH2, v=0
  685938.8160  0.0728 -4.0074 3 1285.7066221  71510 303B0 3A7      A9 4A6        syn-C2H3C(O)NH2, v=0
  685938.8160  0.0728 -4.0074 3 1285.7066221  71510 303B0 4A7      A9 3A6        syn-C2H3C(O)NH2, v=0
  685954.0021  0.0779 -3.9956 3 1287.2764223  71510 303B1 2A9      B0 3A8        syn-C2H3C(O)NH2, v=0
  685954.0021  0.0779 -3.9956 3 1287.2764223  71510 303B1 3A9      B0 2A8        syn-C2H3C(O)NH2, v=0
  685957.2303  0.0552 -4.0704 3 1265.2801209  71510 303A4 995      A31094        syn-C2H3C(O)NH2, v=0
  685957.2303  0.0552 -4.0704 3 1265.2801209  71510 303A41095      A3 994        syn-C2H3C(O)NH2, v=0
  685968.3554  0.0842 -3.9833 3 1288.3338225  71510 303B2 1B1      B1 2B0        syn-C2H3C(O)NH2, v=0
  685968.3554  0.0842 -3.9833 3 1288.3338225  71510 303B2 2B1      B1 1B0        syn-C2H3C(O)NH2, v=0
  685980.4181  0.0920 -3.9704 3 1288.8817227  71510 303B3 0B3      B2 1B2        syn-C2H3C(O)NH2, v=0
  685980.4181  0.0920 -3.9704 3 1288.8817227  71510 303B3 1B3      B2 0B2        syn-C2H3C(O)NH2, v=0
  685990.2221  0.0032 -3.9857 3  208.5031 85  71510 30342 636      41 537        syn-C2H3C(O)NH2, v=0
  686000.7670  0.0032 -3.9857 3  208.5031 85  71510 30342 736      41 437        syn-C2H3C(O)NH2, v=0
  686012.1689  0.0531 -4.0803 3 1259.9843207  71510 303A31093      A21192        syn-C2H3C(O)NH2, v=0
  686012.1689  0.0531 -4.0803 3 1259.9843207  71510 303A31193      A21092        syn-C2H3C(O)NH2, v=0
  686016.1353  0.2190 -5.7734 3 1796.7186253  71510 303C6 8B8      C6 7B9        syn-C2H3C(O)NH2, v=0
  686016.1353  0.2190 -5.7734 3 1796.7186253  71510 303C6 9B8      C6 8B9        syn-C2H3C(O)NH2, v=0
  686097.5144  0.0511 -4.0902 3 1254.1254205  71510 303A21191      A11290        syn-C2H3C(O)NH2, v=0
  686097.5144  0.0511 -4.0902 3 1254.1254205  71510 303A21291      A11190        syn-C2H3C(O)NH2, v=0
  686154.2186  0.0083 -4.8548 3  655.1645139  71510 303691852      691555        syn-C2H3C(O)NH2, v=0
  686165.3010  0.0027 -3.7891 3  241.4039 89  71510 30344 936      43 637        syn-C2H3C(O)NH2, v=0
  686222.9970  0.0490 -4.1004 3 1247.6910203  71510 303A11289      A01388        syn-C2H3C(O)NH2, v=0
  686222.9970  0.0490 -4.1004 3 1247.6910203  71510 303A11389      A01288        syn-C2H3C(O)NH2, v=0
  686224.0696  0.0069 -4.8474 3  695.8515141  71510 303702150      701853        syn-C2H3C(O)NH2, v=0
  686250.8657  0.0027 -2.5972 3  357.2071 71  71510 3033531 4      3430 5        syn-C2H3C(O)NH2, v=0
  686250.8657  0.0027 -2.5972 3  357.2071 71  71510 3033531 5      3430 4        syn-C2H3C(O)NH2, v=0
  686252.6831  0.0027 -4.8584 3  388.0351103  71510 303511933      511636        syn-C2H3C(O)NH2, v=0
  686361.0634  0.0050 -4.8578 3  517.5555125  71510 303621548      621251        syn-C2H3C(O)NH2, v=0
  686375.0750  0.0773 -5.2608 3 1698.7322193  71510 303965046      964947        syn-C2H3C(O)NH2, v=0
  686375.0750  0.0773 -5.2608 3 1698.7322193  71510 303965047      964948        syn-C2H3C(O)NH2, v=0
  686401.4486  0.0470 -4.1111 3 1240.6665201  71510 303A01387      991486        syn-C2H3C(O)NH2, v=0
  686401.4486  0.0470 -4.1111 3 1240.6665201  71510 303A01487      991386        syn-C2H3C(O)NH2, v=0
  686484.9766  0.0095 -4.8835 3  750.5866147  71510 303732153      731856        syn-C2H3C(O)NH2, v=0
  686650.1641  0.0451 -4.1225 3 1233.0341199  71510 303991485      981584        syn-C2H3C(O)NH2, v=0
  686650.1642  0.0451 -4.1225 3 1233.0341199  71510 303991585      981484        syn-C2H3C(O)NH2, v=0
  686677.3800  0.0023 -2.6193 3  360.5948 75  71510 3033730 7      3629 8        syn-C2H3C(O)NH2, v=0
  686677.3800  0.0023 -2.6193 3  360.5948 75  71510 3033730 8      3629 7        syn-C2H3C(O)NH2, v=0
  686787.4604  0.2218 -5.5282 3 1475.9339237  71510 303B8 3B5      B8 2B6        syn-C2H3C(O)NH2, v=0
  686787.4604  0.2218 -5.5282 3 1475.9339237  71510 303B8 4B5      B8 3B6        syn-C2H3C(O)NH2, v=0
  686792.5800  0.0029 -3.8758 3  224.8370 87  71510 30343 736      42 637        syn-C2H3C(O)NH2, v=0
  686833.8898  0.0762 -5.2198 3 1675.2834191  71510 303955045      954946        syn-C2H3C(O)NH2, v=0
  686833.8898  0.0762 -5.2198 3 1675.2834191  71510 303955046      954947        syn-C2H3C(O)NH2, v=0
  686868.6949  0.0029 -3.8757 3  224.8370 87  71510 30343 836      42 537        syn-C2H3C(O)NH2, v=0
  686885.4702  0.0017 -2.9237 3  441.8901107  71510 303532232      522131        syn-C2H3C(O)NH2, v=0
  686885.4802  0.0017 -2.9237 3  441.8901107  71510 303532231      522132        syn-C2H3C(O)NH2, v=0
  686886.3342  0.0118 -4.8877 3  742.6602147  71510 303732054      731757        syn-C2H3C(O)NH2, v=0
  686993.0891  0.0431 -4.1350 3 1224.7717197  71510 303981583      971682        syn-C2H3C(O)NH2, v=0
  686993.0901  0.0431 -4.1350 3 1224.7717197  71510 303981683      971582        syn-C2H3C(O)NH2, v=0
  687082.4166  0.0020 -2.6441 3  365.4565 79  71510 303392910      382811        syn-C2H3C(O)NH2, v=0
  687082.4166  0.0020 -2.6441 3  365.4565 79  71510 303392911      382810        syn-C2H3C(O)NH2, v=0
  687161.9533  0.0021 -5.4050 3  207.4720 71  71510 303351817      351520        syn-C2H3C(O)NH2, v=0
  687162.0969  0.0021 -5.4050 3  207.4720 71  71510 303351818      351521        syn-C2H3C(O)NH2, v=0
  687180.9121  0.0058 -4.6770 3  166.8627 73  71510 303361026      35 729        syn-C2H3C(O)NH2, v=0
  687236.6837  0.0574 -4.4619 3 1192.1391187  71510 303932271      922370        syn-C2H3C(O)NH2, v=0
  687239.9043  0.0040 -5.5715 3  263.0918 87  71510 303431528      431033        syn-C2H3C(O)NH2, v=0
  687279.8077  0.0751 -5.1796 3 1652.0836189  71510 303945044      944945        syn-C2H3C(O)NH2, v=0
  687279.8077  0.0751 -5.1796 3 1652.0836189  71510 303945045      944946        syn-C2H3C(O)NH2, v=0
  687331.9120  0.0096 -4.9136 3  629.6863137  71510 303681652      681355        syn-C2H3C(O)NH2, v=0
  687381.4436  0.0040 -4.8167 3  507.3558119  71510 303592039      591742        syn-C2H3C(O)NH2, v=0
  687452.6431  0.0019 -2.6717 3  371.8006 83  71510 303412813      402714        syn-C2H3C(O)NH2, v=0
  687452.6431  0.0019 -2.6717 3  371.8006 83  71510 303412814      402713        syn-C2H3C(O)NH2, v=0
  687464.5089  0.0412 -4.1492 3 1215.8512195  71510 303971681      961780        syn-C2H3C(O)NH2, v=0
  687464.5344  0.0412 -4.1492 3 1215.8512195  71510 303971781      961680        syn-C2H3C(O)NH2, v=0
  687528.0364  0.2336 -5.7580 3 1358.1284231  71510 303B5 1B4      B5 0B5        syn-C2H3C(O)NH2, v=0
  687528.0364  0.2336 -5.7580 3 1358.1284231  71510 303B5 2B4      B5 1B5        syn-C2H3C(O)NH2, v=0
  687674.9481  0.0017 -2.8682 3  426.2692103  71510 303512329      502228        syn-C2H3C(O)NH2, v=0
  687674.9482  0.0017 -2.8682 3  426.2692103  71510 303512328      502229        syn-C2H3C(O)NH2, v=0
  687713.1199  0.0742 -5.1400 3 1629.1326187  71510 303935043      934944        syn-C2H3C(O)NH2, v=0
  687713.1199  0.0742 -5.1400 3 1629.1326187  71510 303935044      934945        syn-C2H3C(O)NH2, v=0
  687768.6094  0.0019 -2.7027 3  379.6382 87  71510 303432716      422617        syn-C2H3C(O)NH2, v=0
  687768.6094  0.0019 -2.7027 3  379.6382 87  71510 303432717      422616        syn-C2H3C(O)NH2, v=0
  687861.5424  0.2183 -5.6338 3 1671.1162247  71510 303C3 6B7      C3 5B8        syn-C2H3C(O)NH2, v=0
  687861.5424  0.2183 -5.6338 3 1671.1162247  71510 303C3 7B7      C3 6B8        syn-C2H3C(O)NH2, v=0
  687902.7626  0.0237 -5.0027 3  752.3110149  71510 303741856      741559        syn-C2H3C(O)NH2, v=0
  687938.3583  0.0020 -3.2241 3  529.3987123  71510 303611943      601842        syn-C2H3C(O)NH2, v=0
  688001.9372  0.0018 -2.7373 3  388.9829 91  71510 303452619      442520        syn-C2H3C(O)NH2, v=0
  688001.9372  0.0018 -2.7373 3  388.9829 91  71510 303452620      442519        syn-C2H3C(O)NH2, v=0
  688033.5156  0.0018 -2.8193 3  412.2711 99  71510 303492425      482326        syn-C2H3C(O)NH2, v=0
  688033.5156  0.0018 -2.8193 3  412.2711 99  71510 303492426      482325        syn-C2H3C(O)NH2, v=0
  688065.8108  0.0071 -5.6836 3  258.1812 89  71510 303441232      44 737        syn-C2H3C(O)NH2, v=0
  688068.1490  0.0315 -4.2235 3 1149.6789185  71510 303922172      912071        syn-C2H3C(O)NH2, v=0
  688110.9409  0.0018 -2.7760 3  399.8527 95  71510 303472522      462423        syn-C2H3C(O)NH2, v=0
  688110.9409  0.0018 -2.7760 3  399.8527 95  71510 303472523      462422        syn-C2H3C(O)NH2, v=0
  688115.5370  0.0393 -4.1659 3 1206.2364193  71510 303961779      951878        syn-C2H3C(O)NH2, v=0
  688116.0661  0.0393 -4.1659 3 1206.2363193  71510 303961879      951778        syn-C2H3C(O)NH2, v=0
  688134.1114  0.0733 -5.1012 3 1606.4301185  71510 303925042      924943        syn-C2H3C(O)NH2, v=0
  688134.1114  0.0733 -5.1012 3 1606.4301185  71510 303925043      924944        syn-C2H3C(O)NH2, v=0
  688160.7646  0.0024 -3.6524 3  309.3331 97  71510 303481336      471037        syn-C2H3C(O)NH2, v=0
  688233.3170  0.0374 -4.3161 3 1159.5540185  71510 303922171      912270        syn-C2H3C(O)NH2, v=0
  688374.5002  0.1403 -5.3953 3 1126.9398181  71510 303902367      902070        syn-C2H3C(O)NH2, v=0
  688445.4851  0.0050 -4.8964 3  479.7201121  71510 303601347      601050        syn-C2H3C(O)NH2, v=0
  688474.2443  0.0025 -5.6532 3   85.0194 45  71510 3032214 9      211110        syn-C2H3C(O)NH2, v=0
  688474.2915  0.0025 -5.6532 3   85.0194 45  71510 3032214 8      211111        syn-C2H3C(O)NH2, v=0
  688543.0613  0.0724 -5.0631 3 1583.9762183  71510 303915041      914942        syn-C2H3C(O)NH2, v=0
  688543.0613  0.0724 -5.0631 3 1583.9762183  71510 303915042      914943        syn-C2H3C(O)NH2, v=0
  688736.8412  0.0021 -5.4709 3  198.8232 69  71510 303341816      341519        syn-C2H3C(O)NH2, v=0
  688736.9002  0.0021 -5.4709 3  198.8232 69  71510 303341817      341520        syn-C2H3C(O)NH2, v=0
  688867.4111  0.0037 -4.7983 3  522.3245121  71510 303602041      601744        syn-C2H3C(O)NH2, v=0
  688940.2432  0.0717 -5.0258 3 1561.7707181  71510 303905040      904941        syn-C2H3C(O)NH2, v=0
  688940.2432  0.0717 -5.0258 3 1561.7707181  71510 303905041      904942        syn-C2H3C(O)NH2, v=0
  689023.9161  0.0375 -4.1862 3 1195.8782191  71510 303951877      941976        syn-C2H3C(O)NH2, v=0
  689033.2196  0.0375 -4.1862 3 1195.8780191  71510 303951977      941876        syn-C2H3C(O)NH2, v=0
  689114.0877  0.0149 -4.9537 3  689.6905143  71510 303711754      711457        syn-C2H3C(O)NH2, v=0
  689120.8480  0.0017 -3.0894 3  492.5470117  71510 303582039      571938        syn-C2H3C(O)NH2, v=0
  689180.1422  0.0017 -3.0894 3  492.5454117  71510 303582038      571939        syn-C2H3C(O)NH2, v=0
  689249.6215  0.2232 -5.5517 3 1548.4088241  71510 303C0 4B6      C0 3B7        syn-C2H3C(O)NH2, v=0
  689249.6215  0.2232 -5.5517 3 1548.4088241  71510 303C0 5B6      C0 4B7        syn-C2H3C(O)NH2, v=0
  689325.9248  0.0709 -4.9892 3 1539.8133179  71510 303895039      894940        syn-C2H3C(O)NH2, v=0
  689325.9248  0.0709 -4.9892 3 1539.8133179  71510 303895040      894941        syn-C2H3C(O)NH2, v=0
  689468.7434  0.0054 -5.0367 3  153.6063 79  71510 30339 237      38 138        syn-C2H3C(O)NH2, v=0
  689468.7436  0.0054 -5.0367 3  153.6063 79  71510 30339 337      38 038        syn-C2H3C(O)NH2, v=0
  689549.2564  0.0022 -4.8093 3  130.8244 61  71510 303301318      291019        syn-C2H3C(O)NH2, v=0
  689584.4541  0.0063 -4.8423 3  678.0521139  71510 303692149      691852        syn-C2H3C(O)NH2, v=0
  689700.3687  0.0703 -4.9534 3 1518.1040177  71510 303885038      884939        syn-C2H3C(O)NH2, v=0
  689700.3687  0.0703 -4.9534 3 1518.1040177  71510 303885039      884940        syn-C2H3C(O)NH2, v=0
  689985.5107  0.2235 -5.7223 3 1746.8231251  71510 303C5 7B8      C5 6B9        syn-C2H3C(O)NH2, v=0
  689985.5107  0.2235 -5.7223 3 1746.8231251  71510 303C5 8B8      C5 7B9        syn-C2H3C(O)NH2, v=0
  690063.8322  0.0697 -4.9183 3 1496.6425175  71510 303875037      874938        syn-C2H3C(O)NH2, v=0
  690063.8322  0.0697 -4.9183 3 1496.6425175  71510 303875038      874939        syn-C2H3C(O)NH2, v=0
  690171.5687  0.0022 -5.5414 3  190.4307 67  71510 303331815      331518        syn-C2H3C(O)NH2, v=0
  690171.5922  0.0022 -5.5414 3  190.4307 67  71510 303331816      331519        syn-C2H3C(O)NH2, v=0
  690185.5903  0.0036 -4.3298 3  199.4560 77  71510 303381326      371027        syn-C2H3C(O)NH2, v=0
  690203.8298  0.2329 -5.6011 3 1428.6280235  71510 303B7 2B5      B7 1B6        syn-C2H3C(O)NH2, v=0
  690203.8298  0.2329 -5.6011 3 1428.6280235  71510 303B7 3B5      B7 2B6        syn-C2H3C(O)NH2, v=0
  690276.3869  0.0359 -4.2124 3 1184.7080189  71510 303941975      932074        syn-C2H3C(O)NH2, v=0
  690279.8382  0.0021 -4.8087 3  130.8001 61  71510 303301317      291020        syn-C2H3C(O)NH2, v=0
  690412.9173  0.0358 -4.2123 3 1184.7052189  71510 303942075      931974        syn-C2H3C(O)NH2, v=0
  690416.5675  0.0691 -4.8841 3 1475.4289173  71510 303865036      864937        syn-C2H3C(O)NH2, v=0
  690416.5675  0.0691 -4.8841 3 1475.4289173  71510 303865037      864938        syn-C2H3C(O)NH2, v=0
  690461.4411  0.0059 -3.5449 3  644.6077137  71510 303681950      671849        syn-C2H3C(O)NH2, v=0
  690579.4623  0.0026 -4.8826 3  375.2136101  71510 303501931      501634        syn-C2H3C(O)NH2, v=0
  690657.0658  0.0019 -3.2212 3  529.3255123  71510 303611942      601843        syn-C2H3C(O)NH2, v=0
  690725.2749  0.0110 -4.9037 3  769.2539149  71510 303742154      741857        syn-C2H3C(O)NH2, v=0
  690758.8219  0.0686 -4.8506 3 1454.4629171  71510 303855035      854936        syn-C2H3C(O)NH2, v=0
  690758.8219  0.0686 -4.8506 3 1454.4629171  71510 303855036      854937        syn-C2H3C(O)NH2, v=0
  691090.8381  0.0681 -4.8180 3 1433.7444169  71510 303845034      844935        syn-C2H3C(O)NH2, v=0
  691090.8381  0.0681 -4.8180 3 1433.7444169  71510 303845035      844936        syn-C2H3C(O)NH2, v=0
  691100.1599  0.0026 -4.8821 3  375.1962101  71510 303501932      501635        syn-C2H3C(O)NH2, v=0
  691412.8540  0.0677 -4.7862 3 1413.2732167  71510 303835033      834934        syn-C2H3C(O)NH2, v=0
  691412.8540  0.0677 -4.7862 3 1413.2732167  71510 303835034      834935        syn-C2H3C(O)NH2, v=0
  691476.4154  0.0022 -5.6171 3  182.2936 65  71510 303321814      321517        syn-C2H3C(O)NH2, v=0
  691476.4244  0.0022 -5.6171 3  182.2936 65  71510 303321815      321518        syn-C2H3C(O)NH2, v=0
  691533.8999  0.0346 -4.2496 3 1172.6304187  71510 303932073      922172        syn-C2H3C(O)NH2, v=0
  691600.1134  0.2257 -5.6060 3 1622.1650245  71510 303C2 5B7      C2 4B8        syn-C2H3C(O)NH2, v=0
  691600.1134  0.2257 -5.6060 3 1622.1650245  71510 303C2 6B7      C2 5B8        syn-C2H3C(O)NH2, v=0
  691725.1029  0.0674 -4.7553 3 1393.0493165  71510 303825032      824933        syn-C2H3C(O)NH2, v=0
  691725.1029  0.0674 -4.7553 3 1393.0493165  71510 303825033      824934        syn-C2H3C(O)NH2, v=0
  691807.6095  0.0048 -5.2011 3  345.7870101  71510 303501535      501040        syn-C2H3C(O)NH2, v=0
  691829.8036  0.0061 -4.8613 3  610.0045131  71510 303652144      651847        syn-C2H3C(O)NH2, v=0
  691914.0483  0.0661 -4.0757 3 1300.7626217  71510 303A8 6A2      A7 7A1        syn-C2H3C(O)NH2, v=0
  691914.0483  0.0661 -4.0757 3 1300.7626217  71510 303A8 7A2      A7 6A1        syn-C2H3C(O)NH2, v=0
  691915.7804  0.0633 -4.0858 3 1297.1010215  71510 303A7 7A0      A6 899        syn-C2H3C(O)NH2, v=0
  691915.7804  0.0633 -4.0858 3 1297.1010215  71510 303A7 8A0      A6 799        syn-C2H3C(O)NH2, v=0
  691920.5521  0.0691 -4.0654 3 1303.8940219  71510 303A9 5A4      A8 6A3        syn-C2H3C(O)NH2, v=0
  691920.5521  0.0691 -4.0654 3 1303.8940219  71510 303A9 6A4      A8 5A3        syn-C2H3C(O)NH2, v=0
  691929.4046  0.0609 -4.0956 3 1292.9029213  71510 303A6 898      A5 997        syn-C2H3C(O)NH2, v=0
  691929.4046  0.0609 -4.0956 3 1292.9029213  71510 303A6 998      A5 897        syn-C2H3C(O)NH2, v=0
  691932.3127  0.0728 -4.0546 3 1306.5006221  71510 303B0 4A6      A9 5A5        syn-C2H3C(O)NH2, v=0
  691932.3127  0.0728 -4.0546 3 1306.5006221  71510 303B0 5A6      A9 4A5        syn-C2H3C(O)NH2, v=0
  691946.8803  0.0772 -4.0434 3 1308.5870223  71510 303B1 3A8      B0 4A7        syn-C2H3C(O)NH2, v=0
  691946.8803  0.0772 -4.0434 3 1308.5870223  71510 303B1 4A8      B0 3A7        syn-C2H3C(O)NH2, v=0
  691959.4550  0.0586 -4.1052 3 1288.1612211  71510 303A5 996      A41095        syn-C2H3C(O)NH2, v=0
  691959.4550  0.0586 -4.1052 3 1288.1612211  71510 303A51096      A4 995        syn-C2H3C(O)NH2, v=0
  691962.2226  0.0825 -4.0318 3 1310.1574225  71510 303B2 2B0      B1 3A9        syn-C2H3C(O)NH2, v=0
  691962.2226  0.0825 -4.0318 3 1310.1574225  71510 303B2 3B0      B1 2A9        syn-C2H3C(O)NH2, v=0
  691976.6401  0.0891 -4.0196 3 1311.2152227  71510 303B3 1B2      B2 2B1        syn-C2H3C(O)NH2, v=0
  691976.6401  0.0891 -4.0196 3 1311.2152227  71510 303B3 2B2      B2 1B1        syn-C2H3C(O)NH2, v=0
  691988.7000  0.0971 -4.0068 3 1311.7635229  71510 303B4 0B4      B3 1B3        syn-C2H3C(O)NH2, v=0
  691988.7000  0.0971 -4.0068 3 1311.7635229  71510 303B4 1B4      B3 0B3        syn-C2H3C(O)NH2, v=0
  692011.6182  0.0564 -4.1148 3 1282.8672209  71510 303A41094      A31193        syn-C2H3C(O)NH2, v=0
  692011.6182  0.0564 -4.1148 3 1282.8672209  71510 303A41194      A31093        syn-C2H3C(O)NH2, v=0
  692027.8139  0.0670 -4.7252 3 1373.0725163  71510 303815031      814932        syn-C2H3C(O)NH2, v=0
  692027.8139  0.0670 -4.7252 3 1373.0725163  71510 303815032      814933        syn-C2H3C(O)NH2, v=0
  692086.3247  0.0017 -3.0100 3  472.8826113  71510 303562136      552035        syn-C2H3C(O)NH2, v=0
  692087.7349  0.0017 -3.0100 3  472.8825113  71510 303562135      552036        syn-C2H3C(O)NH2, v=0
  692093.1202  0.0542 -4.1244 3 1277.0111207  71510 303A31192      A21291        syn-C2H3C(O)NH2, v=0
  692093.1202  0.0542 -4.1244 3 1277.0111207  71510 303A31292      A21191        syn-C2H3C(O)NH2, v=0
  692121.2688  0.0067 -4.8576 3  613.1492135  71510 303671751      671454        syn-C2H3C(O)NH2, v=0
  692213.2811  0.0521 -4.1342 3 1270.5809205  71510 303A21290      A11389        syn-C2H3C(O)NH2, v=0
  692213.2811  0.0521 -4.1342 3 1270.5809205  71510 303A21390      A11289        syn-C2H3C(O)NH2, v=0
  692321.2119  0.0667 -4.6961 3 1353.3427161  71510 303805030      804931        syn-C2H3C(O)NH2, v=0
  692321.2119  0.0667 -4.6961 3 1353.3427161  71510 303805031      804932        syn-C2H3C(O)NH2, v=0
  692326.0625  0.0022 -3.2596 3  544.8893125  71510 303621944      611843        syn-C2H3C(O)NH2, v=0
  692384.3359  0.0500 -4.1445 3 1263.5624203  71510 303A11388      A01487        syn-C2H3C(O)NH2, v=0
  692384.3359  0.0500 -4.1445 3 1263.5624203  71510 303A11488      A01387        syn-C2H3C(O)NH2, v=0
  692605.5173  0.0665 -4.6679 3 1333.8597159  71510 303795029      794930        syn-C2H3C(O)NH2, v=0
  692605.5173  0.0665 -4.6679 3 1333.8597159  71510 303795030      794931        syn-C2H3C(O)NH2, v=0
  692622.6873  0.0479 -4.1554 3 1255.9383201  71510 303A01486      991585        syn-C2H3C(O)NH2, v=0
  692622.6874  0.0479 -4.1554 3 1255.9383201  71510 303A01586      991485        syn-C2H3C(O)NH2, v=0
  692660.8872  0.0023 -5.6986 3  174.4110 63  71510 303311813      311516        syn-C2H3C(O)NH2, v=0
  692660.8905  0.0023 -5.6986 3  174.4110 63  71510 303311814      311517        syn-C2H3C(O)NH2, v=0
  692771.4528  0.2332 -5.5719 3 1500.4173239  71510 303B9 3B6      B9 2B7        syn-C2H3C(O)NH2, v=0
  692771.4528  0.2332 -5.5719 3 1500.4173239  71510 303B9 4B6      B9 3B7        syn-C2H3C(O)NH2, v=0
  692880.9467  0.0663 -4.6406 3 1314.6234157  71510 303785028      784929        syn-C2H3C(O)NH2, v=0
  692880.9467  0.0663 -4.6406 3 1314.6234157  71510 303785029      784930        syn-C2H3C(O)NH2, v=0
  692950.8990  0.0459 -4.1674 3 1247.6873199  71510 303991584      981683        syn-C2H3C(O)NH2, v=0
  692950.8996  0.0459 -4.1674 3 1247.6873199  71510 303991684      981583        syn-C2H3C(O)NH2, v=0
  693073.3610  0.0033 -2.5862 3  363.3121 69  71510 3033432 2      3331 3        syn-C2H3C(O)NH2, v=0
  693073.3610  0.0033 -2.5862 3  363.3121 69  71510 3033432 3      3331 2        syn-C2H3C(O)NH2, v=0
  693106.1347  0.0047 -4.8918 3  479.7204121  71510 303601447      601150        syn-C2H3C(O)NH2, v=0
  693147.7126  0.0661 -4.6143 3 1295.6338155  71510 303775027      774928        syn-C2H3C(O)NH2, v=0
  693147.7126  0.0661 -4.6143 3 1295.6338155  71510 303775028      774929        syn-C2H3C(O)NH2, v=0
  693164.7412  0.0339 -4.2474 3 1172.5969187  71510 303932173      922072        syn-C2H3C(O)NH2, v=0
  693401.0218  0.0439 -4.1809 3 1238.7825197  71510 303981682      971781        syn-C2H3C(O)NH2, v=0
  693401.0359  0.0439 -4.1809 3 1238.7825197  71510 303981782      971681        syn-C2H3C(O)NH2, v=0
  693406.0239  0.0660 -4.5891 3 1276.8906153  71510 303765026      764927        syn-C2H3C(O)NH2, v=0
  693406.0239  0.0660 -4.5891 3 1276.8906153  71510 303765027      764928        syn-C2H3C(O)NH2, v=0
  693508.1121  0.0031 -3.6831 3  286.2001 95  71510 303471037      46 938        syn-C2H3C(O)NH2, v=0
  693509.2591  0.0027 -2.6065 3  365.7258 73  71510 3033631 5      3530 6        syn-C2H3C(O)NH2, v=0
  693509.2591  0.0027 -2.6065 3  365.7258 73  71510 3033631 6      3530 5        syn-C2H3C(O)NH2, v=0
  693550.3145  0.0022 -4.7419 3  138.3597 63  71510 303311319      301020        syn-C2H3C(O)NH2, v=0
  693656.0853  0.0659 -4.5649 3 1258.3938151  71510 303755025      754926        syn-C2H3C(O)NH2, v=0
  693656.0853  0.0659 -4.5649 3 1258.3938151  71510 303755026      754927        syn-C2H3C(O)NH2, v=0
  693754.1959  0.0017 -2.9436 3  455.0196109  71510 303542233      532132        syn-C2H3C(O)NH2, v=0
  693754.2181  0.0017 -2.9436 3  455.0196109  71510 303542232      532133        syn-C2H3C(O)NH2, v=0
  693837.4526  0.2296 -5.6808 3 1697.1981249  71510 303C4 6B8      C4 5B9        syn-C2H3C(O)NH2, v=0
  693837.4526  0.2296 -5.6808 3 1697.1981249  71510 303C4 7B8      C4 6B9        syn-C2H3C(O)NH2, v=0
  693857.6801  0.0055 -3.6291 3  377.4346107  71510 303531340      521241        syn-C2H3C(O)NH2, v=0
  693898.0980  0.0659 -4.5419 3 1240.1432149  71510 303745024      744925        syn-C2H3C(O)NH2, v=0
  693898.0980  0.0659 -4.5419 3 1240.1432149  71510 303745025      744926        syn-C2H3C(O)NH2, v=0
  693930.3603  0.0022 -2.6293 3  369.6087 77  71510 3033830 8      3729 9        syn-C2H3C(O)NH2, v=0
  693930.3603  0.0022 -2.6293 3  369.6087 77  71510 3033830 9      3729 8        syn-C2H3C(O)NH2, v=0
  693935.9645  0.0252 -4.0354 3  929.2340165  71510 303822162      812061        syn-C2H3C(O)NH2, v=0
  694020.4131  0.0419 -4.1966 3 1229.1894195  71510 303971780      961879        syn-C2H3C(O)NH2, v=0
  694020.7126  0.0419 -4.1966 3 1229.1894195  71510 303971880      961779        syn-C2H3C(O)NH2, v=0
  694132.2598  0.0658 -4.5200 3 1222.1388147  71510 303735023      734924        syn-C2H3C(O)NH2, v=0
  694132.2598  0.0658 -4.5200 3 1222.1388147  71510 303735024      734925        syn-C2H3C(O)NH2, v=0
  694222.3291  0.0058 -4.8399 3  660.4890137  71510 303682148      681851        syn-C2H3C(O)NH2, v=0
  694326.6464  0.0020 -2.6549 3  374.9678 81  71510 303402911      392812        syn-C2H3C(O)NH2, v=0
  694326.6464  0.0020 -2.6549 3  374.9678 81  71510 303402912      392811        syn-C2H3C(O)NH2, v=0
  694358.7645  0.0658 -4.4993 3 1204.3804145  71510 303725022      724923        syn-C2H3C(O)NH2, v=0
  694358.7645  0.0658 -4.4993 3 1204.3804145  71510 303725023      724924        syn-C2H3C(O)NH2, v=0
  694393.7986  0.0055 -3.5203 3  494.3156121  71510 303601644      591545        syn-C2H3C(O)NH2, v=0
  694452.5484  0.1387 -4.8398 3 1331.5329197  71510 303982474      972573        syn-C2H3C(O)NH2, v=0
  694514.4800  0.0048 -4.5912 3  169.2539 81  71510 30340 337      39 238        syn-C2H3C(O)NH2, v=0
  694514.4841  0.0048 -4.5912 3  169.2539 81  71510 30340 437      39 138        syn-C2H3C(O)NH2, v=0
  694577.8029  0.0659 -4.4799 3 1186.8679143  71510 303715021      714922        syn-C2H3C(O)NH2, v=0
  694577.8029  0.0659 -4.4799 3 1186.8679143  71510 303715022      714923        syn-C2H3C(O)NH2, v=0
  694671.0034  0.0017 -2.8862 3  438.8571105  71510 303522330      512229        syn-C2H3C(O)NH2, v=0
  694671.0037  0.0017 -2.8862 3  438.8571105  71510 303522329      512230        syn-C2H3C(O)NH2, v=0
  694683.5012  0.0019 -2.6835 3  381.8124 85  71510 303422814      412715        syn-C2H3C(O)NH2, v=0
  694683.5012  0.0019 -2.6835 3  381.8124 85  71510 303422815      412714        syn-C2H3C(O)NH2, v=0
  694789.5619  0.0659 -4.4618 3 1169.6012141  71510 303705020      704921        syn-C2H3C(O)NH2, v=0
  694789.5619  0.0659 -4.4618 3 1169.6012141  71510 303705021      704922        syn-C2H3C(O)NH2, v=0
  694881.2211  0.0401 -4.2157 3 1218.8617193  71510 303961878      951977        syn-C2H3C(O)NH2, v=0
  694886.6356  0.0401 -4.2157 3 1218.8615193  71510 303961978      951877        syn-C2H3C(O)NH2, v=0
  694910.6511  0.0021 -4.7408 3  138.3144 63  71510 303311318      301021        syn-C2H3C(O)NH2, v=0
  694979.6984  0.0019 -2.7154 3  390.1538 89  71510 303442717      432618        syn-C2H3C(O)NH2, v=0
  694979.6984  0.0019 -2.7154 3  390.1538 89  71510 303442718      432617        syn-C2H3C(O)NH2, v=0
  694994.2255  0.0660 -4.4452 3 1152.5802139  71510 303695019      694920        syn-C2H3C(O)NH2, v=0
  694994.2255  0.0660 -4.4452 3 1152.5802139  71510 303695020      694921        syn-C2H3C(O)NH2, v=0
  694996.6858  0.0029 -3.3758 3  553.6103127  71510 303631845      621746        syn-C2H3C(O)NH2, v=0
  695053.2658  0.0024 -5.5378 3   90.4302 47  71510 303231410      221111        syn-C2H3C(O)NH2, v=0
  695053.4050  0.0024 -5.5378 3   90.4302 47  71510 3032314 9      221112        syn-C2H3C(O)NH2, v=0
  695115.4871  0.0018 -2.8357 3  424.3293101  71510 303502426      492327        syn-C2H3C(O)NH2, v=0
  695115.4871  0.0018 -2.8357 3  424.3293101  71510 303502427      492326        syn-C2H3C(O)NH2, v=0
  695184.3530  0.0018 -2.7511 3  400.0068 93  71510 303462620      452521        syn-C2H3C(O)NH2, v=0
  695184.3530  0.0018 -2.7511 3  400.0068 93  71510 303462621      452520        syn-C2H3C(O)NH2, v=0
  695191.9742  0.0661 -4.4302 3 1135.8048137  71510 303685018      684919        syn-C2H3C(O)NH2, v=0
  695191.9742  0.0661 -4.4302 3 1135.8048137  71510 303685019      684920        syn-C2H3C(O)NH2, v=0
  695198.7001  0.0034 -4.3917 3  189.7845 75  71510 303371325      361026        syn-C2H3C(O)NH2, v=0
  695229.5920  0.2346 -5.5967 3 1573.4919243  71510 303C1 4B7      C1 3B8        syn-C2H3C(O)NH2, v=0
  695229.5920  0.2346 -5.5967 3 1573.4919243  71510 303C1 5B7      C1 4B8        syn-C2H3C(O)NH2, v=0
  695252.1426  0.0018 -2.7910 3  411.3903 97  71510 303482523      472424        syn-C2H3C(O)NH2, v=0
  695252.1426  0.0018 -2.7910 3  411.3903 97  71510 303482524      472423        syn-C2H3C(O)NH2, v=0
  695296.3294  0.1612 -5.7548 3 1413.6922201  71510 303A02872      A02575        syn-C2H3C(O)NH2, v=0
  695314.2988  0.0025 -4.9079 3  362.6401 99  71510 303491930      491633        syn-C2H3C(O)NH2, v=0
  695349.2593  0.0018 -3.1159 3  507.0894119  71510 303592040      581939        syn-C2H3C(O)NH2, v=0
  695382.9853  0.0663 -4.4168 3 1119.2748135  71510 303675017      674918        syn-C2H3C(O)NH2, v=0
  695382.9853  0.0663 -4.4168 3 1119.2748135  71510 303675018      674919        syn-C2H3C(O)NH2, v=0
  695459.3710  0.0018 -3.1158 3  507.0864119  71510 303592039      581940        syn-C2H3C(O)NH2, v=0
  695499.7661  0.0035 -4.8088 3  507.0844119  71510 303592040      591743        syn-C2H3C(O)NH2, v=0
  695567.4330  0.0664 -4.4052 3 1102.9903133  71510 303665016      664917        syn-C2H3C(O)NH2, v=0
  695567.4330  0.0664 -4.4052 3 1102.9903133  71510 303665017      664918        syn-C2H3C(O)NH2, v=0
  695603.6536  0.0025 -4.9075 3  362.6304 99  71510 303491931      491634        syn-C2H3C(O)NH2, v=0
  695678.7521  0.0044 -3.4618 3  531.3360125  71510 303621745      611646        syn-C2H3C(O)NH2, v=0
  695745.4882  0.0666 -4.3955 3 1086.9510131  71510 303655015      654916        syn-C2H3C(O)NH2, v=0
  695745.4882  0.0666 -4.3955 3 1086.9510131  71510 303655016      654917        syn-C2H3C(O)NH2, v=0
  695751.5442  0.1000 -5.7435 3 1969.6638213  71510 303A65155      A65056        syn-C2H3C(O)NH2, v=0
  695751.5442  0.1000 -5.7435 3 1969.6638213  71510 303A65156      A65057        syn-C2H3C(O)NH2, v=0
  695765.2496  0.0049 -3.4888 3  627.1295135  71510 303671949      661848        syn-C2H3C(O)NH2, v=0
  695917.3189  0.0668 -4.3880 3 1071.1568129  71510 303645014      644915        syn-C2H3C(O)NH2, v=0
  695917.3189  0.0668 -4.3880 3 1071.1568129  71510 303645015      644916        syn-C2H3C(O)NH2, v=0
  695919.0929  0.0024 -3.2979 3  560.6838127  71510 303631945      621844        syn-C2H3C(O)NH2, v=0
  696052.2499  0.0380 -4.3308 3 1182.7114187  71510 303932172      922271        syn-C2H3C(O)NH2, v=0
  696076.6353  0.0383 -4.2401 3 1207.7349191  71510 303951976      942075        syn-C2H3C(O)NH2, v=0
  696083.0900  0.0670 -4.3829 3 1055.6078127  71510 303635013      634914        syn-C2H3C(O)NH2, v=0
  696083.0900  0.0670 -4.3829 3 1055.6078127  71510 303635014      634915        syn-C2H3C(O)NH2, v=0
  696158.6793  0.0382 -4.2400 3 1207.7332191  71510 303952076      941975        syn-C2H3C(O)NH2, v=0
  696191.5850  0.2446 -5.6440 3 1452.7115237  71510 303B8 2B6      B8 1B7        syn-C2H3C(O)NH2, v=0
  696191.5850  0.2446 -5.6440 3 1452.7115237  71510 303B8 3B6      B8 2B7        syn-C2H3C(O)NH2, v=0
  696242.9636  0.0673 -4.3804 3 1040.3037125  71510 303625012      624913        syn-C2H3C(O)NH2, v=0
  696242.9636  0.0673 -4.3804 3 1040.3037125  71510 303625013      624914        syn-C2H3C(O)NH2, v=0
  696326.9872  0.0981 -5.6960 3 1943.7367211  71510 303A55154      A55055        syn-C2H3C(O)NH2, v=0
  696326.9872  0.0981 -5.6960 3 1943.7367211  71510 303A55155      A55056        syn-C2H3C(O)NH2, v=0
  696397.0986  0.0676 -4.3809 3 1025.2445123  71510 303615011      614912        syn-C2H3C(O)NH2, v=0
  696397.0986  0.0676 -4.3809 3 1025.2445123  71510 303615012      614913        syn-C2H3C(O)NH2, v=0
  696545.6511  0.0678 -4.3849 3 1010.4301121  71510 303605010      604911        syn-C2H3C(O)NH2, v=0
  696545.6511  0.0678 -4.3849 3 1010.4301121  71510 303605011      604912        syn-C2H3C(O)NH2, v=0
  696567.8642  0.4562 -5.6941 3 1688.2684221  71510 303B02882      A92981        syn-C2H3C(O)NH2, v=0
  696675.0776  0.2669 -5.7432 3 1396.8585201  71510 303A02674      A02377        syn-C2H3C(O)NH2, v=0
  696688.7743  0.0681 -4.3929 3  995.8603119  71510 3035950 9      594910        syn-C2H3C(O)NH2, v=0
  696688.7743  0.0681 -4.3929 3  995.8603119  71510 303595010      594911        syn-C2H3C(O)NH2, v=0
  696698.3822  0.0138 -3.8099 3  780.3294151  71510 303752056      741955        syn-C2H3C(O)NH2, v=0
  696744.7126  0.0045 -4.9392 3  443.0960117  71510 303581246      58 949        syn-C2H3C(O)NH2, v=0
  696801.3999  0.0024 -4.3049 3  193.9311 77  71510 303381226      37 929        syn-C2H3C(O)NH2, v=0
  696826.6188  0.0684 -4.4057 3  981.5352117  71510 3035850 8      5849 9        syn-C2H3C(O)NH2, v=0
  696826.6188  0.0684 -4.4057 3  981.5352117  71510 3035850 9      584910        syn-C2H3C(O)NH2, v=0
  696846.7250  0.0021 -3.2549 3  544.7686125  71510 303621943      611844        syn-C2H3C(O)NH2, v=0
  696868.2626  0.0023 -4.6779 3  146.1760 65  71510 303321320      311021        syn-C2H3C(O)NH2, v=0
  696887.2689  0.0964 -5.6491 3 1918.0597209  71510 303A45153      A45054        syn-C2H3C(O)NH2, v=0
  696887.2689  0.0964 -5.6491 3 1918.0597209  71510 303A45154      A45055        syn-C2H3C(O)NH2, v=0
  696899.0443  0.0036 -4.8258 3  492.2879117  71510 303582038      581741        syn-C2H3C(O)NH2, v=0
  696959.3321  0.0688 -4.4244 3  967.4546115  71510 3035750 7      5749 8        syn-C2H3C(O)NH2, v=0
  696959.3321  0.0688 -4.4244 3  967.4546115  71510 3035750 8      5749 9        syn-C2H3C(O)NH2, v=0
  697049.6244  0.0048 -5.6224 3  249.4123 93  71510 30346 640      46 343        syn-C2H3C(O)NH2, v=0
  697050.5107  0.0048 -5.6224 3  249.4123 93  71510 30346 740      46 443        syn-C2H3C(O)NH2, v=0
  697087.0590  0.0691 -4.4502 3  953.6184113  71510 3035650 6      5649 7        syn-C2H3C(O)NH2, v=0
  697087.0590  0.0691 -4.4502 3  953.6184113  71510 3035650 7      5649 8        syn-C2H3C(O)NH2, v=0
  697209.9417  0.0695 -4.4855 3  940.0266111  71510 3035550 5      5549 6        syn-C2H3C(O)NH2, v=0
  697209.9417  0.0695 -4.4855 3  940.0266111  71510 3035550 6      5549 7        syn-C2H3C(O)NH2, v=0
  697255.5706  0.0129 -4.9283 3  788.1232151  71510 303752155      751858        syn-C2H3C(O)NH2, v=0
  697328.1196  0.0698 -4.5334 3  926.6790109  71510 3035450 4      5449 5        syn-C2H3C(O)NH2, v=0
  697328.1196  0.0698 -4.5334 3  926.6790109  71510 3035450 5      5449 6        syn-C2H3C(O)NH2, v=0
  697363.7786  0.0028 -3.6437 3  303.7188 97  71510 303481237      47 938        syn-C2H3C(O)NH2, v=0
  697432.7229  0.0947 -5.6029 3 1892.6326207  71510 303A35152      A35053        syn-C2H3C(O)NH2, v=0
  697432.7229  0.0947 -5.6029 3 1892.6326207  71510 303A35153      A35054        syn-C2H3C(O)NH2, v=0
  697441.7294  0.0702 -4.5994 3  913.5756107  71510 3035350 3      5349 4        syn-C2H3C(O)NH2, v=0
  697441.7294  0.0702 -4.5994 3  913.5756107  71510 3035350 4      5349 5        syn-C2H3C(O)NH2, v=0
  697457.2437  0.0368 -4.2739 3 1195.7184189  71510 303942074      932173        syn-C2H3C(O)NH2, v=0
  697550.9051  0.0706 -4.6938 3  900.7163105  71510 3035250 2      5249 3        syn-C2H3C(O)NH2, v=0
  697550.9051  0.0706 -4.6938 3  900.7163105  71510 3035250 3      5249 4        syn-C2H3C(O)NH2, v=0
  697576.8659  0.2373 -5.6523 3 1647.8476247  71510 303C3 5B8      C3 4B9        syn-C2H3C(O)NH2, v=0
  697576.8659  0.2373 -5.6523 3 1647.8476247  71510 303C3 6B8      C3 5B9        syn-C2H3C(O)NH2, v=0
  697655.7781  0.0710 -4.8398 3  888.1010103  71510 3035150 1      5149 2        syn-C2H3C(O)NH2, v=0
  697655.7781  0.0710 -4.8398 3  888.1010103  71510 3035150 2      5149 3        syn-C2H3C(O)NH2, v=0
  697756.4772  0.0714 -5.1111 3  875.7296101  71510 3035050 0      5049 1        syn-C2H3C(O)NH2, v=0
  697756.4772  0.0714 -5.1111 3  875.7296101  71510 3035050 1      5049 2        syn-C2H3C(O)NH2, v=0
  697919.7882  0.0700 -4.1118 3 1323.8423219  71510 303A9 6A3      A8 7A2        syn-C2H3C(O)NH2, v=0
  697919.7882  0.0700 -4.1118 3 1323.8423219  71510 303A9 7A3      A8 6A2        syn-C2H3C(O)NH2, v=0
  697920.5476  0.0671 -4.1216 3 1320.1808217  71510 303A8 7A1      A7 8A0        syn-C2H3C(O)NH2, v=0
  697920.5476  0.0671 -4.1216 3 1320.1808217  71510 303A8 8A1      A7 7A0        syn-C2H3C(O)NH2, v=0
  697926.9613  0.0733 -4.1016 3 1326.9740221  71510 303B0 5A5      A9 6A4        syn-C2H3C(O)NH2, v=0
  697926.9613  0.0733 -4.1016 3 1326.9740221  71510 303B0 6A5      A9 5A4        syn-C2H3C(O)NH2, v=0
  697932.7906  0.0645 -4.1312 3 1315.9832215  71510 303A7 899      A6 998        syn-C2H3C(O)NH2, v=0
  697932.7906  0.0645 -4.1312 3 1315.9832215  71510 303A7 999      A6 898        syn-C2H3C(O)NH2, v=0
  697939.1660  0.0771 -4.0910 3 1329.5809223  71510 303B1 4A7      B0 5A6        syn-C2H3C(O)NH2, v=0
  697939.1660  0.0771 -4.0910 3 1329.5809223  71510 303B1 5A7      B0 4A6        syn-C2H3C(O)NH2, v=0
  697954.0105  0.0817 -4.0800 3 1331.6679225  71510 303B2 3A9      B1 4A8        syn-C2H3C(O)NH2, v=0
  697954.0105  0.0817 -4.0800 3 1331.6679225  71510 303B2 4A9      B1 3A8        syn-C2H3C(O)NH2, v=0
  697960.9087  0.0621 -4.1406 3 1311.2425213  71510 303A6 997      A51096        syn-C2H3C(O)NH2, v=0
  697960.9087  0.0621 -4.1406 3 1311.2425213  71510 303A61097      A5 996        syn-C2H3C(O)NH2, v=0
  697963.6753  0.0931 -5.5574 3 1867.4553205  71510 303A25151      A25052        syn-C2H3C(O)NH2, v=0
  697963.6753  0.0931 -5.5574 3 1867.4553205  71510 303A25152      A25053        syn-C2H3C(O)NH2, v=0
  697969.5064  0.0873 -4.0684 3 1333.2388227  71510 303B3 2B1      B2 3B0        syn-C2H3C(O)NH2, v=0
  697969.5064  0.0873 -4.0684 3 1333.2388227  71510 303B3 3B1      B2 2B0        syn-C2H3C(O)NH2, v=0
  697970.6630  0.1097 -5.3181 3 1050.5172175  71510 303872265      871968        syn-C2H3C(O)NH2, v=0
  697983.9866  0.0942 -4.0564 3 1334.2971229  71510 303B4 1B3      B3 2B2        syn-C2H3C(O)NH2, v=0
  697983.9866  0.0942 -4.0564 3 1334.2971229  71510 303B4 2B3      B3 1B2        syn-C2H3C(O)NH2, v=0
  697996.0433  0.1025 -4.0438 3 1334.8458231  71510 303B5 0B5      B4 1B4        syn-C2H3C(O)NH2, v=0
  697996.0433  0.1025 -4.0438 3 1334.8458231  71510 303B5 1B5      B4 0B4        syn-C2H3C(O)NH2, v=0
  698010.3925  0.0598 -4.1498 3 1305.9503211  71510 303A51095      A41194        syn-C2H3C(O)NH2, v=0
  698010.3925  0.0598 -4.1498 3 1305.9503211  71510 303A51195      A41094        syn-C2H3C(O)NH2, v=0
  698088.1955  0.0576 -4.1592 3 1300.0969209  71510 303A41193      A31292        syn-C2H3C(O)NH2, v=0
  698088.1955  0.0576 -4.1592 3 1300.0969209  71510 303A41293      A31192        syn-C2H3C(O)NH2, v=0
  698203.2520  0.0553 -4.1687 3 1293.6707207  71510 303A31291      A21390        syn-C2H3C(O)NH2, v=0
  698203.2520  0.0553 -4.1687 3 1293.6707207  71510 303A31391      A21290        syn-C2H3C(O)NH2, v=0
  698245.1262  0.1320 -5.5825 3 1278.4331191  71510 303952768      952471        syn-C2H3C(O)NH2, v=0
  698367.2391  0.0531 -4.1785 3 1286.6578205  71510 303A21389      A11488        syn-C2H3C(O)NH2, v=0
  698367.2391  0.0531 -4.1785 3 1286.6578205  71510 303A21489      A11388        syn-C2H3C(O)NH2, v=0
  698424.6571  0.0028 -3.3397 3  576.7929129  71510 303641946      631845        syn-C2H3C(O)NH2, v=0
  698476.5760  0.0363 -4.2726 3 1195.6974189  71510 303942174      932073        syn-C2H3C(O)NH2, v=0
  698480.4450  0.0916 -5.5125 3 1842.5275203  71510 303A15150      A15051        syn-C2H3C(O)NH2, v=0
  698480.4450  0.0916 -5.5125 3 1842.5275203  71510 303A15151      A15052        syn-C2H3C(O)NH2, v=0
  698512.3210  0.0044 -4.9374 3  443.0961117  71510 303581346      581049        syn-C2H3C(O)NH2, v=0
  698595.7309  0.0510 -4.1890 3 1279.0417203  71510 303A11487      A01586        syn-C2H3C(O)NH2, v=0
  698595.7309  0.0510 -4.1890 3 1279.0417203  71510 303A11587      A01486        syn-C2H3C(O)NH2, v=0
  698675.2092  0.0031 -4.4485 3  180.4309 73  71510 303361324      351025        syn-C2H3C(O)NH2, v=0
  698702.5331  0.0017 -3.0331 3  486.8343115  71510 303572137      562036        syn-C2H3C(O)NH2, v=0
  698705.3830  0.0017 -3.0331 3  486.8342115  71510 303572136      562037        syn-C2H3C(O)NH2, v=0
  698711.3923  0.0040 -3.4351 3  610.0045133  71510 303661948      651847        syn-C2H3C(O)NH2, v=0
  698754.3073  0.2449 -5.6161 3 1525.1008241  71510 303C0 3B7      C0 2B8        syn-C2H3C(O)NH2, v=0
  698754.3073  0.2449 -5.6161 3 1525.1008241  71510 303C0 4B7      C0 3B8        syn-C2H3C(O)NH2, v=0
  698792.9603  0.0041 -4.3228 3  185.1939 83  71510 30341 437      40 338        syn-C2H3C(O)NH2, v=0
  698793.0179  0.0041 -4.3228 3  185.1939 83  71510 30341 537      40 238        syn-C2H3C(O)NH2, v=0
  698898.8901  0.0038 -5.2413 3  122.7818 63  71510 303311022      30 525        syn-C2H3C(O)NH2, v=0
  698910.0189  0.0488 -4.2004 3 1270.8016201  71510 303A01585      991684        syn-C2H3C(O)NH2, v=0
  698910.0192  0.0488 -4.2004 3 1270.8016201  71510 303A01685      991584        syn-C2H3C(O)NH2, v=0
  698983.3436  0.0902 -5.4683 3 1817.8492201  71510 303A05149      A05050        syn-C2H3C(O)NH2, v=0
  698983.3436  0.0902 -5.4683 3 1817.8492201  71510 303A05150      A05051        syn-C2H3C(O)NH2, v=0
  699296.4746  0.0024 -4.6171 3  154.2813 67  71510 303331321      321022        syn-C2H3C(O)NH2, v=0
  699313.7276  0.0021 -4.6761 3  146.0945 65  71510 303321319      311022        syn-C2H3C(O)NH2, v=0
  699340.1173  0.0467 -4.2132 3 1261.9119199  71510 303991683      981782        syn-C2H3C(O)NH2, v=0
  699340.1250  0.0467 -4.2132 3 1261.9119199  71510 303991783      981682        syn-C2H3C(O)NH2, v=0
  699472.6759  0.0888 -5.4248 3 1793.4202199  71510 303995148      995049        syn-C2H3C(O)NH2, v=0
  699472.6759  0.0888 -5.4248 3 1793.4202199  71510 303995149      995050        syn-C2H3C(O)NH2, v=0
  699484.5877  0.0034 -3.3853 3  593.2290131  71510 303651947      641846        syn-C2H3C(O)NH2, v=0
  699501.8946  0.0533 -4.4621 3 1215.7255189  71510 303942272      932371        syn-C2H3C(O)NH2, v=0
  699597.2105  0.0043 -5.7069 3  251.9405 85  71510 303421527      421032        syn-C2H3C(O)NH2, v=0
  699617.6526  0.0025 -4.9351 3  350.3417 97  71510 303481929      481632        syn-C2H3C(O)NH2, v=0
  699689.8192  0.0055 -4.8704 3  572.3071131  71510 303651650      651353        syn-C2H3C(O)NH2, v=0
  699715.5576  0.0060 -5.3370 3  327.2874 99  71510 303491435      49 940        syn-C2H3C(O)NH2, v=0
  699775.1554  0.0025 -4.9349 3  350.3364 97  71510 303481930      481633        syn-C2H3C(O)NH2, v=0
  699796.9279  0.0027 -3.6782 3  286.1950 95  71510 303471137      46 838        syn-C2H3C(O)NH2, v=0
  699811.8202  0.2413 -5.7283 3 1723.4799251  71510 303C5 6B9      C5 5C0        syn-C2H3C(O)NH2, v=0
  699811.8202  0.2413 -5.7283 3 1723.4799251  71510 303C5 7B9      C5 6C0        syn-C2H3C(O)NH2, v=0
  699812.8925  0.0055 -4.8996 3  532.6518127  71510 303631449      631152        syn-C2H3C(O)NH2, v=0
  699847.5962  0.0054 -4.8397 3  643.1703135  71510 303672147      671850        syn-C2H3C(O)NH2, v=0
  699891.1268  0.0042 -2.5767 3  370.1399 67  71510 3033333 0      3232 1        syn-C2H3C(O)NH2, v=0
  699891.1268  0.0042 -2.5767 3  370.1399 67  71510 3033333 1      3232 0        syn-C2H3C(O)NH2, v=0
  699894.8194  0.0137 -4.9213 3  761.0950149  71510 303742055      741758        syn-C2H3C(O)NH2, v=0
  699929.9793  0.0447 -4.2281 3 1252.3395197  71510 303981781      971880        syn-C2H3C(O)NH2, v=0
  699930.1483  0.0447 -4.2281 3 1252.3395197  71510 303981881      971780        syn-C2H3C(O)NH2, v=0
  699948.7402  0.0875 -5.3820 3 1769.2403197  71510 303985147      985048        syn-C2H3C(O)NH2, v=0
  699948.7402  0.0875 -5.3820 3 1769.2403197  71510 303985148      985049        syn-C2H3C(O)NH2, v=0
  700016.6794  0.1978 -5.0425 3 1416.8128203  71510 303A12576      A02675        syn-C2H3C(O)NH2, v=0
  700184.4117  0.0115 -4.9007 3  716.1393145  71510 303721954      721657        syn-C2H3C(O)NH2, v=0
  700333.2228  0.0033 -2.5954 3  371.5825 71  71510 3033532 3      3431 4        syn-C2H3C(O)NH2, v=0
  700333.2228  0.0033 -2.5954 3  371.5825 71  71510 3033532 4      3431 3        syn-C2H3C(O)NH2, v=0
  700411.8284  0.0863 -5.3399 3 1745.3094195  71510 303975146      975047        syn-C2H3C(O)NH2, v=0
  700411.8284  0.0863 -5.3399 3 1745.3094195  71510 303975147      975048        syn-C2H3C(O)NH2, v=0
  700446.3479  0.0028 -4.5035 3  171.3992 71  71510 303351323      341024        syn-C2H3C(O)NH2, v=0
  700513.3777  0.0037 -3.6596 3  315.4233 99  71510 303491138      481039        syn-C2H3C(O)NH2, v=0
  700580.0469  0.0026 -4.5592 3  162.6856 69  71510 303341322      331023        syn-C2H3C(O)NH2, v=0
  700586.0355  0.0017 -2.9642 3  468.4085111  71510 303552234      542133        syn-C2H3C(O)NH2, v=0
  700586.0845  0.0017 -2.9642 3  468.4085111  71510 303552233      542134        syn-C2H3C(O)NH2, v=0
  700629.8475  0.3590 -5.4725 3 1595.1768215  71510 303A72780      A62879        syn-C2H3C(O)NH2, v=0
  700654.6587  0.0047 -3.6468 3  345.8381103  71510 303511239      501140        syn-C2H3C(O)NH2, v=0
  700746.3601  0.0427 -4.2460 3 1242.0405195  71510 303971879      961978        syn-C2H3C(O)NH2, v=0
  700749.4960  0.0427 -4.2460 3 1242.0404195  71510 303971979      961878        syn-C2H3C(O)NH2, v=0
  700765.4439  0.0026 -2.6163 3  374.4900 75  71510 3033731 6      3630 7        syn-C2H3C(O)NH2, v=0
  700765.4439  0.0026 -2.6163 3  374.4900 75  71510 3033731 7      3630 6        syn-C2H3C(O)NH2, v=0
  700862.2263  0.0852 -5.2984 3 1721.6272193  71510 303965145      965046        syn-C2H3C(O)NH2, v=0
  700862.2263  0.0852 -5.2984 3 1721.6272193  71510 303965146      965047        syn-C2H3C(O)NH2, v=0
  700864.8052  0.0041 -5.4321 3  278.5386 97  71510 30348 741      48 444        syn-C2H3C(O)NH2, v=0
  700868.7994  0.0041 -5.4321 3  278.5386 97  71510 30348 841      48 544        syn-C2H3C(O)NH2, v=0
  701180.2632  0.0022 -2.6399 3  378.8687 79  71510 3033930 9      382910        syn-C2H3C(O)NH2, v=0
  701180.2632  0.0022 -2.6399 3  378.8687 79  71510 303393010      3829 9        syn-C2H3C(O)NH2, v=0
  701208.3068  0.2465 -5.6421 3 1598.7752245  71510 303C2 4B8      C2 3B9        syn-C2H3C(O)NH2, v=0
  701208.3068  0.2465 -5.6421 3 1598.7752245  71510 303C2 5B8      C2 4B9        syn-C2H3C(O)NH2, v=0
  701300.2135  0.0841 -5.2577 3 1698.1937191  71510 303955144      955045        syn-C2H3C(O)NH2, v=0
  701300.2135  0.0841 -5.2577 3 1698.1937191  71510 303955145      955046        syn-C2H3C(O)NH2, v=0
  701313.9131  0.0043 -4.4487 3  189.3346 77  71510 303381127      37 830        syn-C2H3C(O)NH2, v=0
  701380.8473  0.0026 -3.6412 3  321.3057 99  71510 303491337      481038        syn-C2H3C(O)NH2, v=0
  701454.4598  0.0018 -3.1437 3  521.9047121  71510 303602041      591940        syn-C2H3C(O)NH2, v=0
  701519.0333  0.0023 -5.4314 3   96.0944 49  71510 303241411      231112        syn-C2H3C(O)NH2, v=0
  701519.4199  0.0023 -5.4314 3   96.0944 49  71510 303241410      231113        syn-C2H3C(O)NH2, v=0
  701566.6594  0.0020 -2.6663 3  384.7261 83  71510 303412912      402813        syn-C2H3C(O)NH2, v=0
  701566.6594  0.0020 -2.6663 3  384.7261 83  71510 303412913      402812        syn-C2H3C(O)NH2, v=0
  701623.5377  0.0041 -4.9970 3  407.6947113  71510 303561145      56 848        syn-C2H3C(O)NH2, v=0
  701641.1491  0.0017 -2.9049 3  451.7012107  71510 303532331      522230        syn-C2H3C(O)NH2, v=0
  701641.1497  0.0017 -2.9049 3  451.7012107  71510 303532330      522231        syn-C2H3C(O)NH2, v=0
  701655.5116  0.0018 -3.1434 3  521.8991121  71510 303602040      591941        syn-C2H3C(O)NH2, v=0
  701707.9735  0.0027 -3.7316 3  268.8163 93  71510 30346 937      45 838        syn-C2H3C(O)NH2, v=0
  701726.0641  0.0831 -5.2177 3 1675.0088189  71510 303945143      945044        syn-C2H3C(O)NH2, v=0
  701726.0641  0.0831 -5.2177 3 1675.0088189  71510 303945144      945045        syn-C2H3C(O)NH2, v=0
  701810.2281  0.0062 -3.5843 3  458.5348117  71510 303581543      571444        syn-C2H3C(O)NH2, v=0
  701846.7954  0.0306 -4.2755 3 1136.1429183  71510 303912270      902169        syn-C2H3C(O)NH2, v=0
  701882.6897  0.0408 -4.2687 3 1230.9545193  71510 303961977      952076        syn-C2H3C(O)NH2, v=0
  701908.6483  0.0019 -2.6958 3  392.0719 87  71510 303432815      422716        syn-C2H3C(O)NH2, v=0
  701908.6483  0.0019 -2.6958 3  392.0719 87  71510 303432816      422715        syn-C2H3C(O)NH2, v=0
  701931.6964  0.0408 -4.2687 3 1230.9535193  71510 303962077      951976        syn-C2H3C(O)NH2, v=0
  701967.8666  0.2718 -5.2544 3 1504.6928209  71510 303A42678      A32777        syn-C2H3C(O)NH2, v=0
  701994.7606  0.0034 -4.8207 3  492.1176117  71510 303582039      581742        syn-C2H3C(O)NH2, v=0
  702049.8914  0.0306 -4.2561 3 1113.1730181  71510 303902269      892168        syn-C2H3C(O)NH2, v=0
  702140.0465  0.0822 -5.1784 3 1652.0722187  71510 303935142      935043        syn-C2H3C(O)NH2, v=0
  702140.0465  0.0822 -5.1784 3 1652.0722187  71510 303935143      935044        syn-C2H3C(O)NH2, v=0
  702178.2964  0.2567 -5.6874 3 1476.9951239  71510 303B9 2B7      B9 1B8        syn-C2H3C(O)NH2, v=0
  702178.2964  0.2567 -5.6874 3 1476.9951239  71510 303B9 3B7      B9 2B8        syn-C2H3C(O)NH2, v=0
  702178.6841  0.0018 -2.8529 3  436.6413103  71510 303512427      502328        syn-C2H3C(O)NH2, v=0
  702178.6841  0.0018 -2.8529 3  436.6413103  71510 303512428      502327        syn-C2H3C(O)NH2, v=0
  702183.1084  0.0019 -2.7288 3  400.9183 91  71510 303452718      442619        syn-C2H3C(O)NH2, v=0
  702183.1084  0.0019 -2.7288 3  400.9183 91  71510 303452719      442618        syn-C2H3C(O)NH2, v=0
  702184.6547  0.0036 -4.1348 3  201.4147 85  71510 30342 537      41 438        syn-C2H3C(O)NH2, v=0
  702185.2923  0.0036 -4.1348 3  201.4147 85  71510 30342 637      41 338        syn-C2H3C(O)NH2, v=0
  702241.5831  0.0040 -4.9964 3  407.6947113  71510 303561245      56 948        syn-C2H3C(O)NH2, v=0
  702356.4708  0.0019 -2.7656 3  411.2809 95  71510 303472621      462522        syn-C2H3C(O)NH2, v=0
  702356.4708  0.0019 -2.7656 3  411.2809 95  71510 303472622      462521        syn-C2H3C(O)NH2, v=0
  702379.5003  0.0018 -2.8068 3  423.1797 99  71510 303492524      482425        syn-C2H3C(O)NH2, v=0
  702379.5003  0.0018 -2.8068 3  423.1797 99  71510 303492525      482424        syn-C2H3C(O)NH2, v=0
  702542.4239  0.0814 -5.1398 3 1629.3838185  71510 303925141      925042        syn-C2H3C(O)NH2, v=0
  702542.4239  0.0814 -5.1398 3 1629.3838185  71510 303925142      925043        syn-C2H3C(O)NH2, v=0
  702688.0882  0.0100 -4.9385 3  704.1723141  71510 303702248      701951        syn-C2H3C(O)NH2, v=0
  702884.8361  0.0853 -4.6346 3 1273.0387193  71510 303962373      952472        syn-C2H3C(O)NH2, v=0
  702933.4540  0.0805 -5.1020 3 1606.9436183  71510 303915140      915041        syn-C2H3C(O)NH2, v=0
  702933.4540  0.0805 -5.1020 3 1606.9436183  71510 303915141      915042        syn-C2H3C(O)NH2, v=0
  703088.2691  0.0954 -5.4268 3 1149.9015181  71510 303902664      902367        syn-C2H3C(O)NH2, v=0
  703135.1717  0.0393 -4.3491 3 1206.0605189  71510 303942173      932272        syn-C2H3C(O)NH2, v=0
  703137.0558  0.0026 -3.7303 3  268.8155 93  71510 303461037      45 738        syn-C2H3C(O)NH2, v=0
  703286.7326  0.0023 -3.2906 3  560.4890127  71510 303631944      621845        syn-C2H3C(O)NH2, v=0
  703294.2080  0.0318 -4.2960 3 1159.2520185  71510 303922271      912170        syn-C2H3C(O)NH2, v=0
  703304.5426  0.0392 -4.2996 3 1218.9961191  71510 303952075      942174        syn-C2H3C(O)NH2, v=0
  703313.3897  0.0798 -5.0649 3 1584.7512181  71510 303905139      905040        syn-C2H3C(O)NH2, v=0
  703313.3897  0.0798 -5.0649 3 1584.7512181  71510 303905140      905041        syn-C2H3C(O)NH2, v=0
  703403.8677  0.0037 -5.2834 3  308.9397101  71510 30350 842      50 545        syn-C2H3C(O)NH2, v=0
  703420.0173  0.0037 -5.2834 3  308.9397101  71510 30350 942      50 645        syn-C2H3C(O)NH2, v=0
  703537.6997  0.0021 -4.6144 3  154.1401 67  71510 303331320      321023        syn-C2H3C(O)NH2, v=0
  703547.8589  0.0024 -4.9644 3  338.3155 95  71510 303471928      471631        syn-C2H3C(O)NH2, v=0
  703552.2278  0.2493 -5.6990 3 1673.7302249  71510 303C4 5B9      C4 4C0        syn-C2H3C(O)NH2, v=0
  703552.2278  0.2493 -5.6990 3 1673.7302249  71510 303C4 6B9      C4 5C0        syn-C2H3C(O)NH2, v=0
  703631.8281  0.0024 -4.9643 3  338.3127 95  71510 303471929      471632        syn-C2H3C(O)NH2, v=0
  703682.4787  0.0791 -5.0286 3 1562.8067179  71510 303895138      895039        syn-C2H3C(O)NH2, v=0
  703682.4787  0.0791 -5.0286 3 1562.8067179  71510 303895139      895040        syn-C2H3C(O)NH2, v=0
  703924.4279  0.0711 -4.1580 3 1343.4609219  71510 303A9 7A2      A8 8A1        syn-C2H3C(O)NH2, v=0
  703924.4279  0.0711 -4.1580 3 1343.4609219  71510 303A9 8A2      A8 7A1        syn-C2H3C(O)NH2, v=0
  703924.6160  0.0741 -4.1483 3 1347.1224221  71510 303B0 6A4      A9 7A3        syn-C2H3C(O)NH2, v=0
  703924.6160  0.0741 -4.1483 3 1347.1224221  71510 303B0 7A4      A9 6A3        syn-C2H3C(O)NH2, v=0
  703932.4427  0.0776 -4.1383 3 1350.2543223  71510 303B1 5A6      B0 6A5        syn-C2H3C(O)NH2, v=0
  703932.4427  0.0776 -4.1383 3 1350.2543223  71510 303B1 6A6      B0 5A5        syn-C2H3C(O)NH2, v=0
  703935.3293  0.0684 -4.1673 3 1339.2637217  71510 303A8 8A0      A7 999        syn-C2H3C(O)NH2, v=0
  703935.3293  0.0684 -4.1673 3 1339.2637217  71510 303A8 9A0      A7 899        syn-C2H3C(O)NH2, v=0
  703936.5944  0.0389 -4.2988 3 1218.9831191  71510 303952175      942074        syn-C2H3C(O)NH2, v=0
  703945.0820  0.0816 -4.1279 3 1352.8617225  71510 303B2 4A8      B1 5A7        syn-C2H3C(O)NH2, v=0
  703945.0820  0.0816 -4.1279 3 1352.8617225  71510 303B2 5A8      B1 4A7        syn-C2H3C(O)NH2, v=0
  703960.1982  0.0864 -4.1170 3 1354.9491227  71510 303B3 3B0      B2 4A9        syn-C2H3C(O)NH2, v=0
  703960.1982  0.0864 -4.1170 3 1354.9491227  71510 303B3 4B0      B2 3A9        syn-C2H3C(O)NH2, v=0
  703961.5753  0.0658 -4.1765 3 1334.5239215  71510 303A7 998      A61097        syn-C2H3C(O)NH2, v=0
  703961.5753  0.0658 -4.1765 3 1334.5239215  71510 303A71098      A6 997        syn-C2H3C(O)NH2, v=0
  703975.8449  0.0923 -4.1056 3 1356.5205229  71510 303B4 2B2      B3 3B1        syn-C2H3C(O)NH2, v=0
  703975.8449  0.0923 -4.1056 3 1356.5205229  71510 303B4 3B2      B3 2B1        syn-C2H3C(O)NH2, v=0
  703990.3869  0.0994 -4.0937 3 1357.5793231  71510 303B5 1B4      B4 2B3        syn-C2H3C(O)NH2, v=0
  703990.3869  0.0994 -4.0937 3 1357.5793231  71510 303B5 2B4      B4 1B3        syn-C2H3C(O)NH2, v=0
  704002.4397  0.1081 -4.0812 3 1358.1284233  71510 303B6 0B6      B5 1B5        syn-C2H3C(O)NH2, v=0
  704002.4397  0.1081 -4.0812 3 1358.1284233  71510 303B6 1B6      B5 0B5        syn-C2H3C(O)NH2, v=0
  704008.4707  0.0634 -4.1855 3 1329.2334213  71510 303A61096      A51195        syn-C2H3C(O)NH2, v=0
  704008.4707  0.0634 -4.1855 3 1329.2334213  71510 303A61196      A51095        syn-C2H3C(O)NH2, v=0
  704039.0306  0.0037 -5.0715 3  373.5278109  71510 303541044      54 747        syn-C2H3C(O)NH2, v=0
  704040.9641  0.0785 -4.9931 3 1541.1099177  71510 303885137      885038        syn-C2H3C(O)NH2, v=0
  704040.9641  0.0785 -4.9931 3 1541.1099177  71510 303885138      885039        syn-C2H3C(O)NH2, v=0
  704082.7112  0.0610 -4.1945 3 1323.3826211  71510 303A51194      A41293        syn-C2H3C(O)NH2, v=0
  704082.7112  0.0610 -4.1945 3 1323.3826211  71510 303A51294      A41193        syn-C2H3C(O)NH2, v=0
  704192.8679  0.0587 -4.2037 3 1316.9602209  71510 303A41292      A31391        syn-C2H3C(O)NH2, v=0
  704192.8679  0.0587 -4.2037 3 1316.9602209  71510 303A41392      A31291        syn-C2H3C(O)NH2, v=0
  704238.5307  0.0037 -5.0713 3  373.5278109  71510 303541144      54 847        syn-C2H3C(O)NH2, v=0
  704315.6546  0.0318 -4.2373 3 1090.3322179  71510 303892268      882167        syn-C2H3C(O)NH2, v=0
  704350.0955  0.0564 -4.2131 3 1309.9529207  71510 303A31390      A21489        syn-C2H3C(O)NH2, v=0
  704350.0955  0.0564 -4.2131 3 1309.9529207  71510 303A31490      A21389        syn-C2H3C(O)NH2, v=0
  704389.0844  0.0779 -4.9584 3 1519.6606175  71510 303875136      875037        syn-C2H3C(O)NH2, v=0
  704389.0844  0.0779 -4.9584 3 1519.6606175  71510 303875137      875038        syn-C2H3C(O)NH2, v=0
  704528.0530  0.0031 -3.9939 3  217.9034 87  71510 30343 637      42 538        syn-C2H3C(O)NH2, v=0
  704528.1843  0.0036 -5.1655 3  340.6061105  71510 30352 943      52 646        syn-C2H3C(O)NH2, v=0
  704533.7925  0.0031 -3.9939 3  217.9034 87  71510 30343 737      42 438        syn-C2H3C(O)NH2, v=0
  704569.1977  0.0541 -4.2231 3 1302.3443205  71510 303A21488      A11587        syn-C2H3C(O)NH2, v=0
  704569.1977  0.0541 -4.2231 3 1302.3443205  71510 303A21588      A11487        syn-C2H3C(O)NH2, v=0
  704587.4916  0.0036 -5.1654 3  340.6061105  71510 303521043      52 746        syn-C2H3C(O)NH2, v=0
  704727.0734  0.0774 -4.9244 3 1498.4587173  71510 303865135      865036        syn-C2H3C(O)NH2, v=0
  704727.0734  0.0774 -4.9244 3 1498.4587173  71510 303865136      865037        syn-C2H3C(O)NH2, v=0
  704736.0175  0.2572 -5.6608 3 1549.9845243  71510 303C1 3B8      C1 2B9        syn-C2H3C(O)NH2, v=0
  704736.0175  0.2572 -5.6608 3 1549.9845243  71510 303C1 4B8      C1 3B9        syn-C2H3C(O)NH2, v=0
  704870.2928  0.0519 -4.2340 3 1294.1148203  71510 303A11586      A01685        syn-C2H3C(O)NH2, v=0
  704870.2929  0.0519 -4.2340 3 1294.1148203  71510 303A11686      A01585        syn-C2H3C(O)NH2, v=0
  704949.9335  0.0027 -3.7986 3  251.6232 91  71510 30345 837      44 738        syn-C2H3C(O)NH2, v=0
  705055.1608  0.0769 -4.8913 3 1477.5041171  71510 303855134      855035        syn-C2H3C(O)NH2, v=0
  705055.1608  0.0769 -4.8913 3 1477.5041171  71510 303855135      855036        syn-C2H3C(O)NH2, v=0
  705065.6397  0.0091 -4.8929 3  672.3330141  71510 303701853      701556        syn-C2H3C(O)NH2, v=0
  705128.4124  0.0034 -4.8372 3  477.5304115  71510 303572037      571740        syn-C2H3C(O)NH2, v=0
  705219.8225  0.0026 -3.7983 3  251.6231 91  71510 30345 937      44 638        syn-C2H3C(O)NH2, v=0
  705222.4503  0.0249 -4.0085 3  907.9721163  71510 303812161      802060        syn-C2H3C(O)NH2, v=0
  705257.7100  0.0017 -3.0571 3  501.0510117  71510 303582138      572037        syn-C2H3C(O)NH2, v=0
  705263.3704  0.0017 -3.0571 3  501.0508117  71510 303582137      572038        syn-C2H3C(O)NH2, v=0
  705281.5342  0.0497 -4.2462 3 1285.2394201  71510 303A01684      991783        syn-C2H3C(O)NH2, v=0
  705281.5385  0.0497 -4.2462 3 1285.2394201  71510 303A01784      991683        syn-C2H3C(O)NH2, v=0
  705312.7225  0.2357 -5.6463 3 1311.9120195  71510 303972572      972275        syn-C2H3C(O)NH2, v=0
  705373.5718  0.0765 -4.8590 3 1456.7967169  71510 303845133      845034        syn-C2H3C(O)NH2, v=0
  705373.5718  0.0765 -4.8590 3 1456.7967169  71510 303845134      845035        syn-C2H3C(O)NH2, v=0
  705586.4947  0.0028 -3.8846 3  234.6453 89  71510 30344 737      43 638        syn-C2H3C(O)NH2, v=0
  705629.4215  0.0028 -3.8846 3  234.6453 89  71510 30344 837      43 538        syn-C2H3C(O)NH2, v=0
  705682.5275  0.0761 -4.8276 3 1436.3363167  71510 303835132      835033        syn-C2H3C(O)NH2, v=0
  705682.5275  0.0761 -4.8276 3 1436.3363167  71510 303835133      835034        syn-C2H3C(O)NH2, v=0
  705741.4400  0.0068 -5.5318 3  297.4494 95  71510 303471334      47 839        syn-C2H3C(O)NH2, v=0
  705815.2178  0.0053 -4.8613 3  593.2290129  71510 303642143      641846        syn-C2H3C(O)NH2, v=0
  705843.7909  0.0476 -4.2603 3 1275.6866199  71510 303991782      981881        syn-C2H3C(O)NH2, v=0
  705843.8858  0.0476 -4.2603 3 1275.6866199  71510 303991882      981781        syn-C2H3C(O)NH2, v=0
  705889.3285  0.0053 -5.2266 3  358.3057103  71510 303511536      511041        syn-C2H3C(O)NH2, v=0
  705982.2450  0.0758 -4.7971 3 1416.1228165  71510 303825131      825032        syn-C2H3C(O)NH2, v=0
  705982.2450  0.0758 -4.7971 3 1416.1228165  71510 303825132      825033        syn-C2H3C(O)NH2, v=0
  705996.7283  0.0338 -4.3177 3 1182.5110187  71510 303932272      922171        syn-C2H3C(O)NH2, v=0
  706102.0749  0.0152 -4.9572 3  807.1906153  71510 303762156      761859        syn-C2H3C(O)NH2, v=0
  706177.9468  0.0050 -4.8413 3  626.1040133  71510 303662146      661849        syn-C2H3C(O)NH2, v=0
  706272.9375  0.0755 -4.7675 3 1396.1561163  71510 303815130      815031        syn-C2H3C(O)NH2, v=0
  706272.9375  0.0755 -4.7675 3 1396.1561163  71510 303815131      815032        syn-C2H3C(O)NH2, v=0
  706554.8142  0.0753 -4.7388 3 1376.4360161  71510 303805129      805030        syn-C2H3C(O)NH2, v=0
  706554.8142  0.0753 -4.7388 3 1376.4360161  71510 303805130      805031        syn-C2H3C(O)NH2, v=0
  706618.7655  0.0455 -4.2771 3 1265.4149197  71510 303981880      971979        syn-C2H3C(O)NH2, v=0
  706620.5734  0.0455 -4.2771 3 1265.4148197  71510 303981980      971879        syn-C2H3C(O)NH2, v=0
  706828.0806  0.0750 -4.7110 3 1356.9625159  71510 303795128      795029        syn-C2H3C(O)NH2, v=0
  706828.0806  0.0750 -4.7110 3 1356.9625159  71510 303795129      795030        syn-C2H3C(O)NH2, v=0
  706856.2599  0.0816 -5.2435 3  976.6723169  71510 303842163      841866        syn-C2H3C(O)NH2, v=0
  707009.6406  0.0036 -3.4258 3  569.6457129  71510 303641846      631747        syn-C2H3C(O)NH2, v=0
  707092.9387  0.0749 -4.6843 3 1337.7354157  71510 303785127      785028        syn-C2H3C(O)NH2, v=0
  707092.9387  0.0749 -4.6843 3 1337.7354157  71510 303785128      785029        syn-C2H3C(O)NH2, v=0
  707149.4344  0.0023 -4.9958 3  326.5592 93  71510 303461927      461630        syn-C2H3C(O)NH2, v=0
  707151.5903  0.0041 -2.5857 3  378.1628 69  71510 3033433 1      3332 2        syn-C2H3C(O)NH2, v=0
  707151.5903  0.0041 -2.5857 3  378.1628 69  71510 3033433 2      3332 1        syn-C2H3C(O)NH2, v=0
  707185.7608  0.2588 -5.6881 3 1624.2584247  71510 303C3 4B9      C3 3C0        syn-C2H3C(O)NH2, v=0
  707185.7608  0.2588 -5.6881 3 1624.2584247  71510 303C3 5B9      C3 4C0        syn-C2H3C(O)NH2, v=0
  707193.2697  0.0023 -4.9958 3  326.5577 93  71510 303461928      461631        syn-C2H3C(O)NH2, v=0
  707286.0622  0.0049 -4.8926 3  532.6523127  71510 303631549      631252        syn-C2H3C(O)NH2, v=0
  707349.5865  0.0748 -4.6586 3 1318.7547155  71510 303775126      775027        syn-C2H3C(O)NH2, v=0
  707349.5865  0.0748 -4.6586 3 1318.7547155  71510 303775127      775028        syn-C2H3C(O)NH2, v=0
  707378.1682  0.0017 -2.9857 3  482.0577113  71510 303562235      552134        syn-C2H3C(O)NH2, v=0
  707378.2740  0.0017 -2.9857 3  482.0577113  71510 303562234      552135        syn-C2H3C(O)NH2, v=0
  707409.0928  0.0019 -3.1728 3  536.9950123  71510 303612042      601941        syn-C2H3C(O)NH2, v=0
  707591.3373  0.0032 -2.6050 3  380.0980 73  71510 3033632 4      3531 5        syn-C2H3C(O)NH2, v=0
  707591.3373  0.0032 -2.6050 3  380.0980 73  71510 3033632 5      3531 4        syn-C2H3C(O)NH2, v=0
  707598.2190  0.0747 -4.6339 3 1300.0201153  71510 303765125      765026        syn-C2H3C(O)NH2, v=0
  707598.2190  0.0747 -4.6339 3 1300.0201153  71510 303765126      765027        syn-C2H3C(O)NH2, v=0
  707631.0332  0.0055 -5.0426 3  161.5898 81  71510 30340 238      39 139        syn-C2H3C(O)NH2, v=0
  707631.0333  0.0055 -5.0426 3  161.5898 81  71510 30340 338      39 039        syn-C2H3C(O)NH2, v=0
  707635.8788  0.0616 -5.2843 3 1028.1603171  71510 303852560      852263        syn-C2H3C(O)NH2, v=0
  707664.6614  0.0022 -4.5557 3  162.4498 69  71510 303341321      331024        syn-C2H3C(O)NH2, v=0
  707696.7342  0.0435 -4.2983 3 1254.3674195  71510 303971978      962077        syn-C2H3C(O)NH2, v=0
  707725.8404  0.0435 -4.2983 3 1254.3668195  71510 303972078      961977        syn-C2H3C(O)NH2, v=0
  707770.0598  0.0019 -3.1724 3  536.9851123  71510 303612041      601942        syn-C2H3C(O)NH2, v=0
  707839.0275  0.0746 -4.6104 3 1281.5317151  71510 303755124      755025        syn-C2H3C(O)NH2, v=0
  707839.0275  0.0746 -4.6104 3 1281.5317151  71510 303755125      755026        syn-C2H3C(O)NH2, v=0
  707858.0657  0.0023 -5.3327 3  102.0130 51  71510 303251412      241113        syn-C2H3C(O)NH2, v=0
  707859.0827  0.0023 -5.3327 3  102.0129 51  71510 303251411      241114        syn-C2H3C(O)NH2, v=0
  708019.1761  0.0025 -2.6266 3  383.4999 77  71510 3033831 7      3730 8        syn-C2H3C(O)NH2, v=0
  708019.1761  0.0025 -2.6266 3  383.4999 77  71510 3033831 8      3730 7        syn-C2H3C(O)NH2, v=0
  708072.1998  0.0746 -4.5880 3 1263.2892149  71510 303745123      745024        syn-C2H3C(O)NH2, v=0
  708072.1998  0.0746 -4.5880 3 1263.2892149  71510 303745124      745025        syn-C2H3C(O)NH2, v=0
  708163.9568  0.2693 -5.7312 3 1501.4790241  71510 303C0 2B8      C0 1B9        syn-C2H3C(O)NH2, v=0
  708163.9568  0.2693 -5.7312 3 1501.4790241  71510 303C0 3B8      C0 2B9        syn-C2H3C(O)NH2, v=0
  708252.6843  0.0032 -4.8340 3  477.4261115  71510 303572038      571741        syn-C2H3C(O)NH2, v=0
  708297.9207  0.0746 -4.5668 3 1245.2926147  71510 303735122      735023        syn-C2H3C(O)NH2, v=0
  708297.9207  0.0746 -4.5668 3 1245.2926147  71510 303735123      735024        syn-C2H3C(O)NH2, v=0
  708420.4225  0.0121 -3.7609 3  760.8106149  71510 303742055      731954        syn-C2H3C(O)NH2, v=0
  708426.7881  0.0022 -2.6510 3  388.3751 81  71510 303403010      392911        syn-C2H3C(O)NH2, v=0
  708426.7881  0.0022 -2.6510 3  388.3751 81  71510 303403011      392910        syn-C2H3C(O)NH2, v=0
  708516.3715  0.0746 -4.5469 3 1227.5417145  71510 303725121      725022        syn-C2H3C(O)NH2, v=0
  708516.3715  0.0746 -4.5469 3 1227.5417145  71510 303725122      725023        syn-C2H3C(O)NH2, v=0
  708583.5610  0.0017 -2.9244 3  464.8022109  71510 303542332      532231        syn-C2H3C(O)NH2, v=0
  708583.5623  0.0017 -2.9244 3  464.8022109  71510 303542331      532232        syn-C2H3C(O)NH2, v=0
  708633.0218  0.0191 -5.0375 3  805.2613151  71510 303752352      752055        syn-C2H3C(O)NH2, v=0
  708676.1619  0.0055 -5.4229 3  118.3921 63  71510 30331 923      30 426        syn-C2H3C(O)NH2, v=0
  708727.7306  0.0747 -4.5284 3 1210.0365143  71510 303715120      715021        syn-C2H3C(O)NH2, v=0
  708727.7306  0.0747 -4.5284 3 1210.0365143  71510 303715121      715022        syn-C2H3C(O)NH2, v=0
  708802.0849  0.0020 -2.6783 3  394.7316 85  71510 303422913      412814        syn-C2H3C(O)NH2, v=0
  708802.0849  0.0020 -2.6783 3  394.7316 85  71510 303422914      412813        syn-C2H3C(O)NH2, v=0
  708932.1730  0.0748 -4.5114 3 1192.7769141  71510 303705119      705020        syn-C2H3C(O)NH2, v=0
  708932.1730  0.0748 -4.5114 3 1192.7769141  71510 303705120      705021        syn-C2H3C(O)NH2, v=0
  708990.2990  0.0338 -4.2185 3 1067.6140177  71510 303882267      872166        syn-C2H3C(O)NH2, v=0
  709047.3705  0.0067 -4.9171 3  588.2219133  71510 303661551      661254        syn-C2H3C(O)NH2, v=0
  709110.3062  0.0417 -4.3267 3 1242.4639193  71510 303962076      952175        syn-C2H3C(O)NH2, v=0
  709127.6255  0.0019 -2.7088 3  402.5797 89  71510 303442816      432717        syn-C2H3C(O)NH2, v=0
  709127.6255  0.0019 -2.7088 3  402.5797 89  71510 303442817      432716        syn-C2H3C(O)NH2, v=0
  709129.8708  0.0749 -4.4958 3 1175.7627139  71510 303695118      695019        syn-C2H3C(O)NH2, v=0
  709129.8708  0.0749 -4.4958 3 1175.7627139  71510 303695119      695020        syn-C2H3C(O)NH2, v=0
  709221.8252  0.0018 -2.8707 3  449.2076105  71510 303522429      512328        syn-C2H3C(O)NH2, v=0
  709221.8253  0.0018 -2.8707 3  449.2076105  71510 303522428      512329        syn-C2H3C(O)NH2, v=0
  709320.9932  0.0751 -4.4819 3 1158.9939137  71510 303685117      685018        syn-C2H3C(O)NH2, v=0
  709320.9932  0.0751 -4.4819 3 1158.9939137  71510 303685118      685019        syn-C2H3C(O)NH2, v=0
  709378.2655  0.0019 -2.7428 3  411.9322 93  71510 303462719      452620        syn-C2H3C(O)NH2, v=0
  709378.2655  0.0019 -2.7428 3  411.9322 93  71510 303462720      452619        syn-C2H3C(O)NH2, v=0
  709492.0647  0.0018 -2.8232 3  435.2214101  71510 303502525      492426        syn-C2H3C(O)NH2, v=0
  709492.0647  0.0018 -2.8232 3  435.2214101  71510 303502526      492425        syn-C2H3C(O)NH2, v=0
  709499.3089  0.0415 -4.3262 3 1242.4558193  71510 303962176      952075        syn-C2H3C(O)NH2, v=0
  709505.7062  0.0753 -4.4699 3 1142.4703135  71510 303675116      675017        syn-C2H3C(O)NH2, v=0
  709505.7062  0.0753 -4.4699 3 1142.4703135  71510 303675117      675018        syn-C2H3C(O)NH2, v=0
  709517.5613  0.0019 -2.7808 3  422.8056 97  71510 303482622      472523        syn-C2H3C(O)NH2, v=0
  709517.5613  0.0019 -2.7808 3  422.8056 97  71510 303482623      472522        syn-C2H3C(O)NH2, v=0
  709526.1961  0.2617 -5.7462 3 1699.8126251  71510 303C5 5C0      C5 4C1        syn-C2H3C(O)NH2, v=0
  709526.1961  0.2617 -5.7462 3 1699.8126251  71510 303C5 6C0      C5 5C1        syn-C2H3C(O)NH2, v=0
  709618.8627  0.0362 -4.3407 3 1205.9292189  71510 303942273      932172        syn-C2H3C(O)NH2, v=0
  709684.1730  0.0755 -4.4597 3 1126.1919133  71510 303665115      665016        syn-C2H3C(O)NH2, v=0
  709684.1730  0.0755 -4.4597 3 1126.1919133  71510 303665116      665017        syn-C2H3C(O)NH2, v=0
  709717.0842  0.0411 -4.3702 3 1229.5995191  71510 303952174      942273        syn-C2H3C(O)NH2, v=0
  709839.9908  0.0509 -4.4695 3 1239.5136191  71510 303952273      942372        syn-C2H3C(O)NH2, v=0
  709856.5539  0.0757 -4.4518 3 1110.1585131  71510 303655114      655015        syn-C2H3C(O)NH2, v=0
  709856.5539  0.0757 -4.4518 3 1110.1585131  71510 303655115      655016        syn-C2H3C(O)NH2, v=0
  709927.4106  0.0753 -4.1949 3 1366.9413221  71510 303B0 7A3      A9 8A2        syn-C2H3C(O)NH2, v=0
  709927.4106  0.0753 -4.1949 3 1366.9413221  71510 303B0 8A3      A9 7A2        syn-C2H3C(O)NH2, v=0
  709928.5219  0.0785 -4.1854 3 1370.6028223  71510 303B1 6A5      B0 7A4        syn-C2H3C(O)NH2, v=0
  709928.5219  0.0785 -4.1854 3 1370.6028223  71510 303B1 7A5      B0 6A4        syn-C2H3C(O)NH2, v=0
  709936.9872  0.0821 -4.1756 3 1373.7349225  71510 303B2 5A7      B1 6A6        syn-C2H3C(O)NH2, v=0
  709936.9872  0.0821 -4.1756 3 1373.7349225  71510 303B2 6A7      B1 5A6        syn-C2H3C(O)NH2, v=0
  709937.0079  0.0724 -4.2040 3 1362.7445219  71510 303A9 8A1      A8 9A0        syn-C2H3C(O)NH2, v=0
  709937.0079  0.0724 -4.2040 3 1362.7445219  71510 303A9 9A1      A8 8A0        syn-C2H3C(O)NH2, v=0
  709950.0522  0.0863 -4.1653 3 1376.3428227  71510 303B3 4A9      B2 5A8        syn-C2H3C(O)NH2, v=0
  709950.0522  0.0863 -4.1653 3 1376.3428227  71510 303B3 5A9      B2 4A8        syn-C2H3C(O)NH2, v=0
  709961.4392  0.0697 -4.2129 3 1358.0056217  71510 303A8 999      A71098        syn-C2H3C(O)NH2, v=0
  709961.4392  0.0697 -4.2129 3 1358.0056217  71510 303A81099      A7 998        syn-C2H3C(O)NH2, v=0
  709965.4351  0.0914 -4.1546 3 1378.4307229  71510 303B4 3B1      B3 4B0        syn-C2H3C(O)NH2, v=0
  709965.4351  0.0914 -4.1546 3 1378.4307229  71510 303B4 4B1      B3 3B0        syn-C2H3C(O)NH2, v=0
  709976.4588  0.0358 -5.1539 3  913.2658161  71510 303802456      802159        syn-C2H3C(O)NH2, v=0
  709981.2301  0.0975 -4.1433 3 1380.0026231  71510 303B5 2B3      B4 3B2        syn-C2H3C(O)NH2, v=0
  709981.2301  0.0975 -4.1433 3 1380.0026231  71510 303B5 3B3      B4 2B2        syn-C2H3C(O)NH2, v=0
  709995.8325  0.1049 -4.1316 3 1381.0619233  71510 303B6 1B5      B5 2B4        syn-C2H3C(O)NH2, v=0
  709995.8325  0.1049 -4.1316 3 1381.0619233  71510 303B6 2B5      B5 1B4        syn-C2H3C(O)NH2, v=0
  710005.8326  0.0671 -4.2217 3 1352.7166215  71510 303A71097      A61196        syn-C2H3C(O)NH2, v=0
  710005.8326  0.0671 -4.2217 3 1352.7166215  71510 303A71197      A61096        syn-C2H3C(O)NH2, v=0
  710007.8810  0.1140 -4.1192 3 1381.6114235  71510 303B7 0B7      B6 1B6        syn-C2H3C(O)NH2, v=0
  710007.8810  0.1140 -4.1192 3 1381.6114235  71510 303B7 1B7      B6 0B6        syn-C2H3C(O)NH2, v=0
  710023.0065  0.0759 -4.4461 3 1094.3701129  71510 303645113      645014        syn-C2H3C(O)NH2, v=0
  710023.0065  0.0759 -4.4461 3 1094.3701129  71510 303645114      645015        syn-C2H3C(O)NH2, v=0
  710069.1469  0.0028 -4.3005 3  203.3679 79  71510 303391227      38 930        syn-C2H3C(O)NH2, v=0
  710076.6396  0.0647 -4.2304 3 1346.8682213  71510 303A61195      A51294        syn-C2H3C(O)NH2, v=0
  710076.6396  0.0647 -4.2304 3 1346.8682213  71510 303A61295      A51194        syn-C2H3C(O)NH2, v=0
  710177.5452  0.0026 -3.3286 3  576.4857129  71510 303641945      631846        syn-C2H3C(O)NH2, v=0
  710182.0891  0.0622 -4.2392 3 1340.4496211  71510 303A51293      A41392        syn-C2H3C(O)NH2, v=0
  710182.0891  0.0622 -4.2392 3 1340.4496211  71510 303A51393      A41292        syn-C2H3C(O)NH2, v=0
  710183.6855  0.0762 -4.4432 3 1078.8266127  71510 303635112      635013        syn-C2H3C(O)NH2, v=0
  710183.6855  0.0762 -4.4432 3 1078.8266127  71510 303635113      635014        syn-C2H3C(O)NH2, v=0
  710332.8464  0.0598 -4.2483 3 1333.4475209  71510 303A41391      A31490        syn-C2H3C(O)NH2, v=0
  710332.8464  0.0598 -4.2483 3 1333.4475209  71510 303A41491      A31390        syn-C2H3C(O)NH2, v=0
  710338.7427  0.0765 -4.4433 3 1063.5278125  71510 303625111      625012        syn-C2H3C(O)NH2, v=0
  710338.7427  0.0765 -4.4433 3 1063.5278125  71510 303625112      625013        syn-C2H3C(O)NH2, v=0
  710457.3184  0.0023 -5.0294 3  315.0707 91  71510 303451926      451629        syn-C2H3C(O)NH2, v=0
  710479.7181  0.0023 -5.0294 3  315.0700 91  71510 303451927      451630        syn-C2H3C(O)NH2, v=0
  710488.3275  0.0768 -4.4468 3 1048.4738123  71510 303615110      615011        syn-C2H3C(O)NH2, v=0
  710488.3275  0.0768 -4.4468 3 1048.4738123  71510 303615111      615012        syn-C2H3C(O)NH2, v=0
  710542.9977  0.0575 -4.2579 3 1325.8462207  71510 303A31489      A21588        syn-C2H3C(O)NH2, v=0
  710542.9977  0.0575 -4.2579 3 1325.8462207  71510 303A31589      A21488        syn-C2H3C(O)NH2, v=0
  710632.5864  0.0771 -4.4544 3 1033.6643121  71510 3036051 9      605010        syn-C2H3C(O)NH2, v=0
  710632.5864  0.0771 -4.4544 3 1033.6643121  71510 303605110      605011        syn-C2H3C(O)NH2, v=0
  710716.5771  0.2699 -5.7059 3 1575.0682245  71510 303C2 3B9      C2 2C0        syn-C2H3C(O)NH2, v=0
  710716.5771  0.2699 -5.7059 3 1575.0682245  71510 303C2 4B9      C2 3C0        syn-C2H3C(O)NH2, v=0
  710771.6634  0.0774 -4.4667 3 1019.0994119  71510 3035951 8      5950 9        syn-C2H3C(O)NH2, v=0
  710771.6634  0.0774 -4.4667 3 1019.0994119  71510 3035951 9      595010        syn-C2H3C(O)NH2, v=0
  710778.9629  0.0065 -5.7271 3  106.7988 61  71510 30330 823      29 326        syn-C2H3C(O)NH2, v=0
  710831.5768  0.0551 -4.2683 3 1317.6267205  71510 303A21587      A11686        syn-C2H3C(O)NH2, v=0
  710831.5769  0.0551 -4.2683 3 1317.6267205  71510 303A21687      A11586        syn-C2H3C(O)NH2, v=0
  710888.2431  0.0048 -4.9280 3  494.1984123  71510 303611348      611051        syn-C2H3C(O)NH2, v=0
  710905.6996  0.0778 -4.4849 3 1004.7789117  71510 3035851 7      5850 8        syn-C2H3C(O)NH2, v=0
  710905.6996  0.0778 -4.4849 3 1004.7789117  71510 3035851 8      5850 9        syn-C2H3C(O)NH2, v=0
  710971.5308  0.1066 -5.7334 3 1966.9636211  71510 303A55253      A55154        syn-C2H3C(O)NH2, v=0
  710971.5308  0.1066 -5.7334 3 1966.9636211  71510 303A55254      A55155        syn-C2H3C(O)NH2, v=0
  711034.8338  0.0782 -4.5103 3  990.7027115  71510 3035751 6      5750 7        syn-C2H3C(O)NH2, v=0
  711034.8338  0.0782 -4.5103 3  990.7027115  71510 3035751 7      5750 8        syn-C2H3C(O)NH2, v=0
  711150.6143  0.0030 -5.6018 3  111.7434 59  71510 303291119      28 622        syn-C2H3C(O)NH2, v=0
  711159.2020  0.0785 -4.5451 3  976.8708113  71510 3035651 5      5650 6        syn-C2H3C(O)NH2, v=0
  711159.2020  0.0785 -4.5451 3  976.8708113  71510 3035651 6      5650 7        syn-C2H3C(O)NH2, v=0
  711225.0346  0.0528 -4.2798 3 1308.7650203  71510 303A11685      A01784        syn-C2H3C(O)NH2, v=0
  711225.0369  0.0528 -4.2798 3 1308.7650203  71510 303A11785      A01684        syn-C2H3C(O)NH2, v=0
  711278.9379  0.0789 -4.5925 3  963.2830111  71510 3035551 4      5550 5        syn-C2H3C(O)NH2, v=0
  711278.9379  0.0789 -4.5925 3  963.2830111  71510 3035551 5      5550 6        syn-C2H3C(O)NH2, v=0
  711394.1725  0.0793 -4.6581 3  949.9394109  71510 3035451 3      5450 4        syn-C2H3C(O)NH2, v=0
  711394.1725  0.0793 -4.6581 3  949.9394109  71510 3035451 4      5450 5        syn-C2H3C(O)NH2, v=0
  711505.0343  0.0797 -4.7521 3  936.8397107  71510 3035351 2      5350 3        syn-C2H3C(O)NH2, v=0
  711505.0343  0.0797 -4.7521 3  936.8397107  71510 3035351 3      5350 4        syn-C2H3C(O)NH2, v=0
  711505.6445  0.1049 -5.6867 3 1941.3053209  71510 303A45252      A45153        syn-C2H3C(O)NH2, v=0
  711505.6445  0.1049 -5.6867 3 1941.3053209  71510 303A45253      A45154        syn-C2H3C(O)NH2, v=0
  711611.6493  0.0801 -4.8976 3  923.9841105  71510 3035251 1      5250 2        syn-C2H3C(O)NH2, v=0
  711611.6493  0.0801 -4.8976 3  923.9841105  71510 3035251 2      5250 3        syn-C2H3C(O)NH2, v=0
  711714.1412  0.0806 -5.1685 3  911.3722103  71510 3035151 0      5150 1        syn-C2H3C(O)NH2, v=0
  711714.1412  0.0806 -5.1685 3  911.3722103  71510 3035151 1      5150 2        syn-C2H3C(O)NH2, v=0
  711745.7085  0.0018 -3.0822 3  515.5339119  71510 303592139      582038        syn-C2H3C(O)NH2, v=0
  711756.7618  0.0018 -3.0821 3  515.5336119  71510 303592138      582039        syn-C2H3C(O)NH2, v=0
  711761.4421  0.0506 -4.2931 3 1299.2310201  71510 303A01783      991882        syn-C2H3C(O)NH2, v=0
  711761.4953  0.0506 -4.2931 3 1299.2310201  71510 303A01883      991782        syn-C2H3C(O)NH2, v=0
  711816.2645  0.0022 -4.5000 3  171.0210 71  71510 303351322      341025        syn-C2H3C(O)NH2, v=0
  712025.8333  0.1032 -5.6407 3 1915.8964207  71510 303A35251      A35152        syn-C2H3C(O)NH2, v=0
  712025.8333  0.1032 -5.6407 3 1915.8964207  71510 303A35252      A35153        syn-C2H3C(O)NH2, v=0
  712063.7348  0.0040 -5.2618 3  351.4617101  71510 303501634      501139        syn-C2H3C(O)NH2, v=0
  712334.3160  0.0032 -4.8506 3  463.0734113  71510 303562036      561739        syn-C2H3C(O)NH2, v=0
  712497.8457  0.0484 -4.3090 3 1288.9852199  71510 303991881      981980        syn-C2H3C(O)NH2, v=0
  712498.0011  0.0070 -4.8954 3  629.6894137  71510 303681752      681455        syn-C2H3C(O)NH2, v=0
  712498.8833  0.0484 -4.3090 3 1288.9852199  71510 303991981      981880        syn-C2H3C(O)NH2, v=0
  712532.3961  0.1017 -5.5953 3 1890.7368205  71510 303A25250      A25151        syn-C2H3C(O)NH2, v=0
  712532.3961  0.1017 -5.5953 3 1890.7368205  71510 303A25251      A25152        syn-C2H3C(O)NH2, v=0
  712650.0783  0.0042 -5.2191 3  364.2943103  71510 303511635      511140        syn-C2H3C(O)NH2, v=0
  712711.5364  0.0048 -4.5979 3  177.6412 83  71510 30341 338      40 239        syn-C2H3C(O)NH2, v=0
  712711.5385  0.0048 -4.5979 3  177.6412 83  71510 30341 438      40 139        syn-C2H3C(O)NH2, v=0
  712952.8457  0.0047 -4.8444 3  609.2973131  71510 303652145      651848        syn-C2H3C(O)NH2, v=0
  713025.6256  0.1002 -5.5507 3 1865.8263203  71510 303A15249      A15150        syn-C2H3C(O)NH2, v=0
  713025.6256  0.1002 -5.5507 3 1865.8263203  71510 303A15250      A15151        syn-C2H3C(O)NH2, v=0
  713161.9491  0.2716 -5.7345 3 1649.9416249  71510 303C4 4C0      C4 3C1        syn-C2H3C(O)NH2, v=0
  713161.9491  0.2716 -5.7345 3 1649.9416249  71510 303C4 5C0      C4 4C1        syn-C2H3C(O)NH2, v=0
  713173.7970  0.0021 -3.2033 3  552.3633125  71510 303622043      611942        syn-C2H3C(O)NH2, v=0
  713396.2923  0.0062 -3.6309 3  423.9561113  71510 303561442      551343        syn-C2H3C(O)NH2, v=0
  713499.7662  0.0022 -5.0654 3  303.8484 89  71510 303441925      441628        syn-C2H3C(O)NH2, v=0
  713505.8082  0.0988 -5.5067 3 1841.1648201  71510 303A05248      A05149        syn-C2H3C(O)NH2, v=0
  713505.8082  0.0988 -5.5067 3 1841.1648201  71510 303A05249      A05150        syn-C2H3C(O)NH2, v=0
  713510.9650  0.0022 -5.0653 3  303.8480 89  71510 303441926      441629        syn-C2H3C(O)NH2, v=0
  713519.6715  0.0463 -4.3288 3 1277.9740197  71510 303981979      972078        syn-C2H3C(O)NH2, v=0
  713536.8644  0.0463 -4.3287 3 1277.9736197  71510 303982079      971978        syn-C2H3C(O)NH2, v=0
  713652.4494  0.0105 -4.9513 3  795.9718151  71510 303752254      751957        syn-C2H3C(O)NH2, v=0
  713685.6722  0.0118 -4.9669 3  815.2464153  71510 303762255      761958        syn-C2H3C(O)NH2, v=0
  713811.0380  0.0021 -3.2026 3  552.3458125  71510 303622042      611943        syn-C2H3C(O)NH2, v=0
  713866.2229  0.0046 -4.9251 3  494.1986123  71510 303611448      611151        syn-C2H3C(O)NH2, v=0
  713897.2838  0.0389 -4.3649 3 1229.5146191  71510 303952274      942173        syn-C2H3C(O)NH2, v=0
  713973.2242  0.0975 -5.4634 3 1816.7521199  71510 303995247      995148        syn-C2H3C(O)NH2, v=0
  713973.2242  0.0975 -5.4634 3 1816.7521199  71510 303995248      995149        syn-C2H3C(O)NH2, v=0
  714055.3227  0.0022 -5.2407 3  108.1871 53  71510 303261413      251114        syn-C2H3C(O)NH2, v=0
  714057.8708  0.0022 -5.2407 3  108.1870 53  71510 303261412      251115        syn-C2H3C(O)NH2, v=0
  714080.9373  0.0578 -5.1718 3  905.4148163  71510 303812061      811764        syn-C2H3C(O)NH2, v=0
  714127.5068  0.0017 -3.0080 3  495.9681115  71510 303572236      562135        syn-C2H3C(O)NH2, v=0
  714127.7313  0.0017 -3.0080 3  495.9681115  71510 303572235      562136        syn-C2H3C(O)NH2, v=0
  714208.4783  0.0031 -4.8487 3  463.0108113  71510 303562037      561740        syn-C2H3C(O)NH2, v=0
  714410.6717  0.0040 -2.5951 3  386.4305 71  71510 3033533 2      3432 3        syn-C2H3C(O)NH2, v=0
  714410.6717  0.0040 -2.5951 3  386.4305 71  71510 3033533 3      3432 2        syn-C2H3C(O)NH2, v=0
  714428.1483  0.0962 -5.4208 3 1792.5881197  71510 303985246      985147        syn-C2H3C(O)NH2, v=0
  714428.1483  0.0962 -5.4208 3 1792.5881197  71510 303985247      985148        syn-C2H3C(O)NH2, v=0
  714847.4971  0.0031 -2.6150 3  388.8588 75  71510 3033732 5      3631 6        syn-C2H3C(O)NH2, v=0
  714847.4971  0.0031 -2.6150 3  388.8588 75  71510 3033732 6      3631 5        syn-C2H3C(O)NH2, v=0
  714870.8495  0.0951 -5.3789 3 1768.6726195  71510 303975245      975146        syn-C2H3C(O)NH2, v=0
  714870.8495  0.0951 -5.3789 3 1768.6726195  71510 303975246      975147        syn-C2H3C(O)NH2, v=0
  714873.3867  0.0159 -4.9580 3  779.7231151  71510 303752056      751759        syn-C2H3C(O)NH2, v=0
  714896.3647  0.0444 -4.3549 3 1266.1222195  71510 303972077      962176        syn-C2H3C(O)NH2, v=0
  714990.7818  0.0027 -3.8177 3  313.9139 97  71510 303481435      471136        syn-C2H3C(O)NH2, v=0
  715010.7128  0.0040 -5.3256 3  338.7899 99  71510 303491633      491138        syn-C2H3C(O)NH2, v=0
  715104.8244  0.0030 -3.6915 3  297.4524 97  71510 303481038      47 939        syn-C2H3C(O)NH2, v=0
  715134.1114  0.0443 -4.3546 3 1266.1172195  71510 303972177      962076        syn-C2H3C(O)NH2, v=0
  715270.2004  0.0025 -2.6375 3  392.7557 79  71510 3033931 8      3830 9        syn-C2H3C(O)NH2, v=0
  715270.2004  0.0025 -2.6375 3  392.7557 79  71510 3033931 9      3830 8        syn-C2H3C(O)NH2, v=0
  715301.5914  0.0940 -5.3377 3 1745.0055193  71510 303965244      965145        syn-C2H3C(O)NH2, v=0
  715301.5914  0.0940 -5.3377 3 1745.0055193  71510 303965245      965146        syn-C2H3C(O)NH2, v=0
  715322.4969  0.0027 -5.4497 3  119.0762 61  71510 303301120      29 623        syn-C2H3C(O)NH2, v=0
  715464.8182  0.1263 -4.8204 3 1356.5254199  71510 303992475      982574        syn-C2H3C(O)NH2, v=0
  715495.9891  0.0095 -4.9391 3  776.9164149  71510 303742253      741956        syn-C2H3C(O)NH2, v=0
  715496.2829  0.0017 -2.9447 3  478.1607111  71510 303552333      542232        syn-C2H3C(O)NH2, v=0
  715496.2860  0.0017 -2.9447 3  478.1607111  71510 303552332      542233        syn-C2H3C(O)NH2, v=0
  715532.5939  0.0049 -5.6453 3  259.6171 95  71510 30347 641      47 344        syn-C2H3C(O)NH2, v=0
  715533.0647  0.0049 -5.6453 3  259.6171 95  71510 30347 741      47 444        syn-C2H3C(O)NH2, v=0
  715563.8944  0.1974 -5.5549 3 1229.5146189  71510 303942470      942173        syn-C2H3C(O)NH2, v=0
  715669.6214  0.0021 -2.6626 3  398.1281 83  71510 303413011      402912        syn-C2H3C(O)NH2, v=0
  715669.6214  0.0021 -2.6626 3  398.1281 83  71510 303413012      402911        syn-C2H3C(O)NH2, v=0
  715716.5801  0.0029 -3.6512 3  315.4063 99  71510 303491238      48 939        syn-C2H3C(O)NH2, v=0
  715720.6323  0.0930 -5.2972 3 1721.5866191  71510 303955243      955144        syn-C2H3C(O)NH2, v=0
  715720.6323  0.0930 -5.2972 3 1721.5866191  71510 303955244      955145        syn-C2H3C(O)NH2, v=0
  715808.7691  0.0135 -4.9865 3  834.7330155  71510 303772256      771959        syn-C2H3C(O)NH2, v=0
  715831.4360  0.0096 -4.9477 3  646.4237139  71510 303691653      691356        syn-C2H3C(O)NH2, v=0
  715929.4849  0.0796 -4.2323 3 1390.6219223  71510 303B1 7A4      B0 8A3        syn-C2H3C(O)NH2, v=0
  715929.4849  0.0796 -4.2323 3 1390.6219223  71510 303B1 8A4      B0 7A3        syn-C2H3C(O)NH2, v=0
  715931.4964  0.0830 -4.2230 3 1394.2835225  71510 303B2 6A6      B1 7A5        syn-C2H3C(O)NH2, v=0
  715931.4964  0.0830 -4.2230 3 1394.2835225  71510 303B2 7A6      B1 6A5        syn-C2H3C(O)NH2, v=0
  715937.8140  0.0766 -4.2412 3 1386.4254221  71510 303B0 8A2      A9 9A1        syn-C2H3C(O)NH2, v=0
  715937.8140  0.0766 -4.2412 3 1386.4254221  71510 303B0 9A2      A9 8A1        syn-C2H3C(O)NH2, v=0
  715940.5859  0.0868 -4.2134 3 1397.4159227  71510 303B3 5A8      B2 6A7        syn-C2H3C(O)NH2, v=0
  715940.5859  0.0868 -4.2134 3 1397.4159227  71510 303B3 6A8      B2 5A7        syn-C2H3C(O)NH2, v=0
  715954.0679  0.0912 -4.2033 3 1400.0241229  71510 303B4 4B0      B3 5A9        syn-C2H3C(O)NH2, v=0
  715954.0679  0.0912 -4.2033 3 1400.0241229  71510 303B4 5B0      B3 4A9        syn-C2H3C(O)NH2, v=0
  715960.4852  0.0737 -4.2499 3 1381.6873219  71510 303A9 9A0      A81099        syn-C2H3C(O)NH2, v=0
  715960.4852  0.0737 -4.2499 3 1381.6873219  71510 303A910A0      A8 999        syn-C2H3C(O)NH2, v=0
  715967.7175  0.0433 -4.3937 3 1253.3276193  71510 303962175      952274        syn-C2H3C(O)NH2, v=0
  715969.7128  0.0965 -4.1927 3 1402.1126231  71510 303B5 3B2      B4 4B1        syn-C2H3C(O)NH2, v=0
  715969.7128  0.0965 -4.1927 3 1402.1126231  71510 303B5 4B2      B4 3B1        syn-C2H3C(O)NH2, v=0
  715985.6536  0.1029 -4.1816 3 1403.6851233  71510 303B6 2B4      B5 3B3        syn-C2H3C(O)NH2, v=0
  715985.6536  0.1029 -4.1816 3 1403.6851233  71510 303B6 3B4      B5 2B3        syn-C2H3C(O)NH2, v=0
  716000.3154  0.1107 -4.1699 3 1404.7448235  71510 303B7 1B6      B6 2B5        syn-C2H3C(O)NH2, v=0
  716000.3154  0.1107 -4.1699 3 1404.7448235  71510 303B7 2B6      B6 1B5        syn-C2H3C(O)NH2, v=0
  716002.4585  0.0711 -4.2584 3 1376.3998217  71510 303A81098      A71197        syn-C2H3C(O)NH2, v=0
  716002.4585  0.0711 -4.2584 3 1376.3998217  71510 303A81198      A71097        syn-C2H3C(O)NH2, v=0
  716012.3590  0.1201 -4.1577 3 1405.2947237  71510 303B8 0B8      B7 1B7        syn-C2H3C(O)NH2, v=0
  716012.3590  0.1201 -4.1577 3 1405.2947237  71510 303B8 1B8      B7 0B7        syn-C2H3C(O)NH2, v=0
  716032.5369  0.0020 -2.6908 3  404.9845 87  71510 303432914      422815        syn-C2H3C(O)NH2, v=0
  716032.5369  0.0020 -2.6908 3  404.9845 87  71510 303432915      422814        syn-C2H3C(O)NH2, v=0
  716041.1071  0.0055 -3.5258 3  547.0767127  71510 303631746      621647        syn-C2H3C(O)NH2, v=0
  716069.9541  0.0685 -4.2669 3 1370.5538215  71510 303A71196      A61295        syn-C2H3C(O)NH2, v=0
  716069.9541  0.0685 -4.2669 3 1370.5538215  71510 303A71296      A61195        syn-C2H3C(O)NH2, v=0
  716128.2254  0.0920 -5.2574 3 1698.4158189  71510 303945242      945143        syn-C2H3C(O)NH2, v=0
  716128.2254  0.0920 -5.2574 3 1698.4158189  71510 303945243      945144        syn-C2H3C(O)NH2, v=0
  716157.3881  0.0022 -4.4475 3  179.8500 73  71510 303361323      351026        syn-C2H3C(O)NH2, v=0
  716170.8782  0.0659 -4.2754 3 1364.1387213  71510 303A61294      A51393        syn-C2H3C(O)NH2, v=0
  716170.8782  0.0659 -4.2754 3 1364.1387213  71510 303A61394      A51293        syn-C2H3C(O)NH2, v=0
  716243.4611  0.0360 -4.1982 3 1045.0186175  71510 303872266      862165        syn-C2H3C(O)NH2, v=0
  716243.5526  0.0018 -2.8893 3  462.0288107  71510 303532429      522330        syn-C2H3C(O)NH2, v=0
  716243.5526  0.0018 -2.8893 3  462.0288107  71510 303532430      522329        syn-C2H3C(O)NH2, v=0
  716300.2908  0.0022 -5.1037 3  292.8907 87  71510 303431924      431627        syn-C2H3C(O)NH2, v=0
  716305.7653  0.0022 -5.1037 3  292.8905 87  71510 303431925      431628        syn-C2H3C(O)NH2, v=0
  716315.4366  0.0634 -4.2841 3 1357.1416211  71510 303A51392      A41491        syn-C2H3C(O)NH2, v=0
  716315.4366  0.0634 -4.2841 3 1357.1416211  71510 303A51492      A41391        syn-C2H3C(O)NH2, v=0
  716336.3135  0.0031 -3.8915 3  301.7179 95  71510 303471434      461135        syn-C2H3C(O)NH2, v=0
  716339.9547  0.0019 -2.7223 3  413.3358 91  71510 303452817      442718        syn-C2H3C(O)NH2, v=0
  716339.9547  0.0019 -2.7223 3  413.3358 91  71510 303452818      442717        syn-C2H3C(O)NH2, v=0
  716473.8886  0.0028 -3.6383 3  333.4551101  71510 303501338      491039        syn-C2H3C(O)NH2, v=0
  716517.0466  0.0609 -4.2933 3 1349.5474209  71510 303A41490      A31589        syn-C2H3C(O)NH2, v=0
  716517.0466  0.0609 -4.2933 3 1349.5474209  71510 303A41590      A31489        syn-C2H3C(O)NH2, v=0
  716524.6192  0.0911 -5.2183 3 1675.4931187  71510 303935241      935142        syn-C2H3C(O)NH2, v=0
  716524.6192  0.0911 -5.2183 3 1675.4931187  71510 303935242      935143        syn-C2H3C(O)NH2, v=0
  716564.5709  0.0019 -2.7574 3  423.1956 95  71510 303472720      462621        syn-C2H3C(O)NH2, v=0
  716564.5709  0.0019 -2.7574 3  423.1956 95  71510 303472721      462620        syn-C2H3C(O)NH2, v=0
  716588.8372  0.0018 -2.8403 3  447.5158103  71510 303512526      502427        syn-C2H3C(O)NH2, v=0
  716588.8372  0.0018 -2.8403 3  447.5158103  71510 303512527      502426        syn-C2H3C(O)NH2, v=0
  716666.8614  0.0019 -2.7966 3  434.5814 99  71510 303492623      482524        syn-C2H3C(O)NH2, v=0
  716666.8614  0.0019 -2.7966 3  434.5814 99  71510 303492624      482523        syn-C2H3C(O)NH2, v=0
  716695.3665  0.0045 -5.1961 3  377.2947105  71510 303521636      521141        syn-C2H3C(O)NH2, v=0
  716771.8627  0.0025 -3.7565 3  326.2739 99  71510 303491436      481137        syn-C2H3C(O)NH2, v=0
  716793.7383  0.0585 -4.3032 3 1341.3375207  71510 303A31588      A21687        syn-C2H3C(O)NH2, v=0
  716793.7383  0.0585 -4.3032 3 1341.3375207  71510 303A31688      A21587        syn-C2H3C(O)NH2, v=0
  716910.0570  0.0903 -5.1800 3 1652.8181185  71510 303925240      925141        syn-C2H3C(O)NH2, v=0
  716910.0570  0.0903 -5.1800 3 1652.8181185  71510 303925241      925142        syn-C2H3C(O)NH2, v=0
  717051.8649  0.0042 -4.3304 3  193.9851 85  71510 30342 438      41 339        syn-C2H3C(O)NH2, v=0
  717051.8941  0.0042 -4.3304 3  193.9851 85  71510 30342 538      41 239        syn-C2H3C(O)NH2, v=0
  717170.4007  0.0561 -4.3141 3 1332.4890205  71510 303A21686      A11785        syn-C2H3C(O)NH2, v=0
  717170.4020  0.0561 -4.3141 3 1332.4890205  71510 303A21786      A11685        syn-C2H3C(O)NH2, v=0
  717219.5694  0.0180 -4.9900 3  826.4536155  71510 303772157      771860        syn-C2H3C(O)NH2, v=0
  717284.7779  0.0895 -5.1425 3 1630.3909183  71510 303915239      915140        syn-C2H3C(O)NH2, v=0
  717284.7779  0.0895 -5.1425 3 1630.3909183  71510 303915240      915141        syn-C2H3C(O)NH2, v=0
  717640.4191  0.0772 -4.6299 3 1297.4416195  71510 303972374      962473        syn-C2H3C(O)NH2, v=0
  717649.0161  0.0888 -5.1057 3 1608.2112181  71510 303905238      905139        syn-C2H3C(O)NH2, v=0
  717649.0161  0.0888 -5.1057 3 1608.2112181  71510 303905239      905140        syn-C2H3C(O)NH2, v=0
  717682.5640  0.0537 -4.3267 3 1322.9728203  71510 303A11784      A01883        syn-C2H3C(O)NH2, v=0
  717682.5936  0.0537 -4.3267 3 1322.9728203  71510 303A11884      A01783        syn-C2H3C(O)NH2, v=0
  717773.8517  0.0236 -3.9740 3  886.9018161  71510 303802160      792059        syn-C2H3C(O)NH2, v=0
  717774.5639  0.0046 -4.8632 3  576.7929127  71510 303632142      631845        syn-C2H3C(O)NH2, v=0
  717795.8432  0.0044 -4.9702 3  456.9584119  71510 303591247      59 950        syn-C2H3C(O)NH2, v=0
  717801.1321  0.0030 -3.3693 3  592.7563131  71510 303651946      641847        syn-C2H3C(O)NH2, v=0
  717967.9342  0.0042 -5.2279 3  130.1913 65  71510 303321023      31 526        syn-C2H3C(O)NH2, v=0
  717976.1886  0.0076 -5.0902 3  153.6068 71  71510 30335 926      34 629        syn-C2H3C(O)NH2, v=0
  718003.0017  0.0882 -5.0697 3 1586.2790179  71510 303895237      895138        syn-C2H3C(O)NH2, v=0
  718003.0017  0.0882 -5.0697 3 1586.2790179  71510 303895238      895139        syn-C2H3C(O)NH2, v=0
  718139.3867  0.0131 -4.9396 3  734.1334147  71510 303731955      731658        syn-C2H3C(O)NH2, v=0
  718159.1493  0.0018 -3.1082 3  530.2844121  71510 303602140      592039        syn-C2H3C(O)NH2, v=0
  718180.3771  0.0018 -3.1082 3  530.2838121  71510 303602139      592040        syn-C2H3C(O)NH2, v=0
  718346.9604  0.0876 -5.0345 3 1564.5942177  71510 303885236      885137        syn-C2H3C(O)NH2, v=0
  718346.9604  0.0876 -5.0345 3 1564.5942177  71510 303885237      885138        syn-C2H3C(O)NH2, v=0
  718383.0213  0.0515 -4.3416 3 1312.7516201  71510 303A01882      991981        syn-C2H3C(O)NH2, v=0
  718383.6143  0.0515 -4.3416 3 1312.7515201  71510 303A01982      991881        syn-C2H3C(O)NH2, v=0
  718635.7726  0.0418 -4.3903 3 1253.2732193  71510 303962275      952174        syn-C2H3C(O)NH2, v=0
  718681.1138  0.0870 -5.0001 3 1543.1565175  71510 303875235      875136        syn-C2H3C(O)NH2, v=0
  718681.1138  0.0870 -5.0001 3 1543.1565175  71510 303875236      875137        syn-C2H3C(O)NH2, v=0
  718691.2158  0.0022 -3.2355 3  568.0129127  71510 303632044      621943        syn-C2H3C(O)NH2, v=0
  718720.7774  0.0500 -4.4827 3 1263.4987193  71510 303962274      952373        syn-C2H3C(O)NH2, v=0
  718724.2366  0.0030 -4.8659 3  448.9085111  71510 303552035      551738        syn-C2H3C(O)NH2, v=0
  718783.6040  0.0064 -4.7770 3  175.4799 75  71510 303371027      36 730        syn-C2H3C(O)NH2, v=0
  718835.6686  0.0103 -3.7057 3  741.5945147  71510 303732054      721953        syn-C2H3C(O)NH2, v=0
  718878.9555  0.0021 -5.1446 3  282.1963 85  71510 303421923      421626        syn-C2H3C(O)NH2, v=0
  718881.5705  0.0021 -5.1446 3  282.1962 85  71510 303421924      421627        syn-C2H3C(O)NH2, v=0
  718889.4216  0.0043 -4.9691 3  456.9584119  71510 303591347      591050        syn-C2H3C(O)NH2, v=0
  718918.1342  0.0389 -5.1043 3  836.7536157  71510 303781959      781662        syn-C2H3C(O)NH2, v=0
  718960.1007  0.0087 -4.9300 3  758.0880147  71510 303732252      731955        syn-C2H3C(O)NH2, v=0
  719005.6793  0.0865 -4.9665 3 1521.9659173  71510 303865234      865135        syn-C2H3C(O)NH2, v=0
  719005.6793  0.0865 -4.9665 3 1521.9659173  71510 303865235      865136        syn-C2H3C(O)NH2, v=0
  719100.9350  0.0083 -5.4185 3  132.9663 67  71510 30333 825      32 528        syn-C2H3C(O)NH2, v=0
  719125.6809  0.0027 -3.6882 3  297.4494 97  71510 303481138      47 839        syn-C2H3C(O)NH2, v=0
  719320.8707  0.0861 -4.9337 3 1501.0222171  71510 303855233      855134        syn-C2H3C(O)NH2, v=0
  719320.8707  0.0861 -4.9337 3 1501.0222171  71510 303855234      855135        syn-C2H3C(O)NH2, v=0
  719351.6526  0.0493 -4.3601 3 1301.7747199  71510 303991980      982079        syn-C2H3C(O)NH2, v=0
  719361.7556  0.0493 -4.3600 3 1301.7744199  71510 303992080      981979        syn-C2H3C(O)NH2, v=0
  719525.6563  0.0041 -5.4565 3  289.3501 99  71510 30349 742      49 445        syn-C2H3C(O)NH2, v=0
  719527.8293  0.0041 -5.4565 3  289.3501 99  71510 30349 842      49 545        syn-C2H3C(O)NH2, v=0
  719626.8976  0.0857 -4.9018 3 1480.3254169  71510 303845232      845133        syn-C2H3C(O)NH2, v=0
  719626.8976  0.0857 -4.9018 3 1480.3254169  71510 303845233      845134        syn-C2H3C(O)NH2, v=0
  719797.2292  0.0022 -3.2343 3  567.9828127  71510 303632043      621944        syn-C2H3C(O)NH2, v=0
  719825.4276  0.0030 -4.8648 3  448.8717111  71510 303552036      551739        syn-C2H3C(O)NH2, v=0
  719858.8799  0.0154 -4.9902 3  707.2508145  71510 303721755      721458        syn-C2H3C(O)NH2, v=0
  719923.9661  0.0854 -4.8708 3 1459.8753167  71510 303835231      835132        syn-C2H3C(O)NH2, v=0
  719923.9661  0.0854 -4.8708 3 1459.8753167  71510 303835232      835133        syn-C2H3C(O)NH2, v=0
  719944.2308  0.0044 -4.8489 3  592.7563129  71510 303642144      641847        syn-C2H3C(O)NH2, v=0
  719971.0864  0.0083 -4.9331 3  685.9921139  71510 303692247      691950        syn-C2H3C(O)NH2, v=0
  720093.7943  0.0022 -5.1545 3  114.6181 55  71510 303271414      261115        syn-C2H3C(O)NH2, v=0
  720099.8965  0.0022 -5.1545 3  114.6179 55  71510 303271413      261116        syn-C2H3C(O)NH2, v=0
  720178.3659  0.0159 -5.0102 3  854.4255157  71510 303782257      781960        syn-C2H3C(O)NH2, v=0
  720212.2786  0.0851 -4.8407 3 1439.6718165  71510 303825230      825131        syn-C2H3C(O)NH2, v=0
  720212.2786  0.0851 -4.8407 3 1439.6718165  71510 303825231      825132        syn-C2H3C(O)NH2, v=0
  720385.2579  0.0034 -3.9731 3  289.7024 93  71510 303461433      451134        syn-C2H3C(O)NH2, v=0
  720468.8428  0.0063 -3.5849 3  509.4799123  71510 303611645      601546        syn-C2H3C(O)NH2, v=0
  720492.0339  0.0848 -4.8115 3 1419.7148163  71510 303815229      815130        syn-C2H3C(O)NH2, v=0
  720492.0339  0.0848 -4.8115 3 1419.7148163  71510 303815230      815131        syn-C2H3C(O)NH2, v=0
  720541.4801  0.0036 -4.1432 3  210.6106 87  71510 30343 538      42 439        syn-C2H3C(O)NH2, v=0
  720541.8140  0.0036 -4.1432 3  210.6106 87  71510 30343 638      42 339        syn-C2H3C(O)NH2, v=0
  720676.1315  0.0472 -4.3843 3 1289.9715197  71510 303982078      972177        syn-C2H3C(O)NH2, v=0
  720681.6960  0.0056 -4.9070 3  588.2228133  71510 303661651      661354        syn-C2H3C(O)NH2, v=0
  720763.4273  0.0846 -4.7833 3 1400.0041161  71510 303805228      805129        syn-C2H3C(O)NH2, v=0
  720763.4273  0.0846 -4.7833 3 1400.0041161  71510 303805229      805130        syn-C2H3C(O)NH2, v=0
  720820.4800  0.0471 -4.3841 3 1289.9685197  71510 303982178      972077        syn-C2H3C(O)NH2, v=0
  720830.6525  0.0017 -3.0313 3  510.1405117  71510 303582237      572136        syn-C2H3C(O)NH2, v=0
  720831.1203  0.0017 -3.0313 3  510.1405117  71510 303582236      572137        syn-C2H3C(O)NH2, v=0
  720896.7377  0.0022 -4.3988 3  188.9318 75  71510 303371324      361027        syn-C2H3C(O)NH2, v=0
  720906.1657  0.0249 -5.0431 3  770.6964151  71510 303751857      751560        syn-C2H3C(O)NH2, v=0
  721026.6507  0.0845 -4.7561 3 1380.5397159  71510 303795227      795128        syn-C2H3C(O)NH2, v=0
  721026.6507  0.0845 -4.7561 3 1380.5397159  71510 303795228      795129        syn-C2H3C(O)NH2, v=0
  721225.3177  0.0051 -2.5868 3  393.4858 69  71510 3033434 0      3333 1        syn-C2H3C(O)NH2, v=0
  721225.3177  0.0051 -2.5868 3  393.4858 69  71510 3033434 1      3333 0        syn-C2H3C(O)NH2, v=0
  721253.2391  0.0021 -5.1883 3  271.7638 83  71510 303411922      411625        syn-C2H3C(O)NH2, v=0
  721254.4586  0.0021 -5.1883 3  271.7638 83  71510 303411923      411626        syn-C2H3C(O)NH2, v=0
  721281.8927  0.0844 -4.7299 3 1361.3215157  71510 303785226      785127        syn-C2H3C(O)NH2, v=0
  721281.8927  0.0844 -4.7299 3 1361.3215157  71510 303785227      785128        syn-C2H3C(O)NH2, v=0
  721529.3387  0.0843 -4.7047 3 1342.3493155  71510 303775225      775126        syn-C2H3C(O)NH2, v=0
  721529.3387  0.0843 -4.7047 3 1342.3493155  71510 303775226      775127        syn-C2H3C(O)NH2, v=0
  721532.7216  0.0041 -5.4113 3  326.2739 97  71510 303481632      481137        syn-C2H3C(O)NH2, v=0
  721567.8843  0.0027 -3.7414 3  279.6499 95  71510 30347 938      46 839        syn-C2H3C(O)NH2, v=0
  721621.6874  0.0046 -3.4815 3  585.9338131  71510 303651847      641748        syn-C2H3C(O)NH2, v=0
  721668.1943  0.0039 -2.6050 3  394.9431 73  71510 3033633 3      3532 4        syn-C2H3C(O)NH2, v=0
  721668.1943  0.0039 -2.6050 3  394.9431 73  71510 3033633 4      3532 3        syn-C2H3C(O)NH2, v=0
  721769.1708  0.0842 -4.6807 3 1323.6231153  71510 303765224      765125        syn-C2H3C(O)NH2, v=0
  721769.1708  0.0842 -4.6807 3 1323.6231153  71510 303765225      765126        syn-C2H3C(O)NH2, v=0
  721806.9599  0.0024 -3.7106 3  338.7899101  71510 303501437      491138        syn-C2H3C(O)NH2, v=0
  721807.2583  0.0041 -5.0270 3  420.9436115  71510 303571146      57 849        syn-C2H3C(O)NH2, v=0
  721930.6404  0.0841 -4.2702 3 1414.5028225  71510 303B2 7A5      B1 8A4        syn-C2H3C(O)NH2, v=0
  721930.6404  0.0841 -4.2702 3 1414.5028225  71510 303B2 8A5      B1 7A4        syn-C2H3C(O)NH2, v=0
  721933.5300  0.0877 -4.2612 3 1418.1644227  71510 303B3 6A7      B2 7A6        syn-C2H3C(O)NH2, v=0
  721933.5300  0.0877 -4.2612 3 1418.1644227  71510 303B3 7A7      B2 6A6        syn-C2H3C(O)NH2, v=0
  721937.7355  0.0809 -4.2790 3 1410.3066223  71510 303B1 8A3      B0 9A2        syn-C2H3C(O)NH2, v=0
  721937.7355  0.0809 -4.2790 3 1410.3066223  71510 303B1 9A3      B0 8A2        syn-C2H3C(O)NH2, v=0
  721943.2298  0.0917 -4.2517 3 1421.2971229  71510 303B4 5A9      B3 6A8        syn-C2H3C(O)NH2, v=0
  721943.2298  0.0917 -4.2517 3 1421.2971229  71510 303B4 6A9      B3 5A8        syn-C2H3C(O)NH2, v=0
  721957.1207  0.0963 -4.2417 3 1423.9058231  71510 303B5 4B1      B4 5B0        syn-C2H3C(O)NH2, v=0
  721957.1207  0.0963 -4.2417 3 1423.9058231  71510 303B5 5B1      B4 4B0        syn-C2H3C(O)NH2, v=0
  721958.6986  0.0780 -4.2874 3 1405.5692221  71510 303B0 9A1      A910A0        syn-C2H3C(O)NH2, v=0
  721958.6986  0.0780 -4.2874 3 1405.5692221  71510 303B010A1      A9 9A0        syn-C2H3C(O)NH2, v=0
  721973.0228  0.1019 -4.2313 3 1425.9948233  71510 303B6 3B3      B5 4B2        syn-C2H3C(O)NH2, v=0
  721973.0228  0.1019 -4.2313 3 1425.9948233  71510 303B6 4B3      B5 3B2        syn-C2H3C(O)NH2, v=0
  721989.1071  0.1086 -4.2203 3 1427.5678235  71510 303B7 2B5      B6 3B4        syn-C2H3C(O)NH2, v=0
  721989.1071  0.1086 -4.2203 3 1427.5678235  71510 303B7 3B5      B6 2B4        syn-C2H3C(O)NH2, v=0
  721998.3296  0.0752 -4.2957 3 1400.2831219  71510 303A91099      A81198        syn-C2H3C(O)NH2, v=0
  721998.3296  0.0752 -4.2957 3 1400.2831219  71510 303A91199      A81098        syn-C2H3C(O)NH2, v=0
  722001.5680  0.0842 -4.6578 3 1305.1426151  71510 303755223      755124        syn-C2H3C(O)NH2, v=0
  722001.5680  0.0842 -4.6578 3 1305.1426151  71510 303755224      755125        syn-C2H3C(O)NH2, v=0
  722003.8272  0.1166 -4.2088 3 1428.6280237  71510 303B8 1B7      B7 2B6        syn-C2H3C(O)NH2, v=0
  722003.8272  0.1166 -4.2088 3 1428.6280237  71510 303B8 2B7      B7 1B6        syn-C2H3C(O)NH2, v=0
  722005.9107  0.0457 -4.4191 3 1277.2443195  71510 303972176      962275        syn-C2H3C(O)NH2, v=0
  722015.8655  0.1264 -4.1967 3 1429.1783239  71510 303B9 0B9      B8 1B8        syn-C2H3C(O)NH2, v=0
  722015.8655  0.1264 -4.1967 3 1429.1783239  71510 303B9 1B9      B8 0B8        syn-C2H3C(O)NH2, v=0
  722062.6295  0.0724 -4.3039 3 1394.4394217  71510 303A81197      A71296        syn-C2H3C(O)NH2, v=0
  722062.6295  0.0724 -4.3039 3 1394.4394217  71510 303A81297      A71196        syn-C2H3C(O)NH2, v=0
  722101.4843  0.0030 -2.6256 3  397.8650 77  71510 3033832 6      3731 7        syn-C2H3C(O)NH2, v=0
  722101.4843  0.0030 -2.6256 3  397.8650 77  71510 3033832 7      3731 6        syn-C2H3C(O)NH2, v=0
  722159.1996  0.0698 -4.3121 3 1388.0276215  71510 303A71295      A61394        syn-C2H3C(O)NH2, v=0
  722159.1996  0.0698 -4.3121 3 1388.0276215  71510 303A71395      A61294        syn-C2H3C(O)NH2, v=0
  722178.8745  0.0041 -5.0266 3  420.9436115  71510 303571246      57 949        syn-C2H3C(O)NH2, v=0
  722194.9123  0.0026 -5.3289 3  126.5828 63  71510 303311121      30 624        syn-C2H3C(O)NH2, v=0
  722226.7062  0.0842 -4.6362 3 1286.9079149  71510 303745222      745123        syn-C2H3C(O)NH2, v=0
  722226.7062  0.0842 -4.6362 3 1286.9079149  71510 303745223      745124        syn-C2H3C(O)NH2, v=0
  722297.5566  0.0037 -5.3092 3  320.3587103  71510 30351 843      51 546        syn-C2H3C(O)NH2, v=0
  722297.8143  0.0671 -4.3205 3 1381.0353213  71510 303A61393      A51492        syn-C2H3C(O)NH2, v=0
  722297.8143  0.0671 -4.3205 3 1381.0353213  71510 303A61493      A51392        syn-C2H3C(O)NH2, v=0
  722306.5568  0.0037 -5.3092 3  320.3587103  71510 30351 943      51 646        syn-C2H3C(O)NH2, v=0
  722377.2117  0.0017 -2.9658 3  491.7776113  71510 303562334      552233        syn-C2H3C(O)NH2, v=0
  722377.2186  0.0017 -2.9658 3  491.7776113  71510 303562333      552234        syn-C2H3C(O)NH2, v=0
  722433.7558  0.0026 -3.7406 3  279.6495 95  71510 303471038      46 739        syn-C2H3C(O)NH2, v=0
  722444.7583  0.0843 -4.6158 3 1268.9188147  71510 303735221      735122        syn-C2H3C(O)NH2, v=0
  722444.7583  0.0843 -4.6158 3 1268.9188147  71510 303735222      735123        syn-C2H3C(O)NH2, v=0
  722491.2662  0.0646 -4.3292 3 1373.4478211  71510 303A51491      A41590        syn-C2H3C(O)NH2, v=0
  722491.2662  0.0646 -4.3292 3 1373.4478211  71510 303A51591      A41490        syn-C2H3C(O)NH2, v=0
  722518.2496  0.0025 -2.6488 3  402.2575 81  71510 3034031 9      393010        syn-C2H3C(O)NH2, v=0
  722518.2496  0.0025 -2.6488 3  402.2575 81  71510 303403110      3930 9        syn-C2H3C(O)NH2, v=0
  722655.8944  0.0844 -4.5968 3 1251.1753145  71510 303725220      725121        syn-C2H3C(O)NH2, v=0
  722655.8944  0.0844 -4.5968 3 1251.1753145  71510 303725221      725122        syn-C2H3C(O)NH2, v=0
  722756.6547  0.0620 -4.3386 3 1365.2472209  71510 303A41589      A31688        syn-C2H3C(O)NH2, v=0
  722756.6548  0.0620 -4.3386 3 1365.2472209  71510 303A41689      A31588        syn-C2H3C(O)NH2, v=0
  722860.2814  0.0845 -4.5793 3 1233.6771143  71510 303715219      715120        syn-C2H3C(O)NH2, v=0
  722860.2814  0.0845 -4.5793 3 1233.6771143  71510 303715220      715121        syn-C2H3C(O)NH2, v=0
  722908.4358  0.0021 -2.6748 3  408.1279 85  71510 303423012      412913        syn-C2H3C(O)NH2, v=0
  722908.4358  0.0021 -2.6748 3  408.1279 85  71510 303423013      412912        syn-C2H3C(O)NH2, v=0
  723033.4004  0.0031 -4.0030 3  227.5053 89  71510 30344 638      43 539        syn-C2H3C(O)NH2, v=0
  723036.5033  0.0031 -4.0030 3  227.5053 89  71510 30344 738      43 439        syn-C2H3C(O)NH2, v=0
  723058.0836  0.0846 -4.5633 3 1216.4243141  71510 303705218      705119        syn-C2H3C(O)NH2, v=0
  723058.0836  0.0846 -4.5633 3 1216.4243141  71510 303705219      705120        syn-C2H3C(O)NH2, v=0
  723117.4337  0.0595 -4.3490 3 1356.4112207  71510 303A31687      A21786        syn-C2H3C(O)NH2, v=0
  723117.4344  0.0595 -4.3490 3 1356.4112207  71510 303A31787      A21686        syn-C2H3C(O)NH2, v=0
  723242.4247  0.0018 -2.9086 3  475.1054109  71510 303542430      532331        syn-C2H3C(O)NH2, v=0
  723242.4247  0.0018 -2.9086 3  475.1054109  71510 303542431      532330        syn-C2H3C(O)NH2, v=0
  723249.4624  0.0848 -4.5489 3 1199.4167139  71510 303695217      695118        syn-C2H3C(O)NH2, v=0
  723249.4624  0.0848 -4.5489 3 1199.4167139  71510 303695218      695119        syn-C2H3C(O)NH2, v=0
  723257.6130  0.0020 -2.7039 3  415.4851 89  71510 303442915      432816        syn-C2H3C(O)NH2, v=0
  723257.6130  0.0020 -2.7039 3  415.4851 89  71510 303442916      432815        syn-C2H3C(O)NH2, v=0
  723427.0116  0.0053 -4.9323 3  547.9469129  71510 303641450      641153        syn-C2H3C(O)NH2, v=0
  723434.5763  0.0850 -4.5364 3 1182.6543137  71510 303685216      685117        syn-C2H3C(O)NH2, v=0
  723434.5763  0.0850 -4.5364 3 1182.6543137  71510 303685217      685118        syn-C2H3C(O)NH2, v=0
  723438.6200  0.0021 -5.2348 3  261.5921 81  71510 303401921      401624        syn-C2H3C(O)NH2, v=0
  723439.1746  0.0021 -5.2348 3  261.5921 81  71510 303401922      401625        syn-C2H3C(O)NH2, v=0
  723498.5869  0.0054 -3.6515 3  390.5585109  71510 303541341      531242        syn-C2H3C(O)NH2, v=0
  723545.1374  0.0019 -2.7364 3  424.3407 93  71510 303462818      452719        syn-C2H3C(O)NH2, v=0
  723545.1374  0.0019 -2.7364 3  424.3407 93  71510 303462819      452718        syn-C2H3C(O)NH2, v=0
  723606.8209  0.0570 -4.3609 3 1346.9121205  71510 303A21785      A11884        syn-C2H3C(O)NH2, v=0
  723606.8374  0.0570 -4.3609 3 1346.9121205  71510 303A21885      A11784        syn-C2H3C(O)NH2, v=0
  723613.5813  0.0852 -4.5258 3 1166.1369135  71510 303675215      675116        syn-C2H3C(O)NH2, v=0
  723613.5813  0.0852 -4.5258 3 1166.1369135  71510 303675216      675117        syn-C2H3C(O)NH2, v=0
  723646.9975  0.0038 -5.1001 3  386.1653111  71510 303551045      55 748        syn-C2H3C(O)NH2, v=0
  723657.1600  0.0060 -5.2707 3  371.0146105  71510 303521537      521042        syn-C2H3C(O)NH2, v=0
  723668.7669  0.0018 -2.8581 3  460.0634105  71510 303522527      512428        syn-C2H3C(O)NH2, v=0
  723668.7669  0.0018 -2.8581 3  460.0634105  71510 303522528      512427        syn-C2H3C(O)NH2, v=0
  723693.2585  0.0447 -4.4170 3 1277.2097195  71510 303972276      962175        syn-C2H3C(O)NH2, v=0
  723727.0010  0.0036 -5.1927 3  352.6336107  71510 30353 944      53 647        syn-C2H3C(O)NH2, v=0
  723741.3996  0.0019 -2.7726 3  434.7090 97  71510 303482721      472622        syn-C2H3C(O)NH2, v=0
  723741.3996  0.0019 -2.7726 3  434.7090 97  71510 303482722      472621        syn-C2H3C(O)NH2, v=0
  723760.8699  0.0036 -5.1927 3  352.6336107  71510 303531044      53 747        syn-C2H3C(O)NH2, v=0
  723761.3479  0.0080 -4.9235 3  739.4950145  71510 303722251      721954        syn-C2H3C(O)NH2, v=0
  723763.8276  0.0038 -5.1000 3  386.1653111  71510 303551145      55 848        syn-C2H3C(O)NH2, v=0
  723786.6305  0.0854 -4.5173 3 1149.8644133  71510 303665214      665115        syn-C2H3C(O)NH2, v=0
  723786.6305  0.0854 -4.5173 3 1149.8644133  71510 303665215      665116        syn-C2H3C(O)NH2, v=0
  723803.5723  0.0019 -2.8130 3  446.6086101  71510 303502624      492525        syn-C2H3C(O)NH2, v=0
  723803.5723  0.0019 -2.8130 3  446.6086101  71510 303502625      492524        syn-C2H3C(O)NH2, v=0
  723877.5467  0.0025 -3.2694 3  583.9482129  71510 303642045      631944        syn-C2H3C(O)NH2, v=0
  723953.8746  0.0857 -4.5113 3 1133.8368131  71510 303655213      655114        syn-C2H3C(O)NH2, v=0
  723953.8746  0.0857 -4.5113 3 1133.8368131  71510 303655214      655115        syn-C2H3C(O)NH2, v=0
  724060.8259  0.0026 -3.8086 3  262.0429 93  71510 30346 838      45 739        syn-C2H3C(O)NH2, v=0
  724115.4614  0.0860 -4.5078 3 1118.0539129  71510 303645212      645113        syn-C2H3C(O)NH2, v=0
  724115.4614  0.0860 -4.5078 3 1118.0539129  71510 303645213      645114        syn-C2H3C(O)NH2, v=0
  724166.5716  0.0049 -5.1914 3  390.4700107  71510 303531637      531142        syn-C2H3C(O)NH2, v=0
  724217.5045  0.0026 -3.8084 3  262.0428 93  71510 30346 938      45 639        syn-C2H3C(O)NH2, v=0
  724271.5363  0.0863 -4.5074 3 1102.5158127  71510 303635211      635112        syn-C2H3C(O)NH2, v=0
  724271.5363  0.0863 -4.5074 3 1102.5158127  71510 303635212      635113        syn-C2H3C(O)NH2, v=0
  724273.7440  0.0547 -4.3749 3 1336.7142203  71510 303A11883      A01982        syn-C2H3C(O)NH2, v=0
  724274.0814  0.0547 -4.3749 3 1336.7142203  71510 303A11983      A01882        syn-C2H3C(O)NH2, v=0
  724319.1991  0.0028 -3.8942 3  244.6548 91  71510 30345 738      44 639        syn-C2H3C(O)NH2, v=0
  724343.2081  0.0028 -3.8942 3  244.6548 91  71510 30345 838      44 539        syn-C2H3C(O)NH2, v=0
  724422.2422  0.0866 -4.5105 3 1087.2222125  71510 303625210      625111        syn-C2H3C(O)NH2, v=0
  724422.2422  0.0866 -4.5105 3 1087.2222125  71510 303625211      625112        syn-C2H3C(O)NH2, v=0
  724425.5552  0.0035 -3.6677 3  327.2975101  71510 303501139      491040        syn-C2H3C(O)NH2, v=0
  724437.4657  0.1343 -5.5825 3 1253.3832189  71510 303942767      942470        syn-C2H3C(O)NH2, v=0
  724454.2255  0.0029 -4.8832 3  435.0296109  71510 303542034      541737        syn-C2H3C(O)NH2, v=0
  724488.8967  0.0019 -3.1353 3  545.3038123  71510 303612141      602040        syn-C2H3C(O)NH2, v=0
  724529.0022  0.0019 -3.1353 3  545.3027123  71510 303612140      602041        syn-C2H3C(O)NH2, v=0
  724547.3860  0.1836 -5.0191 3 1442.6013205  71510 303A22577      A12676        syn-C2H3C(O)NH2, v=0
  724567.7193  0.0869 -4.5176 3 1072.1731123  71510 3036152 9      615110        syn-C2H3C(O)NH2, v=0
  724567.7193  0.0869 -4.5176 3 1072.1731123  71510 303615210      615111        syn-C2H3C(O)NH2, v=0
  724705.4204  0.0067 -5.4159 3  339.3637101  71510 303501436      50 941        syn-C2H3C(O)NH2, v=0
  724708.1054  0.0873 -4.5295 3 1057.3685121  71510 3036052 8      6051 9        syn-C2H3C(O)NH2, v=0
  724708.1054  0.0873 -4.5295 3 1057.3685121  71510 3036052 9      605110        syn-C2H3C(O)NH2, v=0
  724843.5359  0.0877 -4.5472 3 1042.8082119  71510 3035952 7      5951 8        syn-C2H3C(O)NH2, v=0
  724843.5359  0.0877 -4.5472 3 1042.8082119  71510 3035952 8      5951 9        syn-C2H3C(O)NH2, v=0
  724974.1437  0.0881 -4.5722 3 1028.4921117  71510 3035852 6      5851 7        syn-C2H3C(O)NH2, v=0
  724974.1437  0.0881 -4.5722 3 1028.4921117  71510 3035852 7      5851 8        syn-C2H3C(O)NH2, v=0
  724976.8206  0.0101 -4.9321 3  689.6962143  71510 303711854      711557        syn-C2H3C(O)NH2, v=0
  725088.4228  0.0029 -4.8825 3  435.0084109  71510 303542035      541738        syn-C2H3C(O)NH2, v=0
  725100.0592  0.0885 -4.6065 3 1014.4202115  71510 3035752 5      5751 6        syn-C2H3C(O)NH2, v=0
  725100.0592  0.0885 -4.6065 3 1014.4202115  71510 3035752 6      5751 7        syn-C2H3C(O)NH2, v=0
  725192.4081  0.0524 -4.3922 3 1325.7698201  71510 303A01981      992080        syn-C2H3C(O)NH2, v=0
  725198.3154  0.0524 -4.3922 3 1325.7696201  71510 303A02081      991980        syn-C2H3C(O)NH2, v=0
  725221.4105  0.0889 -4.6535 3 1000.5925113  71510 3035652 4      5651 5        syn-C2H3C(O)NH2, v=0
  725221.4105  0.0889 -4.6535 3 1000.5925113  71510 3035652 5      5651 6        syn-C2H3C(O)NH2, v=0
  725338.3233  0.0893 -4.7187 3  987.0087111  71510 3035552 3      5551 4        syn-C2H3C(O)NH2, v=0
  725338.3233  0.0893 -4.7187 3  987.0087111  71510 3035552 4      5551 5        syn-C2H3C(O)NH2, v=0
  725448.9797  0.0021 -5.2844 3  251.6801 79  71510 303391920      391623        syn-C2H3C(O)NH2, v=0
  725449.2256  0.0021 -5.2844 3  251.6801 79  71510 303391921      391624        syn-C2H3C(O)NH2, v=0
  725450.9211  0.0897 -4.8122 3  973.6689109  71510 3035452 2      5451 3        syn-C2H3C(O)NH2, v=0
  725450.9211  0.0897 -4.8122 3  973.6689109  71510 3035452 3      5451 4        syn-C2H3C(O)NH2, v=0
  725559.3247  0.0902 -4.9573 3  960.5730107  71510 3035352 1      5351 2        syn-C2H3C(O)NH2, v=0
  725559.3247  0.0902 -4.9573 3  960.5730107  71510 3035352 2      5351 3        syn-C2H3C(O)NH2, v=0
  725663.6529  0.0906 -5.2278 3  947.7209105  71510 3035252 0      5251 1        syn-C2H3C(O)NH2, v=0
  725663.6529  0.0906 -5.2278 3  947.7209105  71510 3035252 1      5251 2        syn-C2H3C(O)NH2, v=0
  725764.3244  0.0025 -3.2675 3  583.8972129  71510 303642044      631945        syn-C2H3C(O)NH2, v=0
  725790.8354  0.0057 -5.0492 3  169.7753 83  71510 30341 239      40 140        syn-C2H3C(O)NH2, v=0
  725790.8355  0.0057 -5.0492 3  169.7753 83  71510 30341 339      40 040        syn-C2H3C(O)NH2, v=0
  725953.8700  0.0021 -5.0735 3  121.3074 57  71510 303281415      271116        syn-C2H3C(O)NH2, v=0
  725967.8852  0.0021 -5.0735 3  121.3069 57  71510 303281414      271117        syn-C2H3C(O)NH2, v=0
  725970.5848  0.0374 -4.1746 3 1022.5568173  71510 303862265      852164        syn-C2H3C(O)NH2, v=0
  726011.4729  0.0032 -4.3130 3  213.0145 81  71510 303401228      39 931        syn-C2H3C(O)NH2, v=0
  726064.3777  0.1143 -5.7258 3 1965.0386209  71510 303A45351      A45252        syn-C2H3C(O)NH2, v=0
  726064.3777  0.1143 -5.7258 3 1965.0386209  71510 303A45352      A45253        syn-C2H3C(O)NH2, v=0
  726175.7700  0.1576 -5.4669 3 1149.6789183  71510 303912368      912071        syn-C2H3C(O)NH2, v=0
  726284.5389  0.0022 -4.3547 3  198.2603 77  71510 303381325      371028        syn-C2H3C(O)NH2, v=0
  726457.5454  0.0502 -4.4146 3 1314.0125199  71510 303992079      982178        syn-C2H3C(O)NH2, v=0
  726474.4845  0.0037 -4.0564 3  277.8908 91  71510 303451432      441133        syn-C2H3C(O)NH2, v=0
  726535.6598  0.0035 -3.4134 3  609.2973133  71510 303661947      651848        syn-C2H3C(O)NH2, v=0
  726543.3809  0.0504 -4.5003 3 1287.6771195  71510 303972275      962374        syn-C2H3C(O)NH2, v=0
  726544.6417  0.0501 -4.4145 3 1314.0107199  71510 303992179      982078        syn-C2H3C(O)NH2, v=0
  726561.5779  0.1127 -5.6800 3 1939.6471207  71510 303A35350      A35251        syn-C2H3C(O)NH2, v=0
  726561.5779  0.1127 -5.6800 3 1939.6471207  71510 303A35351      A35252        syn-C2H3C(O)NH2, v=0
  726732.3479  0.0050 -4.5180 3  198.5703 79  71510 303391128      38 831        syn-C2H3C(O)NH2, v=0
  726884.7995  0.0189 -5.0380 3  874.3190159  71510 303792258      791961        syn-C2H3C(O)NH2, v=0
  726963.1646  0.0041 -4.8547 3  576.4857127  71510 303632143      631846        syn-C2H3C(O)NH2, v=0
  727045.9435  0.1111 -5.6348 3 1914.5044205  71510 303A25349      A25250        syn-C2H3C(O)NH2, v=0
  727045.9435  0.1111 -5.6348 3 1914.5044205  71510 303A25350      A25251        syn-C2H3C(O)NH2, v=0
  727296.8905  0.0021 -5.3374 3  242.0268 77  71510 303381919      381622        syn-C2H3C(O)NH2, v=0
  727296.9965  0.0021 -5.3374 3  242.0268 77  71510 303381920      381623        syn-C2H3C(O)NH2, v=0
  727307.8433  0.0085 -3.6472 3  722.7089145  71510 303722053      711952        syn-C2H3C(O)NH2, v=0
  727483.8356  0.0018 -3.0553 3  524.5759119  71510 303592238      582137        syn-C2H3C(O)NH2, v=0
  727484.7940  0.0018 -3.0553 3  524.5759119  71510 303592237      582138        syn-C2H3C(O)NH2, v=0
  727517.7438  0.1097 -5.5904 3 1889.6103203  71510 303A15348      A15249        syn-C2H3C(O)NH2, v=0
  727517.7438  0.1097 -5.5904 3 1889.6103203  71510 303A15349      A15250        syn-C2H3C(O)NH2, v=0
  727656.1447  0.0044 -3.6577 3  358.3369105  71510 303521240      511141        syn-C2H3C(O)NH2, v=0
  727912.7068  0.0484 -4.4462 3 1301.3495197  71510 303982177      972276        syn-C2H3C(O)NH2, v=0
  727930.8666  0.0888 -4.3087 3 1438.5838227  71510 303B3 7A6      B2 8A5        syn-C2H3C(O)NH2, v=0
  727930.8666  0.0888 -4.3087 3 1438.5838227  71510 303B3 8A6      B2 7A5        syn-C2H3C(O)NH2, v=0
  727934.6132  0.0925 -4.2998 3 1442.2455229  71510 303B4 6A8      B3 7A7        syn-C2H3C(O)NH2, v=0
  727934.6132  0.0925 -4.2998 3 1442.2455229  71510 303B4 7A8      B3 6A7        syn-C2H3C(O)NH2, v=0
  727936.7604  0.0855 -4.3173 3 1434.3878225  71510 303B2 8A4      B1 9A3        syn-C2H3C(O)NH2, v=0
  727936.7604  0.0855 -4.3173 3 1434.3878225  71510 303B2 9A4      B1 8A3        syn-C2H3C(O)NH2, v=0
  727944.9101  0.0968 -4.2905 3 1445.3785231  71510 303B5 5B0      B4 6A9        syn-C2H3C(O)NH2, v=0
  727944.9101  0.0968 -4.2905 3 1445.3785231  71510 303B5 6B0      B4 5A9        syn-C2H3C(O)NH2, v=0
  727956.0649  0.0824 -4.3255 3 1429.6512223  71510 303B1 9A2      B010A1        syn-C2H3C(O)NH2, v=0
  727956.0649  0.0824 -4.3255 3 1429.6512223  71510 303B110A2      B0 9A1        syn-C2H3C(O)NH2, v=0
  727959.2019  0.1017 -4.2807 3 1447.9877233  71510 303B6 4B2      B5 5B1        syn-C2H3C(O)NH2, v=0
  727959.2019  0.1017 -4.2807 3 1447.9877233  71510 303B6 5B2      B5 4B1        syn-C2H3C(O)NH2, v=0
  727975.3569  0.1075 -4.2704 3 1450.0772235  71510 303B7 3B4      B6 4B3        syn-C2H3C(O)NH2, v=0
  727975.3569  0.1075 -4.2704 3 1450.0772235  71510 303B7 4B4      B6 3B3        syn-C2H3C(O)NH2, v=0
  727977.2430  0.1083 -5.5466 3 1864.9648201  71510 303A05347      A05248        syn-C2H3C(O)NH2, v=0
  727977.2430  0.1083 -5.5466 3 1864.9648201  71510 303A05348      A05249        syn-C2H3C(O)NH2, v=0
  727991.5824  0.1144 -4.2596 3 1451.6507237  71510 303B8 2B6      B7 3B5        syn-C2H3C(O)NH2, v=0
  727991.5824  0.1144 -4.2596 3 1451.6507237  71510 303B8 3B6      B7 2B5        syn-C2H3C(O)NH2, v=0
  727993.4275  0.0794 -4.3335 3 1424.3664221  71510 303B010A0      A91199        syn-C2H3C(O)NH2, v=0
  727993.4275  0.0794 -4.3335 3 1424.3664221  71510 303B011A0      A91099        syn-C2H3C(O)NH2, v=0
  728006.3597  0.1228 -4.2482 3 1452.7115239  71510 303B9 1B8      B8 2B7        syn-C2H3C(O)NH2, v=0
  728006.3597  0.1228 -4.2482 3 1452.7115239  71510 303B9 2B8      B8 1B7        syn-C2H3C(O)NH2, v=0
  728018.3923  0.1330 -4.2362 3 1453.2622241  71510 303C0 0C0      B9 1B9        syn-C2H3C(O)NH2, v=0
  728018.3923  0.1330 -4.2362 3 1453.2622241  71510 303C0 1C0      B9 0B9        syn-C2H3C(O)NH2, v=0
  728035.2684  0.0042 -4.8672 3  560.6838125  71510 303622141      621844        syn-C2H3C(O)NH2, v=0
  728054.6412  0.0766 -4.3414 3 1418.5248219  71510 303A91198      A81297        syn-C2H3C(O)NH2, v=0
  728054.6412  0.0766 -4.3414 3 1418.5248219  71510 303A91298      A81197        syn-C2H3C(O)NH2, v=0
  728147.0194  0.0738 -4.3493 3 1412.1162217  71510 303A81296      A71395        syn-C2H3C(O)NH2, v=0
  728147.0194  0.0738 -4.3493 3 1412.1162217  71510 303A81396      A71295        syn-C2H3C(O)NH2, v=0
  728279.9306  0.0710 -4.3574 3 1405.1286215  71510 303A71394      A61493        syn-C2H3C(O)NH2, v=0
  728279.9306  0.0710 -4.3574 3 1405.1286215  71510 303A71494      A61393        syn-C2H3C(O)NH2, v=0
  728299.1364  0.0049 -4.9277 3  547.9472129  71510 303641550      641253        syn-C2H3C(O)NH2, v=0
  728424.6999  0.1071 -5.5035 3 1840.5677199  71510 303995346      995247        syn-C2H3C(O)NH2, v=0
  728424.6999  0.1071 -5.5035 3 1840.5677199  71510 303995347      995248        syn-C2H3C(O)NH2, v=0
  728465.5831  0.0683 -4.3658 3 1397.5476213  71510 303A61492      A51591        syn-C2H3C(O)NH2, v=0
  728465.5831  0.0683 -4.3658 3 1397.5476213  71510 303A61592      A51491        syn-C2H3C(O)NH2, v=0
  728483.3978  0.0050 -2.5965 3  401.7509 71  71510 3033534 1      3433 2        syn-C2H3C(O)NH2, v=0
  728483.3978  0.0050 -2.5965 3  401.7509 71  71510 3033534 2      3433 1        syn-C2H3C(O)NH2, v=0
  728611.2862  0.0028 -3.3055 3  600.1747131  71510 303652046      641945        syn-C2H3C(O)NH2, v=0
  728720.2125  0.0657 -4.3747 3 1389.3557211  71510 303A51590      A41689        syn-C2H3C(O)NH2, v=0
  728720.2125  0.0657 -4.3747 3 1389.3557211  71510 303A51690      A41589        syn-C2H3C(O)NH2, v=0
  728860.3683  0.1059 -5.4611 3 1816.4188197  71510 303985345      985246        syn-C2H3C(O)NH2, v=0
  728860.3683  0.1059 -5.4611 3 1816.4188197  71510 303985346      985247        syn-C2H3C(O)NH2, v=0
  728923.9724  0.0038 -2.6154 3  403.7007 75  71510 3033733 4      3632 5        syn-C2H3C(O)NH2, v=0
  728923.9724  0.0038 -2.6154 3  403.7007 75  71510 3033733 5      3632 4        syn-C2H3C(O)NH2, v=0
  728970.8465  0.0477 -4.4449 3 1301.3278197  71510 303982277      972176        syn-C2H3C(O)NH2, v=0
  728993.8254  0.0021 -5.3939 3  232.6312 75  71510 303371918      371621        syn-C2H3C(O)NH2, v=0
  728993.8698  0.0021 -5.3939 3  232.6312 75  71510 303371919      371622        syn-C2H3C(O)NH2, v=0
  729065.9507  0.0631 -4.3846 3 1380.5318209  71510 303A41688      A31787        syn-C2H3C(O)NH2, v=0
  729065.9511  0.0631 -4.3846 3 1380.5318209  71510 303A41788      A31687        syn-C2H3C(O)NH2, v=0
  729224.0793  0.0018 -2.9876 3  505.6533115  71510 303572335      562234        syn-C2H3C(O)NH2, v=0
  729224.0948  0.0018 -2.9876 3  505.6533115  71510 303572334      562235        syn-C2H3C(O)NH2, v=0
  729284.4968  0.1047 -5.4194 3 1792.5181195  71510 303975344      975245        syn-C2H3C(O)NH2, v=0
  729284.4968  0.1047 -5.4194 3 1792.5181195  71510 303975345      975246        syn-C2H3C(O)NH2, v=0
  729353.0713  0.0030 -2.6367 3  407.1169 79  71510 3033932 7      3831 8        syn-C2H3C(O)NH2, v=0
  729353.0713  0.0030 -2.6367 3  407.1169 79  71510 3033932 8      3831 7        syn-C2H3C(O)NH2, v=0
  729354.8571  0.0157 -5.0291 3  785.6662149  71510 303742351      742054        syn-C2H3C(O)NH2, v=0
  729533.9076  0.0605 -4.3958 3 1371.0491207  71510 303A31786      A21885        syn-C2H3C(O)NH2, v=0
  729533.9167  0.0605 -4.3958 3 1371.0491207  71510 303A31886      A21785        syn-C2H3C(O)NH2, v=0
  729605.8915  0.0074 -4.9191 3  721.1459143  71510 303712250      711953        syn-C2H3C(O)NH2, v=0
  729639.5245  0.0028 -4.9022 3  421.4317107  71510 303532033      531736        syn-C2H3C(O)NH2, v=0
  729697.3296  0.1037 -5.3785 3 1768.8654193  71510 303965343      965244        syn-C2H3C(O)NH2, v=0
  729697.3296  0.1037 -5.3785 3 1768.8654193  71510 303965344      965245        syn-C2H3C(O)NH2, v=0
  729763.0452  0.0024 -2.6607 3  412.0056 83  71510 303413110      403011        syn-C2H3C(O)NH2, v=0
  729763.0452  0.0024 -2.6607 3  412.0056 83  71510 303413111      403010        syn-C2H3C(O)NH2, v=0
  729830.0959  0.4619 -5.6746 3 1716.3942223  71510 303B12883      B02982        syn-C2H3C(O)NH2, v=0
  729900.8106  0.2590 -5.2293 3 1531.2690211  71510 303A52679      A42778        syn-C2H3C(O)NH2, v=0
  729944.5892  0.0710 -4.6336 3 1322.0513197  71510 303982375      972474        syn-C2H3C(O)NH2, v=0
  729950.6378  0.0025 -3.6797 3  351.4617103  71510 303511438      501139        syn-C2H3C(O)NH2, v=0
  729997.6817  0.0028 -4.9018 3  421.4197107  71510 303532034      531737        syn-C2H3C(O)NH2, v=0
  730082.3734  0.0905 -5.4246 3 1126.1566179  71510 303892663      892366        syn-C2H3C(O)NH2, v=0
  730099.1059  0.1027 -5.3382 3 1745.4605191  71510 303955342      955243        syn-C2H3C(O)NH2, v=0
  730099.1059  0.1027 -5.3382 3 1745.4605191  71510 303955343      955244        syn-C2H3C(O)NH2, v=0
  730142.8902  0.0021 -2.6876 3  418.3747 87  71510 303433013      422914        syn-C2H3C(O)NH2, v=0
  730142.8902  0.0021 -2.6876 3  418.3747 87  71510 303433014      422913        syn-C2H3C(O)NH2, v=0
  730169.5041  0.0580 -4.4089 3 1360.8734205  71510 303A21884      A11983        syn-C2H3C(O)NH2, v=0
  730169.6954  0.0580 -4.4089 3 1360.8734205  71510 303A21984      A11883        syn-C2H3C(O)NH2, v=0
  730216.9086  0.0018 -2.9287 3  488.4380111  71510 303552432      542331        syn-C2H3C(O)NH2, v=0
  730216.9087  0.0018 -2.9287 3  488.4380111  71510 303552431      542332        syn-C2H3C(O)NH2, v=0
  730476.8942  0.0020 -2.7177 3  426.2336 91  71510 303452916      442817        syn-C2H3C(O)NH2, v=0
  730476.8942  0.0020 -2.7177 3  426.2336 91  71510 303452917      442816        syn-C2H3C(O)NH2, v=0
  730490.0604  0.1018 -5.2987 3 1722.3033189  71510 303945341      945242        syn-C2H3C(O)NH2, v=0
  730490.0604  0.1018 -5.2987 3 1722.3033189  71510 303945342      945243        syn-C2H3C(O)NH2, v=0
  730495.3390  0.0213 -5.0264 3  845.9101157  71510 303782158      781861        syn-C2H3C(O)NH2, v=0
  730550.3186  0.0021 -5.4544 3  223.4925 73  71510 303361917      361620        syn-C2H3C(O)NH2, v=0
  730550.3366  0.0021 -5.4544 3  223.4925 73  71510 303361918      361621        syn-C2H3C(O)NH2, v=0
  730723.2418  0.0021 -3.1635 3  560.5937125  71510 303622142      612041        syn-C2H3C(O)NH2, v=0
  730730.7464  0.0018 -2.8766 3  472.8647107  71510 303532528      522429        syn-C2H3C(O)NH2, v=0
  730730.7464  0.0018 -2.8766 3  472.8647107  71510 303532529      522428        syn-C2H3C(O)NH2, v=0
  730742.6546  0.0019 -2.7512 3  435.5945 95  71510 303472819      462720        syn-C2H3C(O)NH2, v=0
  730742.6546  0.0019 -2.7512 3  435.5945 95  71510 303472820      462719        syn-C2H3C(O)NH2, v=0
  730761.5899  0.0214 -3.9311 3  866.0594159  71510 303792159      782058        syn-C2H3C(O)NH2, v=0
  730797.7962  0.0021 -3.1635 3  560.5917125  71510 303622141      612042        syn-C2H3C(O)NH2, v=0
  730870.4236  0.1009 -5.2599 3 1699.3938187  71510 303935340      935241        syn-C2H3C(O)NH2, v=0
  730870.4236  0.1009 -5.2599 3 1699.3938187  71510 303935341      935242        syn-C2H3C(O)NH2, v=0
  730903.6591  0.0049 -4.6054 3  186.2303 85  71510 30342 339      41 240        syn-C2H3C(O)NH2, v=0
  730903.6600  0.0049 -4.6054 3  186.2303 85  71510 30342 439      41 140        syn-C2H3C(O)NH2, v=0
  730908.0994  0.0019 -2.7885 3  446.4726 99  71510 303492722      482623        syn-C2H3C(O)NH2, v=0
  730908.0994  0.0019 -2.7885 3  446.4726 99  71510 303492723      482622        syn-C2H3C(O)NH2, v=0
  730926.8569  0.0019 -2.8301 3  458.8875103  71510 303512625      502526        syn-C2H3C(O)NH2, v=0
  730926.8569  0.0019 -2.8301 3  458.8875103  71510 303512626      502525        syn-C2H3C(O)NH2, v=0
  731041.4502  0.0556 -4.4251 3 1349.9597203  71510 303A11982      A02081        syn-C2H3C(O)NH2, v=0
  731044.8878  0.0556 -4.4251 3 1349.9596203  71510 303A12082      A01981        syn-C2H3C(O)NH2, v=0
  731240.4216  0.1001 -5.2219 3 1676.7317185  71510 303925339      925240        syn-C2H3C(O)NH2, v=0
  731240.4216  0.1001 -5.2219 3 1676.7317185  71510 303925340      925241        syn-C2H3C(O)NH2, v=0
  731539.7800  0.0043 -5.5177 3  313.9139 95  71510 303471631      471136        syn-C2H3C(O)NH2, v=0
  731557.2797  0.3526 -5.4488 3 1622.5321217  71510 303A82781      A72880        syn-C2H3C(O)NH2, v=0
  731600.2763  0.0994 -5.1846 3 1654.3169183  71510 303915338      915239        syn-C2H3C(O)NH2, v=0
  731600.2763  0.0994 -5.1846 3 1654.3169183  71510 303915339      915240        syn-C2H3C(O)NH2, v=0
  731610.8362  0.0184 -4.9972 3  798.5441153  71510 303762057      761760        syn-C2H3C(O)NH2, v=0
  731612.3506  0.0021 -4.9972 3  128.2565 59  71510 303291416      281117        syn-C2H3C(O)NH2, v=0
  731643.3080  0.0021 -4.9971 3  128.2554 59  71510 303291415      281118        syn-C2H3C(O)NH2, v=0
  731646.9092  0.0066 -3.6364 3  473.0987119  71510 303591544      581445        syn-C2H3C(O)NH2, v=0
  731754.1117  0.0028 -5.2377 3  134.2652 65  71510 303321122      31 625        syn-C2H3C(O)NH2, v=0
  731773.4764  0.0027 -3.3023 3  600.0899131  71510 303652045      641946        syn-C2H3C(O)NH2, v=0
  731950.2057  0.0987 -5.1481 3 1632.1494181  71510 303905337      905238        syn-C2H3C(O)NH2, v=0
  731950.2057  0.0987 -5.1481 3 1632.1494181  71510 303905338      905239        syn-C2H3C(O)NH2, v=0
  731976.0907  0.0022 -5.5191 3  214.6096 71  71510 303351916      351619        syn-C2H3C(O)NH2, v=0
  731976.0979  0.0022 -5.5191 3  214.6096 71  71510 303351917      351620        syn-C2H3C(O)NH2, v=0
  732245.0562  0.0533 -4.4459 3 1338.2456201  71510 303A02080      992179        syn-C2H3C(O)NH2, v=0
  732290.4238  0.0981 -5.1124 3 1610.2290179  71510 303895336      895237        syn-C2H3C(O)NH2, v=0
  732290.4238  0.0981 -5.1124 3 1610.2290179  71510 303895337      895238        syn-C2H3C(O)NH2, v=0
  732297.2977  0.0533 -4.4458 3 1338.2445201  71510 303A02180      992079        syn-C2H3C(O)NH2, v=0
  732608.3552  0.0022 -4.3164 3  207.8290 79  71510 303391326      381029        syn-C2H3C(O)NH2, v=0
  732621.1407  0.0976 -5.0775 3 1588.5556177  71510 303885335      885236        syn-C2H3C(O)NH2, v=0
  732621.1407  0.0976 -5.0775 3 1588.5556177  71510 303885336      885237        syn-C2H3C(O)NH2, v=0
  732694.7381  0.0047 -4.9604 3  508.8757125  71510 303621349      621052        syn-C2H3C(O)NH2, v=0
  732704.9098  0.0410 -4.4397 3 1239.0583191  71510 303952373      942272        syn-C2H3C(O)NH2, v=0
  732719.6013  0.0031 -3.3440 3  616.6996133  71510 303662047      651946        syn-C2H3C(O)NH2, v=0
  732942.5630  0.0971 -5.0434 3 1567.1291175  71510 303875334      875235        syn-C2H3C(O)NH2, v=0
  732942.5630  0.0971 -5.0434 3 1567.1291175  71510 303875335      875236        syn-C2H3C(O)NH2, v=0
  733016.4888  0.0414 -4.4175 3 1215.0628189  71510 303942372      932271        syn-C2H3C(O)NH2, v=0
  733042.2863  0.0030 -3.6415 3  345.7870103  71510 303511339      501040        syn-C2H3C(O)NH2, v=0
  733226.5502  0.1132 -4.8103 3 1381.7391201  71510 303A02476      992575        syn-C2H3C(O)NH2, v=0
  733254.8933  0.0966 -5.0102 3 1545.9493173  71510 303865333      865234        syn-C2H3C(O)NH2, v=0
  733254.8933  0.0966 -5.0102 3 1545.9493173  71510 303865334      865235        syn-C2H3C(O)NH2, v=0
  733280.1499  0.0023 -5.5885 3  205.9819 69  71510 303341915      341618        syn-C2H3C(O)NH2, v=0
  733280.1526  0.0023 -5.5885 3  205.9819 69  71510 303341916      341619        syn-C2H3C(O)NH2, v=0
  733415.4888  0.0075 -4.9337 3  646.4255139  71510 303691753      691456        syn-C2H3C(O)NH2, v=0
  733443.4091  0.0070 -3.5885 3  704.1723143  71510 303712052      701951        syn-C2H3C(O)NH2, v=0
  733558.3310  0.0962 -4.9778 3 1525.0162171  71510 303855332      855233        syn-C2H3C(O)NH2, v=0
  733558.3310  0.0962 -4.9778 3 1525.0162171  71510 303855333      855234        syn-C2H3C(O)NH2, v=0
  733623.1074  0.0518 -4.5215 3 1312.0462197  71510 303982276      972375        syn-C2H3C(O)NH2, v=0
  733722.8799  0.0551 -5.2786 3 1005.7671169  71510 303842559      842262        syn-C2H3C(O)NH2, v=0
  733742.0639  0.0513 -4.4747 3 1325.6436199  71510 303992178      982277        syn-C2H3C(O)NH2, v=0
  733800.7289  0.0038 -4.1356 3  266.3103 89  71510 303441431      431132        syn-C2H3C(O)NH2, v=0
  733811.5663  0.0305 -5.1456 3  892.2608159  71510 303792455      792158        syn-C2H3C(O)NH2, v=0
  733853.0718  0.0959 -4.9463 3 1504.3296169  71510 303845331      845232        syn-C2H3C(O)NH2, v=0
  733853.0718  0.0959 -4.9463 3 1504.3296169  71510 303845332      845233        syn-C2H3C(O)NH2, v=0
  733862.2360  0.0038 -4.8617 3  560.4890125  71510 303622142      621845        syn-C2H3C(O)NH2, v=0
  733930.1532  0.0938 -4.3477 3 1462.8650229  71510 303B4 7A7      B3 8A6        syn-C2H3C(O)NH2, v=0
  733930.1532  0.0938 -4.3477 3 1462.8650229  71510 303B4 8A7      B3 7A6        syn-C2H3C(O)NH2, v=0
  733934.7365  0.0977 -4.3390 3 1466.5268231  71510 303B5 6A9      B4 7A8        syn-C2H3C(O)NH2, v=0
  733934.7365  0.0977 -4.3390 3 1466.5268231  71510 303B5 7A9      B4 6A8        syn-C2H3C(O)NH2, v=0
  733934.8769  0.0902 -4.3561 3 1458.6692227  71510 303B3 8A5      B2 9A4        syn-C2H3C(O)NH2, v=0
  733934.8769  0.0902 -4.3561 3 1458.6692227  71510 303B3 9A5      B2 8A4        syn-C2H3C(O)NH2, v=0
  733945.6179  0.1021 -4.3299 3 1469.6602233  71510 303B6 5B1      B5 6B0        syn-C2H3C(O)NH2, v=0
  733945.6179  0.1021 -4.3299 3 1469.6602233  71510 303B6 6B1      B5 5B0        syn-C2H3C(O)NH2, v=0
  733952.5700  0.0870 -4.3641 3 1453.9332225  71510 303B2 9A3      B110A2        syn-C2H3C(O)NH2, v=0
  733952.5700  0.0870 -4.3641 3 1453.9332225  71510 303B210A3      B1 9A2        syn-C2H3C(O)NH2, v=0
  733960.3031  0.1072 -4.3202 3 1472.2698235  71510 303B7 4B3      B6 5B2        syn-C2H3C(O)NH2, v=0
  733960.3031  0.1072 -4.3202 3 1472.2698235  71510 303B7 5B3      B6 4B2        syn-C2H3C(O)NH2, v=0
  733976.7066  0.1133 -4.3101 3 1474.3599237  71510 303B8 3B5      B7 4B4        syn-C2H3C(O)NH2, v=0
  733976.7066  0.1133 -4.3101 3 1474.3599237  71510 303B8 4B5      B7 3B4        syn-C2H3C(O)NH2, v=0
  733987.7346  0.0839 -4.3719 3 1448.6496223  71510 303B110A1      B011A0        syn-C2H3C(O)NH2, v=0
  733987.7346  0.0839 -4.3719 3 1448.6496223  71510 303B111A1      B010A0        syn-C2H3C(O)NH2, v=0
  733990.2812  0.0049 -5.6686 3  270.0237 97  71510 30348 642      48 345        syn-C2H3C(O)NH2, v=0
  733990.5299  0.0049 -5.6686 3  270.0237 97  71510 30348 742      48 445        syn-C2H3C(O)NH2, v=0
  733993.0712  0.1206 -4.2994 3 1475.9339239  71510 303B9 2B7      B8 3B6        syn-C2H3C(O)NH2, v=0
  733993.0712  0.1206 -4.2994 3 1475.9339239  71510 303B9 3B7      B8 2B6        syn-C2H3C(O)NH2, v=0
  734007.9047  0.1293 -4.2881 3 1476.9951241  71510 303C0 1B9      B9 2B8        syn-C2H3C(O)NH2, v=0
  734007.9047  0.1293 -4.2881 3 1476.9951241  71510 303C0 2B9      B9 1B8        syn-C2H3C(O)NH2, v=0
  734019.9310  0.1398 -4.2762 3 1477.5463243  71510 303C1 0C1      C0 1C0        syn-C2H3C(O)NH2, v=0
  734019.9310  0.1398 -4.2762 3 1477.5463243  71510 303C1 1C1      C0 0C0        syn-C2H3C(O)NH2, v=0
  734045.9660  0.0809 -4.3796 3 1442.8101221  71510 303B01199      A91298        syn-C2H3C(O)NH2, v=0
  734045.9660  0.0809 -4.3796 3 1442.8101221  71510 303B01299      A91198        syn-C2H3C(O)NH2, v=0
  734065.5799  0.0422 -4.4630 3 1263.1913193  71510 303962374      952273        syn-C2H3C(O)NH2, v=0
  734082.8348  0.0019 -3.0804 3  539.2753121  71510 303602239      592138        syn-C2H3C(O)NH2, v=0
  734084.7652  0.0019 -3.0803 3  539.2752121  71510 303602238      592139        syn-C2H3C(O)NH2, v=0
  734124.9243  0.0065 -4.9508 3  604.3352135  71510 303671552      671255        syn-C2H3C(O)NH2, v=0
  734134.3053  0.0780 -4.3872 3 1436.4046219  71510 303A91297      A81396        syn-C2H3C(O)NH2, v=0
  734134.3053  0.0780 -4.3872 3 1436.4046219  71510 303A91397      A81296        syn-C2H3C(O)NH2, v=0
  734139.3082  0.0956 -4.9157 3 1483.8894167  71510 303835330      835231        syn-C2H3C(O)NH2, v=0
  734139.3082  0.0956 -4.9157 3 1483.8894167  71510 303835331      835232        syn-C2H3C(O)NH2, v=0
  734261.7391  0.0751 -4.3949 3 1429.4214217  71510 303A81395      A71494        syn-C2H3C(O)NH2, v=0
  734261.7391  0.0751 -4.3949 3 1429.4214217  71510 303A81495      A71394        syn-C2H3C(O)NH2, v=0
  734365.0840  0.0027 -4.9230 3  408.1109105  71510 303522032      521735        syn-C2H3C(O)NH2, v=0
  734400.4391  0.0509 -4.4739 3 1325.6301199  71510 303992278      982177        syn-C2H3C(O)NH2, v=0
  734417.2293  0.0954 -4.8861 3 1463.6955165  71510 303825329      825230        syn-C2H3C(O)NH2, v=0
  734417.2293  0.0954 -4.8861 3 1463.6955165  71510 303825330      825231        syn-C2H3C(O)NH2, v=0
  734439.9287  0.0723 -4.4029 3 1421.8466215  71510 303A71493      A61592        syn-C2H3C(O)NH2, v=0
  734439.9287  0.0723 -4.4029 3 1421.8466215  71510 303A71593      A61492        syn-C2H3C(O)NH2, v=0
  734470.8742  0.0023 -5.6631 3  197.6086 67  71510 303331914      331617        syn-C2H3C(O)NH2, v=0
  734470.8752  0.0023 -5.6631 3  197.6086 67  71510 303331915      331618        syn-C2H3C(O)NH2, v=0
  734563.4636  0.0027 -4.9228 3  408.1043105  71510 303522033      521736        syn-C2H3C(O)NH2, v=0
  734570.4386  0.0046 -4.9586 3  508.8757125  71510 303621449      621152        syn-C2H3C(O)NH2, v=0
  734630.3840  0.0029 -3.6610 3  327.2874101  71510 303501239      49 940        syn-C2H3C(O)NH2, v=0
  734684.3061  0.0695 -4.4114 3 1413.6632213  71510 303A61591      A51690        syn-C2H3C(O)NH2, v=0
  734684.3061  0.0695 -4.4114 3 1413.6632213  71510 303A61691      A51590        syn-C2H3C(O)NH2, v=0
  734687.0209  0.0952 -4.8574 3 1443.7478163  71510 303815328      815229        syn-C2H3C(O)NH2, v=0
  734687.0209  0.0952 -4.8574 3 1443.7478163  71510 303815329      815230        syn-C2H3C(O)NH2, v=0
  734731.8655  0.0058 -5.4510 3  125.5785 65  71510 30332 924      31 427        syn-C2H3C(O)NH2, v=0
  734899.0401  0.0070 -4.9286 3  668.1655137  71510 303682246      681949        syn-C2H3C(O)NH2, v=0
  734948.8658  0.0950 -4.8297 3 1424.0462161  71510 303805327      805228        syn-C2H3C(O)NH2, v=0
  734948.8658  0.0950 -4.8297 3 1424.0462161  71510 303805328      805229        syn-C2H3C(O)NH2, v=0
  735015.7840  0.0668 -4.4207 3 1404.8508211  71510 303A51689      A41788        syn-C2H3C(O)NH2, v=0
  735015.7842  0.0668 -4.4207 3 1404.8508211  71510 303A51789      A41688        syn-C2H3C(O)NH2, v=0
  735113.5582  0.0054 -5.2044 3  403.8261109  71510 303541638      541143        syn-C2H3C(O)NH2, v=0
  735202.9434  0.0949 -4.8030 3 1404.5906159  71510 303795326      795227        syn-C2H3C(O)NH2, v=0
  735202.9434  0.0949 -4.8030 3 1404.5906159  71510 303795327      795228        syn-C2H3C(O)NH2, v=0
  735301.4993  0.0042 -4.3387 3  202.9783 87  71510 30343 439      42 340        syn-C2H3C(O)NH2, v=0
  735301.5141  0.0042 -4.3387 3  202.9783 87  71510 30343 539      42 240        syn-C2H3C(O)NH2, v=0
  735423.5659  0.0437 -4.3959 3 1191.1944187  71510 303932371      922270        syn-C2H3C(O)NH2, v=0
  735449.4305  0.0948 -4.7774 3 1385.3809157  71510 303785325      785226        syn-C2H3C(O)NH2, v=0
  735449.4305  0.0948 -4.7774 3 1385.3809157  71510 303785326      785227        syn-C2H3C(O)NH2, v=0
  735463.5462  0.0641 -4.4313 3 1395.3837209  71510 303A41787      A31886        syn-C2H3C(O)NH2, v=0
  735463.5512  0.0641 -4.4313 3 1395.3837209  71510 303A41887      A31786        syn-C2H3C(O)NH2, v=0
  735688.5006  0.0947 -4.7529 3 1366.4169155  71510 303775324      775225        syn-C2H3C(O)NH2, v=0
  735688.5006  0.0947 -4.7529 3 1366.4169155  71510 303775325      775226        syn-C2H3C(O)NH2, v=0
  735740.0743  0.0049 -2.6067 3  410.2607 73  71510 3033634 2      3533 3        syn-C2H3C(O)NH2, v=0
  735740.0743  0.0049 -2.6067 3  410.2607 73  71510 3033634 3      3533 2        syn-C2H3C(O)NH2, v=0
  735920.3243  0.0947 -4.7295 3 1347.6987153  71510 303765323      765224        syn-C2H3C(O)NH2, v=0
  735920.3243  0.0947 -4.7295 3 1347.6987153  71510 303765324      765225        syn-C2H3C(O)NH2, v=0
  735946.7668  0.0227 -5.0699 3  894.4097161  71510 303802259      801962        syn-C2H3C(O)NH2, v=0
  735964.6577  0.0035 -3.3854 3  633.5320135  71510 303672048      661947        syn-C2H3C(O)NH2, v=0
  736011.9831  0.1201 -5.3812 3 1072.4160177  71510 303882266      881969        syn-C2H3C(O)NH2, v=0
  736034.4319  0.0018 -3.0103 3  519.7888117  71510 303582336      572235        syn-C2H3C(O)NH2, v=0
  736034.4658  0.0018 -3.0103 3  519.7888117  71510 303582335      572236        syn-C2H3C(O)NH2, v=0
  736037.5645  0.0029 -3.7015 3  308.9035 99  71510 303491039      48 940        syn-C2H3C(O)NH2, v=0
  736069.8338  0.0615 -4.4437 3 1385.2293207  71510 303A31885      A21984        syn-C2H3C(O)NH2, v=0
  736069.9418  0.0615 -4.4437 3 1385.2292207  71510 303A31985      A21884        syn-C2H3C(O)NH2, v=0
  736145.0696  0.0948 -4.7074 3 1329.2260151  71510 303755322      755223        syn-C2H3C(O)NH2, v=0
  736145.0696  0.0948 -4.7074 3 1329.2260151  71510 303755323      755224        syn-C2H3C(O)NH2, v=0
  736177.8110  0.0037 -2.6263 3  412.7035 77  71510 3033833 5      3732 6        syn-C2H3C(O)NH2, v=0
  736177.8110  0.0037 -2.6263 3  412.7035 77  71510 3033833 6      3732 5        syn-C2H3C(O)NH2, v=0
  736205.8286  0.0068 -4.9165 3  703.0488141  71510 303702249      701952        syn-C2H3C(O)NH2, v=0
  736362.9013  0.0948 -4.6866 3 1310.9988149  71510 303745321      745222        syn-C2H3C(O)NH2, v=0
  736362.9013  0.0948 -4.6866 3 1310.9988149  71510 303745322      745223        syn-C2H3C(O)NH2, v=0
  736573.9818  0.0949 -4.6671 3 1293.0170147  71510 303735320      735221        syn-C2H3C(O)NH2, v=0
  736573.9818  0.0949 -4.6671 3 1293.0170147  71510 303735321      735222        syn-C2H3C(O)NH2, v=0
  736602.0199  0.0029 -2.6483 3  416.6145 81  71510 3034032 8      3931 9        syn-C2H3C(O)NH2, v=0
  736602.0199  0.0029 -2.6483 3  416.6145 81  71510 3034032 9      3931 8        syn-C2H3C(O)NH2, v=0
  736696.6093  0.0445 -4.4875 3 1287.4727195  71510 303972375      962274        syn-C2H3C(O)NH2, v=0
  736778.4704  0.0951 -4.6491 3 1275.2805145  71510 303725319      725220        syn-C2H3C(O)NH2, v=0
  736778.4704  0.0951 -4.6491 3 1275.2805145  71510 303725320      725221        syn-C2H3C(O)NH2, v=0
  736846.6319  0.0022 -3.1930 3  576.1560127  71510 303632143      622042        syn-C2H3C(O)NH2, v=0
  736860.3680  0.0044 -3.4615 3  626.1040135  71510 303671948      661849        syn-C2H3C(O)NH2, v=0
  736898.1932  0.0590 -4.4588 3 1374.3446205  71510 303A21983      A12082        syn-C2H3C(O)NH2, v=0
  736900.1845  0.0590 -4.4588 3 1374.3446205  71510 303A22083      A11982        syn-C2H3C(O)NH2, v=0
  736922.4314  0.0038 -4.8734 3  544.8893123  71510 303612140      611843        syn-C2H3C(O)NH2, v=0
  736976.5242  0.0952 -4.6326 3 1257.7892143  71510 303715318      715219        syn-C2H3C(O)NH2, v=0
  736976.5242  0.0952 -4.6326 3 1257.7892143  71510 303715319      715220        syn-C2H3C(O)NH2, v=0
  736983.0202  0.0022 -3.1928 3  576.1522127  71510 303632142      622043        syn-C2H3C(O)NH2, v=0
  737004.2968  0.0024 -2.6731 3  422.0002 85  71510 303423111      413012        syn-C2H3C(O)NH2, v=0
  737004.2968  0.0024 -2.6731 3  422.0002 85  71510 303423112      413011        syn-C2H3C(O)NH2, v=0
  737040.8877  0.0021 -4.9250 3  135.4671 61  71510 303301417      291118        syn-C2H3C(O)NH2, v=0
  737106.8034  0.0021 -4.9249 3  135.4649 61  71510 303301416      291119        syn-C2H3C(O)NH2, v=0
  737139.9225  0.0058 -3.5319 3  685.9921141  71510 303702051      691950        syn-C2H3C(O)NH2, v=0
  737165.3707  0.0018 -2.9494 3  502.0271113  71510 303562433      552332        syn-C2H3C(O)NH2, v=0
  737165.3712  0.0018 -2.9494 3  502.0271113  71510 303562432      552333        syn-C2H3C(O)NH2, v=0
  737168.2972  0.0954 -4.6177 3 1240.5429141  71510 303705317      705218        syn-C2H3C(O)NH2, v=0
  737168.2972  0.0954 -4.6177 3 1240.5429141  71510 303705318      705219        syn-C2H3C(O)NH2, v=0
  737348.7463  0.0148 -4.9799 3  752.3211149  71510 303741956      741659        syn-C2H3C(O)NH2, v=0
  737353.9411  0.0956 -4.6047 3 1223.5417139  71510 303695316      695217        syn-C2H3C(O)NH2, v=0
  737353.9411  0.0956 -4.6047 3 1223.5417139  71510 303695317      695218        syn-C2H3C(O)NH2, v=0
  737372.6299  0.0021 -2.7009 3  428.8688 89  71510 303443014      432915        syn-C2H3C(O)NH2, v=0
  737372.6299  0.0021 -2.7009 3  428.8688 89  71510 303443015      432914        syn-C2H3C(O)NH2, v=0
  737533.6050  0.0958 -4.5937 3 1206.7855137  71510 303685315      685216        syn-C2H3C(O)NH2, v=0
  737533.6050  0.0958 -4.5937 3 1206.7855137  71510 303685316      685217        syn-C2H3C(O)NH2, v=0
  737689.9445  0.0020 -2.7320 3  437.2303 93  71510 303462917      452818        syn-C2H3C(O)NH2, v=0
  737689.9445  0.0020 -2.7320 3  437.2303 93  71510 303462918      452817        syn-C2H3C(O)NH2, v=0
  737707.4353  0.0961 -4.5847 3 1190.2740135  71510 303675314      675215        syn-C2H3C(O)NH2, v=0
  737707.4353  0.0961 -4.5847 3 1190.2740135  71510 303675315      675216        syn-C2H3C(O)NH2, v=0
  737758.4719  0.0374 -4.1455 3 1000.2505171  71510 303852264      842163        syn-C2H3C(O)NH2, v=0
  737773.6068  0.0018 -2.8958 3  485.9201109  71510 303542529      532430        syn-C2H3C(O)NH2, v=0
  737773.6068  0.0018 -2.8958 3  485.9201109  71510 303542530      532429        syn-C2H3C(O)NH2, v=0
  737875.5763  0.0964 -4.5782 3 1174.0073133  71510 303665313      665214        syn-C2H3C(O)NH2, v=0
  737875.5763  0.0964 -4.5782 3 1174.0073133  71510 303665314      665215        syn-C2H3C(O)NH2, v=0
  737919.4984  0.0075 -5.6420 3  308.9018 97  71510 303481335      48 840        syn-C2H3C(O)NH2, v=0
  737922.6597  0.0031 -3.3389 3  616.5613133  71510 303662046      651947        syn-C2H3C(O)NH2, v=0
  737931.9654  0.0019 -2.7666 3  447.0976 97  71510 303482820      472721        syn-C2H3C(O)NH2, v=0
  737931.9654  0.0019 -2.7666 3  447.0976 97  71510 303482821      472720        syn-C2H3C(O)NH2, v=0
  738035.8378  0.0019 -2.8479 3  471.4187105  71510 303522626      512527        syn-C2H3C(O)NH2, v=0
  738035.8378  0.0019 -2.8479 3  471.4187105  71510 303522627      512526        syn-C2H3C(O)NH2, v=0
  738035.8869  0.0041 -3.4303 3  650.6830137  71510 303682049      671948        syn-C2H3C(O)NH2, v=0
  738038.1694  0.0967 -4.5743 3 1157.9853131  71510 303655312      655213        syn-C2H3C(O)NH2, v=0
  738038.1694  0.0967 -4.5743 3 1157.9853131  71510 303655313      655214        syn-C2H3C(O)NH2, v=0
  738040.9382  0.0566 -4.4781 3 1362.6714203  71510 303A12081      A02180        syn-C2H3C(O)NH2, v=0
  738063.9892  0.0019 -2.8050 3  458.4868101  71510 303502723      492624        syn-C2H3C(O)NH2, v=0
  738063.9892  0.0019 -2.8050 3  458.4868101  71510 303502724      492623        syn-C2H3C(O)NH2, v=0
  738072.0971  0.0566 -4.4780 3 1362.6707203  71510 303A12181      A02080        syn-C2H3C(O)NH2, v=0
  738148.3126  0.0041 -5.4812 3  300.3632101  71510 30350 743      50 446        syn-C2H3C(O)NH2, v=0
  738149.4878  0.0041 -5.4812 3  300.3632101  71510 30350 843      50 546        syn-C2H3C(O)NH2, v=0
  738195.3539  0.0970 -4.5734 3 1142.2078129  71510 303645311      645212        syn-C2H3C(O)NH2, v=0
  738195.3539  0.0970 -4.5734 3 1142.2078129  71510 303645312      645213        syn-C2H3C(O)NH2, v=0
  738347.2665  0.0973 -4.5760 3 1126.6749127  71510 303635310      635211        syn-C2H3C(O)NH2, v=0
  738347.2665  0.0973 -4.5760 3 1126.6749127  71510 303635311      635212        syn-C2H3C(O)NH2, v=0
  738444.9344  0.0025 -5.6725 3   95.7942 47  71510 3032315 9      221210        syn-C2H3C(O)NH2, v=0
  738444.9390  0.0025 -5.6725 3   95.7942 47  71510 3032315 8      221211        syn-C2H3C(O)NH2, v=0
  738488.4238  0.0044 -5.0018 3  471.0205121  71510 303601248      60 951        syn-C2H3C(O)NH2, v=0
  738494.0417  0.0977 -4.5827 3 1111.3863125  71510 3036253 9      625210        syn-C2H3C(O)NH2, v=0
  738494.0417  0.0977 -4.5827 3 1111.3863125  71510 303625310      625211        syn-C2H3C(O)NH2, v=0
  738559.4487  0.0048 -3.4790 3  668.1655139  71510 303692050      681949        syn-C2H3C(O)NH2, v=0
  738563.0142  0.0027 -3.6994 3  308.9018 99  71510 303491139      48 840        syn-C2H3C(O)NH2, v=0
  738635.8115  0.0981 -4.5941 3 1096.3421123  71510 3036153 8      6152 9        syn-C2H3C(O)NH2, v=0
  738635.8115  0.0981 -4.5941 3 1096.3421123  71510 3036153 9      615210        syn-C2H3C(O)NH2, v=0
  738694.2013  0.0027 -4.9456 3  395.0644103  71510 303512031      511734        syn-C2H3C(O)NH2, v=0
  738772.7058  0.0985 -4.6114 3 1081.5421121  71510 3036053 7      6052 8        syn-C2H3C(O)NH2, v=0
  738772.7058  0.0985 -4.6114 3 1081.5421121  71510 3036053 8      6052 9        syn-C2H3C(O)NH2, v=0
  738801.9736  0.0027 -4.9455 3  395.0608103  71510 303512032      511735        syn-C2H3C(O)NH2, v=0
  738881.7877  0.0036 -4.1522 3  220.0084 89  71510 30344 539      43 440        syn-C2H3C(O)NH2, v=0
  738881.9617  0.0036 -4.1522 3  220.0084 89  71510 30344 639      43 340        syn-C2H3C(O)NH2, v=0
  738904.8519  0.0989 -4.6359 3 1066.9863119  71510 3035953 6      5952 7        syn-C2H3C(O)NH2, v=0
  738904.8519  0.0989 -4.6359 3 1066.9863119  71510 3035953 7      5952 8        syn-C2H3C(O)NH2, v=0
  739032.3750  0.0993 -4.6698 3 1052.6747117  71510 3035853 5      5852 6        syn-C2H3C(O)NH2, v=0
  739032.3750  0.0993 -4.6698 3 1052.6747117  71510 3035853 6      5852 7        syn-C2H3C(O)NH2, v=0
  739064.6717  0.0046 -5.2293 3  137.7972 67  71510 303331024      32 527        syn-C2H3C(O)NH2, v=0
  739155.3982  0.0998 -4.7163 3 1038.6070115  71510 3035753 4      5752 5        syn-C2H3C(O)NH2, v=0
  739155.3982  0.0998 -4.7163 3 1038.6070115  71510 3035753 5      5752 6        syn-C2H3C(O)NH2, v=0
  739157.1666  0.0043 -5.0011 3  471.0205121  71510 303601348      601051        syn-C2H3C(O)NH2, v=0
  739274.0421  0.1002 -4.7810 3 1024.7833113  71510 3035653 3      5652 4        syn-C2H3C(O)NH2, v=0
  739274.0421  0.1002 -4.7810 3 1024.7833113  71510 3035653 4      5652 5        syn-C2H3C(O)NH2, v=0
  739364.1742  0.0060 -3.5432 3  602.4670133  71510 303661848      651749        syn-C2H3C(O)NH2, v=0
  739388.4251  0.1007 -4.8741 3 1011.2034111  71510 3035553 2      5552 3        syn-C2H3C(O)NH2, v=0
  739388.4251  0.1007 -4.8741 3 1011.2034111  71510 3035553 3      5552 4        syn-C2H3C(O)NH2, v=0
  739498.6636  0.1011 -5.0188 3  997.8674109  71510 3035453 1      5452 2        syn-C2H3C(O)NH2, v=0
  739498.6636  0.1011 -5.0188 3  997.8674109  71510 3035453 2      5452 3        syn-C2H3C(O)NH2, v=0
  739529.0745  0.0544 -4.5044 3 1350.1270201  71510 303A02179      992278        syn-C2H3C(O)NH2, v=0
  739604.8716  0.1016 -5.2888 3  984.7751107  71510 3035353 0      5352 1        syn-C2H3C(O)NH2, v=0
  739604.8716  0.1016 -5.2888 3  984.7751107  71510 3035353 1      5352 2        syn-C2H3C(O)NH2, v=0
  739868.7815  0.0067 -3.5926 3  563.0470129  71510 303641747      631648        syn-C2H3C(O)NH2, v=0
  739928.4899  0.0989 -4.3873 3 1487.3462231  71510 303B5 7A8      B4 8A7        syn-C2H3C(O)NH2, v=0
  739928.4899  0.0989 -4.3873 3 1487.3462231  71510 303B5 8A8      B4 7A7        syn-C2H3C(O)NH2, v=0
  739932.0734  0.0952 -4.3954 3 1483.1506229  71510 303B4 8A6      B3 9A5        syn-C2H3C(O)NH2, v=0
  739932.0734  0.0952 -4.3954 3 1483.1506229  71510 303B4 9A6      B3 8A5        syn-C2H3C(O)NH2, v=0
  739933.8907  0.1030 -4.3787 3 1491.0082233  71510 303B6 6B0      B5 7A9        syn-C2H3C(O)NH2, v=0
  739933.8907  0.1030 -4.3787 3 1491.0082233  71510 303B6 7B0      B5 6A9        syn-C2H3C(O)NH2, v=0
  739935.7236  0.0541 -4.5039 3 1350.1186201  71510 303A02279      992178        syn-C2H3C(O)NH2, v=0
  739945.3444  0.1076 -4.3697 3 1494.1420235  71510 303B7 5B2      B6 6B1        syn-C2H3C(O)NH2, v=0
  739945.3444  0.1076 -4.3697 3 1494.1420235  71510 303B7 6B2      B6 5B1        syn-C2H3C(O)NH2, v=0
  739948.2001  0.0917 -4.4033 3 1478.4152227  71510 303B3 9A4      B210A3        syn-C2H3C(O)NH2, v=0
  739948.2001  0.0917 -4.4033 3 1478.4152227  71510 303B310A4      B2 9A3        syn-C2H3C(O)NH2, v=0
  739960.4157  0.1130 -4.3602 3 1496.7521237  71510 303B8 4B4      B7 5B3        syn-C2H3C(O)NH2, v=0
  739960.4157  0.1130 -4.3602 3 1496.7521237  71510 303B8 5B4      B7 4B3        syn-C2H3C(O)NH2, v=0
  739977.0636  0.1193 -4.3502 3 1498.8427239  71510 303B9 3B6      B8 4B5        syn-C2H3C(O)NH2, v=0
  739977.0636  0.1193 -4.3502 3 1498.8427239  71510 303B9 4B6      B8 3B5        syn-C2H3C(O)NH2, v=0
  739981.2336  0.0885 -4.4108 3 1473.1328225  71510 303B210A2      B111A1        syn-C2H3C(O)NH2, v=0
  739981.2336  0.0885 -4.4108 3 1473.1328225  71510 303B211A2      B110A1        syn-C2H3C(O)NH2, v=0
  739993.5651  0.1269 -4.3397 3 1500.4173241  71510 303C0 2B8      B9 3B7        syn-C2H3C(O)NH2, v=0
  739993.5651  0.1269 -4.3397 3 1500.4173241  71510 303C0 3B8      B9 2B7        syn-C2H3C(O)NH2, v=0
  740008.4540  0.1360 -4.3285 3 1501.4790243  71510 303C1 1C0      C0 2B9        syn-C2H3C(O)NH2, v=0
  740008.4540  0.1360 -4.3285 3 1501.4790243  71510 303C1 2C0      C0 1B9        syn-C2H3C(O)NH2, v=0
  740020.4736  0.1469 -4.3167 3 1502.0306245  71510 303C2 0C2      C1 1C1        syn-C2H3C(O)NH2, v=0
  740020.4736  0.1469 -4.3167 3 1502.0306245  71510 303C2 1C2      C1 0C1        syn-C2H3C(O)NH2, v=0
  740036.5814  0.0854 -4.4182 3 1467.2952223  71510 303B111A0      B01299        syn-C2H3C(O)NH2, v=0
  740036.5814  0.0854 -4.4182 3 1467.2952223  71510 303B112A0      B01199        syn-C2H3C(O)NH2, v=0
  740121.0267  0.0823 -4.4256 3 1460.8927221  71510 303B01298      A91397        syn-C2H3C(O)NH2, v=0
  740121.0267  0.0823 -4.4256 3 1460.8927221  71510 303B01398      A91297        syn-C2H3C(O)NH2, v=0
  740188.6768  0.0023 -4.2853 3  217.6307 81  71510 303401327      391030        syn-C2H3C(O)NH2, v=0
  740196.6489  0.0539 -4.5455 3 1336.6044199  71510 303992277      982376        syn-C2H3C(O)NH2, v=0
  740243.1963  0.0794 -4.4330 3 1453.9137219  71510 303A91396      A81495        syn-C2H3C(O)NH2, v=0
  740243.1963  0.0794 -4.4330 3 1453.9137219  71510 303A91496      A81395        syn-C2H3C(O)NH2, v=0
  740258.6705  0.0475 -4.5133 3 1311.9120197  71510 303982376      972275        syn-C2H3C(O)NH2, v=0
  740289.8073  0.0473 -4.3743 3 1167.4457185  71510 303922370      912269        syn-C2H3C(O)NH2, v=0
  740303.6640  0.0671 -4.6442 3 1346.8618199  71510 303992376      982475        syn-C2H3C(O)NH2, v=0
  740414.2386  0.0764 -4.4406 3 1446.3448217  71510 303A81494      A71593        syn-C2H3C(O)NH2, v=0
  740414.2386  0.0764 -4.4406 3 1446.3448217  71510 303A81594      A71493        syn-C2H3C(O)NH2, v=0
  740534.1214  0.0036 -4.8699 3  544.7686123  71510 303612141      611844        syn-C2H3C(O)NH2, v=0
  740622.8626  0.0020 -3.1063 3  554.2397123  71510 303612240      602139        syn-C2H3C(O)NH2, v=0
  740626.6874  0.0020 -3.1063 3  554.2396123  71510 303612239      602140        syn-C2H3C(O)NH2, v=0
  740648.8375  0.0735 -4.4487 3 1438.1697215  71510 303A71592      A61691        syn-C2H3C(O)NH2, v=0
  740648.8375  0.0735 -4.4487 3 1438.1697215  71510 303A71692      A61591        syn-C2H3C(O)NH2, v=0
  740870.0370  0.0027 -3.6620 3  364.2943105  71510 303521439      511140        syn-C2H3C(O)NH2, v=0
  740966.7787  0.0707 -4.4575 3 1429.3683213  71510 303A61690      A51789        syn-C2H3C(O)NH2, v=0
  740966.7788  0.0707 -4.4575 3 1429.3683213  71510 303A61790      A51689        syn-C2H3C(O)NH2, v=0
  741134.6353  0.0037 -5.3354 3  331.9791105  71510 30352 844      52 547        syn-C2H3C(O)NH2, v=0
  741139.6175  0.0037 -5.3354 3  331.9791105  71510 30352 944      52 647        syn-C2H3C(O)NH2, v=0
  741171.6914  0.0026 -3.7524 3  290.6834 97  71510 30348 939      47 840        syn-C2H3C(O)NH2, v=0
  741395.4828  0.0679 -4.4675 3 1419.9161211  71510 303A51788      A41887        syn-C2H3C(O)NH2, v=0
  741395.4856  0.0679 -4.4675 3 1419.9161211  71510 303A51888      A41787        syn-C2H3C(O)NH2, v=0
  741509.1785  0.1216 -5.6759 3 1938.7560205  71510 303A25448      A25349        syn-C2H3C(O)NH2, v=0
  741509.1785  0.1216 -5.6759 3 1938.7560205  71510 303A25449      A25350        syn-C2H3C(O)NH2, v=0
  741509.9658  0.0031 -4.0128 3  237.3087 91  71510 30345 639      44 540        syn-C2H3C(O)NH2, v=0
  741511.6327  0.0031 -4.0128 3  237.3087 91  71510 30345 739      44 440        syn-C2H3C(O)NH2, v=0
  741518.9469  0.0039 -4.2071 3  254.9887 87  71510 303431430      421131        syn-C2H3C(O)NH2, v=0
  741689.8442  0.0026 -3.7519 3  290.6832 97  71510 303481039      47 740        syn-C2H3C(O)NH2, v=0
  741782.1576  0.0041 -5.0573 3  434.3929117  71510 303581147      58 850        syn-C2H3C(O)NH2, v=0
  741874.4708  0.0057 -4.9439 3  604.3358135  71510 303671652      671355        syn-C2H3C(O)NH2, v=0
  741961.4355  0.1202 -5.6316 3 1913.8777203  71510 303A15447      A15348        syn-C2H3C(O)NH2, v=0
  741961.4355  0.1202 -5.6316 3 1913.8777203  71510 303A15448      A15349        syn-C2H3C(O)NH2, v=0
  741974.3055  0.0651 -4.4791 3 1409.7819209  71510 303A41886      A31985        syn-C2H3C(O)NH2, v=0
  741974.3663  0.0651 -4.4791 3 1409.7819209  71510 303A41986      A31885        syn-C2H3C(O)NH2, v=0
  742003.4077  0.0041 -5.0571 3  434.3929117  71510 303581247      58 950        syn-C2H3C(O)NH2, v=0
  742203.5332  0.0021 -4.8566 3  142.9413 63  71510 303311418      301119        syn-C2H3C(O)NH2, v=0
  742339.0785  0.0021 -4.8565 3  142.9368 63  71510 303311417      301120        syn-C2H3C(O)NH2, v=0
  742402.0686  0.1188 -5.5881 3 1889.2475201  71510 303A05446      A05347        syn-C2H3C(O)NH2, v=0
  742402.0686  0.1188 -5.5881 3 1889.2475201  71510 303A05447      A05348        syn-C2H3C(O)NH2, v=0
  742551.5182  0.0062 -2.5995 3  417.5433 71  71510 3033535 0      3434 1        syn-C2H3C(O)NH2, v=0
  742551.5182  0.0062 -2.5995 3  417.5433 71  71510 3033535 1      3434 0        syn-C2H3C(O)NH2, v=0
  742605.2514  0.0146 -5.0604 3  882.5109159  71510 303792357      792060        syn-C2H3C(O)NH2, v=0
  742667.9775  0.0165 -5.0797 3  902.8123161  71510 303802358      802061        syn-C2H3C(O)NH2, v=0
  742674.9952  0.0026 -4.9701 3  382.2895101  71510 303502030      501733        syn-C2H3C(O)NH2, v=0
  742693.2397  0.0097 -4.9824 3  663.3569141  71510 303701654      701357        syn-C2H3C(O)NH2, v=0
  742732.4147  0.0026 -4.9701 3  382.2876101  71510 303502031      501734        syn-C2H3C(O)NH2, v=0
  742762.0237  0.0625 -4.4932 3 1398.9249207  71510 303A31984      A22083        syn-C2H3C(O)NH2, v=0
  742763.1721  0.0625 -4.4932 3 1398.9249207  71510 303A32084      A21983        syn-C2H3C(O)NH2, v=0
  742805.6044  0.0018 -3.0338 3  534.1848119  71510 303592337      582236        syn-C2H3C(O)NH2, v=0
  742805.6771  0.0018 -3.0338 3  534.1848119  71510 303592336      582237        syn-C2H3C(O)NH2, v=0
  742831.3173  0.1176 -5.5452 3 1864.8653199  71510 303995445      995346        syn-C2H3C(O)NH2, v=0
  742831.3173  0.1176 -5.5452 3 1864.8653199  71510 303995446      995347        syn-C2H3C(O)NH2, v=0
  742837.7102  0.0025 -3.2236 3  591.9926129  71510 303642144      632043        syn-C2H3C(O)NH2, v=0
  742841.5875  0.0037 -5.2204 3  364.8623109  71510 30354 945      54 648        syn-C2H3C(O)NH2, v=0
  742860.7832  0.0037 -5.2203 3  364.8624109  71510 303541045      54 748        syn-C2H3C(O)NH2, v=0
  742995.1803  0.0047 -2.6174 3  419.0153 75  71510 3033734 3      3633 4        syn-C2H3C(O)NH2, v=0
  742995.1803  0.0047 -2.6174 3  419.0153 75  71510 3033734 4      3633 3        syn-C2H3C(O)NH2, v=0
  743000.0670  0.0028 -3.9047 3  254.8656 93  71510 30346 739      45 640        syn-C2H3C(O)NH2, v=0
  743013.3919  0.0028 -3.9046 3  254.8656 93  71510 30346 839      45 540        syn-C2H3C(O)NH2, v=0
  743066.3376  0.0026 -3.8194 3  272.6634 95  71510 30347 839      46 740        syn-C2H3C(O)NH2, v=0
  743083.2662  0.0025 -3.2233 3  591.9859129  71510 303642143      632044        syn-C2H3C(O)NH2, v=0
  743125.8367  0.0038 -5.1292 3  399.0035113  71510 303561046      56 749        syn-C2H3C(O)NH2, v=0
  743156.4274  0.0026 -3.8193 3  272.6634 95  71510 30347 939      46 640        syn-C2H3C(O)NH2, v=0
  743193.6689  0.0038 -5.1291 3  399.0035113  71510 303561146      56 849        syn-C2H3C(O)NH2, v=0
  743249.4170  0.1164 -5.5030 3 1840.7310197  71510 303985444      985345        syn-C2H3C(O)NH2, v=0
  743249.4170  0.1164 -5.5030 3 1840.7310197  71510 303985445      985346        syn-C2H3C(O)NH2, v=0
  743293.5755  0.0062 -4.9153 3  685.2110139  71510 303692248      691951        syn-C2H3C(O)NH2, v=0
  743310.6229  0.0187 -3.8802 3  845.4827157  71510 303782158      772057        syn-C2H3C(O)NH2, v=0
  743429.5062  0.0037 -2.6376 3  421.9517 79  71510 3033933 6      3832 7        syn-C2H3C(O)NH2, v=0
  743429.5062  0.0037 -2.6376 3  421.9517 79  71510 3033933 7      3832 6        syn-C2H3C(O)NH2, v=0
  743656.5983  0.1153 -5.4616 3 1816.8444195  71510 303975443      975344        syn-C2H3C(O)NH2, v=0
  743656.5983  0.1153 -5.4616 3 1816.8444195  71510 303975444      975345        syn-C2H3C(O)NH2, v=0
  743846.1423  0.0600 -4.5111 3 1387.2901205  71510 303A22082      A12181        syn-C2H3C(O)NH2, v=0
  743848.0815  0.0029 -2.6604 3  426.3581 83  71510 3034132 9      403110        syn-C2H3C(O)NH2, v=0
  743848.0815  0.0029 -2.6604 3  426.3581 83  71510 303413210      4031 9        syn-C2H3C(O)NH2, v=0
  743864.6270  0.0600 -4.5111 3 1387.2898205  71510 303A22182      A12081        syn-C2H3C(O)NH2, v=0
  743901.3022  0.0030 -5.1728 3  142.1279 67  71510 303331123      32 626        syn-C2H3C(O)NH2, v=0
  743948.2421  0.0058 -5.0565 3  178.1628 85  71510 30342 240      41 141        syn-C2H3C(O)NH2, v=0
  743948.2421  0.0058 -5.0565 3  178.1628 85  71510 30342 340      41 041        syn-C2H3C(O)NH2, v=0
  744053.0878  0.1143 -5.4208 3 1793.2054193  71510 303965442      965343        syn-C2H3C(O)NH2, v=0
  744053.0878  0.1143 -5.4208 3 1793.2054193  71510 303965443      965344        syn-C2H3C(O)NH2, v=0
  744059.6924  0.0062 -3.6632 3  437.9034115  71510 303571443      561344        syn-C2H3C(O)NH2, v=0
  744086.0668  0.0018 -2.9710 3  515.8735115  71510 303572434      562333        syn-C2H3C(O)NH2, v=0
  744086.0677  0.0018 -2.9710 3  515.8735115  71510 303572433      562334        syn-C2H3C(O)NH2, v=0
  744114.6710  0.0875 -5.2982 3  997.7358171  71510 303852164      851867        syn-C2H3C(O)NH2, v=0
  744241.7017  0.0024 -2.6861 3  432.2415 87  71510 303433112      423013        syn-C2H3C(O)NH2, v=0
  744241.7017  0.0024 -2.6861 3  432.2415 87  71510 303433113      423012        syn-C2H3C(O)NH2, v=0
  744360.9380  0.0035 -3.3776 3  633.3110135  71510 303672047      661948        syn-C2H3C(O)NH2, v=0
  744439.1077  0.1134 -5.3808 3 1769.8140191  71510 303955441      955342        syn-C2H3C(O)NH2, v=0
  744439.1077  0.1134 -5.3808 3 1769.8140191  71510 303955442      955343        syn-C2H3C(O)NH2, v=0
  744478.8648  0.0133 -5.0445 3  862.4277157  71510 303782356      782059        syn-C2H3C(O)NH2, v=0
  744485.9536  0.0508 -4.5402 3 1336.5173199  71510 303992377      982276        syn-C2H3C(O)NH2, v=0
  744597.2855  0.0021 -2.7148 3  439.6104 91  71510 303453015      442916        syn-C2H3C(O)NH2, v=0
  744597.2855  0.0021 -2.7148 3  439.6104 91  71510 303453016      442915        syn-C2H3C(O)NH2, v=0
  744715.4044  0.0036 -4.8816 3  529.3987121  71510 303602139      601842        syn-C2H3C(O)NH2, v=0
  744722.3058  0.0045 -5.6411 3  301.7179 93  71510 303461630      461135        syn-C2H3C(O)NH2, v=0
  744796.1132  0.0018 -2.9157 3  499.2302111  71510 303552530      542431        syn-C2H3C(O)NH2, v=0
  744796.1132  0.0018 -2.9157 3  499.2302111  71510 303552531      542430        syn-C2H3C(O)NH2, v=0
  744814.8763  0.1125 -5.3416 3 1746.6698189  71510 303945440      945341        syn-C2H3C(O)NH2, v=0
  744814.8763  0.1125 -5.3416 3 1746.6698189  71510 303945441      945342        syn-C2H3C(O)NH2, v=0
  744877.1171  0.0191 -5.1027 3  923.3246163  71510 303812359      812062        syn-C2H3C(O)NH2, v=0
  744896.3104  0.0020 -2.7469 3  448.4755 95  71510 303472918      462819        syn-C2H3C(O)NH2, v=0
  744896.3104  0.0020 -2.7469 3  448.4755 95  71510 303472919      462818        syn-C2H3C(O)NH2, v=0
  745064.6776  0.0037 -4.3450 3  222.8669 83  71510 303411229      40 932        syn-C2H3C(O)NH2, v=0
  745100.6593  0.0024 -5.5600 3  101.4441 49  71510 303241510      231211        syn-C2H3C(O)NH2, v=0
  745100.6738  0.0024 -5.5600 3  101.4441 49  71510 3032415 9      231212        syn-C2H3C(O)NH2, v=0
  745112.5066  0.0019 -2.7825 3  458.8504 99  71510 303492821      482722        syn-C2H3C(O)NH2, v=0
  745112.5066  0.0019 -2.7825 3  458.8504 99  71510 303492822      482721        syn-C2H3C(O)NH2, v=0
  745129.5942  0.0019 -2.8664 3  484.2024107  71510 303532627      522528        syn-C2H3C(O)NH2, v=0
  745129.5942  0.0019 -2.8664 3  484.2024107  71510 303532628      522527        syn-C2H3C(O)NH2, v=0
  745180.6080  0.1117 -5.3031 3 1723.7730187  71510 303935439      935340        syn-C2H3C(O)NH2, v=0
  745180.6080  0.1117 -5.3031 3 1723.7730187  71510 303935440      935341        syn-C2H3C(O)NH2, v=0
  745208.3577  0.0019 -2.8222 3  470.7521103  71510 303512724      502625        syn-C2H3C(O)NH2, v=0
  745208.3577  0.0019 -2.8222 3  470.7521103  71510 303512725      502624        syn-C2H3C(O)NH2, v=0
  745296.0023  0.0577 -4.5353 3 1374.8002203  71510 303A12180      A02279        syn-C2H3C(O)NH2, v=0
  745396.0414  0.0067 -5.3340 3  383.9162107  71510 303531538      531043        syn-C2H3C(O)NH2, v=0
  745536.5133  0.1109 -5.2653 3 1701.1232185  71510 303925438      925339        syn-C2H3C(O)NH2, v=0
  745536.5133  0.1109 -5.2653 3 1701.1232185  71510 303925439      925340        syn-C2H3C(O)NH2, v=0
  745545.4475  0.0575 -4.5350 3 1374.7951203  71510 303A12280      A02179        syn-C2H3C(O)NH2, v=0
  745642.9615  0.0111 -4.9720 3  707.2542145  71510 303721855      721558        syn-C2H3C(O)NH2, v=0
  745715.6168  0.1658 -5.0037 3 1468.6188207  71510 303A32578      A22677        syn-C2H3C(O)NH2, v=0
  745757.6317  0.0249 -5.0656 3  865.5592159  71510 303792159      791862        syn-C2H3C(O)NH2, v=0
  745882.7990  0.1103 -5.2283 3 1678.7205183  71510 303915437      915338        syn-C2H3C(O)NH2, v=0
  745882.7990  0.1103 -5.2283 3 1678.7205183  71510 303915438      915339        syn-C2H3C(O)NH2, v=0
  745925.8667  0.1042 -4.4273 3 1512.0276233  71510 303B6 7A9      B5 8A8        syn-C2H3C(O)NH2, v=0
  745925.8667  0.1042 -4.4273 3 1512.0276233  71510 303B6 8A9      B5 7A8        syn-C2H3C(O)NH2, v=0
  745928.3384  0.1003 -4.4353 3 1507.8321231  71510 303B5 8A7      B4 9A6        syn-C2H3C(O)NH2, v=0
  745928.3384  0.1003 -4.4353 3 1507.8321231  71510 303B5 9A7      B4 8A6        syn-C2H3C(O)NH2, v=0
  745932.0663  0.1085 -4.4190 3 1515.6898235  71510 303B7 6B1      B6 7B0        syn-C2H3C(O)NH2, v=0
  745932.0663  0.1085 -4.4190 3 1515.6898235  71510 303B7 7B1      B6 6B0        syn-C2H3C(O)NH2, v=0
  745942.9417  0.0967 -4.4429 3 1503.0972229  71510 303B4 9A5      B310A4        syn-C2H3C(O)NH2, v=0
  745942.9417  0.0967 -4.4429 3 1503.0972229  71510 303B410A5      B3 9A4        syn-C2H3C(O)NH2, v=0
  745944.0808  0.1134 -4.4101 3 1518.8239237  71510 303B8 5B3      B7 6B2        syn-C2H3C(O)NH2, v=0
  745944.0808  0.1134 -4.4101 3 1518.8239237  71510 303B8 6B3      B7 5B2        syn-C2H3C(O)NH2, v=0
  745959.5311  0.1190 -4.4008 3 1521.4345239  71510 303B9 4B5      B8 5B4        syn-C2H3C(O)NH2, v=0
  745959.5311  0.1190 -4.4008 3 1521.4345239  71510 303B9 5B5      B8 4B4        syn-C2H3C(O)NH2, v=0
  745973.9077  0.0933 -4.4503 3 1497.8159227  71510 303B310A3      B211A2        syn-C2H3C(O)NH2, v=0
  745973.9077  0.0933 -4.4503 3 1497.8159227  71510 303B311A3      B210A2        syn-C2H3C(O)NH2, v=0
  745976.4196  0.1256 -4.3909 3 1523.5257241  71510 303C0 3B7      B9 4B6        syn-C2H3C(O)NH2, v=0
  745976.4196  0.1256 -4.3909 3 1523.5257241  71510 303C0 4B7      B9 3B6        syn-C2H3C(O)NH2, v=0
  745993.0560  0.1335 -4.3804 3 1525.1008243  71510 303C1 2B9      C0 3B8        syn-C2H3C(O)NH2, v=0
  745993.0560  0.1335 -4.3804 3 1525.1008243  71510 303C1 3B9      C0 2B8        syn-C2H3C(O)NH2, v=0
  746007.9992  0.1430 -4.3694 3 1526.1630245  71510 303C2 1C1      C1 2C0        syn-C2H3C(O)NH2, v=0
  746007.9992  0.1430 -4.3694 3 1526.1630245  71510 303C2 2C1      C1 1C0        syn-C2H3C(O)NH2, v=0
  746020.0118  0.1543 -4.3577 3 1526.7150247  71510 303C3 0C3      C2 1C2        syn-C2H3C(O)NH2, v=0
  746020.0118  0.1543 -4.3577 3 1526.7150247  71510 303C3 1C3      C2 0C2        syn-C2H3C(O)NH2, v=0
  746026.4656  0.0901 -4.4574 3 1491.9802225  71510 303B211A1      B112A0        syn-C2H3C(O)NH2, v=0
  746026.4656  0.0901 -4.4574 3 1491.9802225  71510 303B212A1      B111A0        syn-C2H3C(O)NH2, v=0
  746107.1542  0.0869 -4.4645 3 1485.5804223  71510 303B11299      B01398        syn-C2H3C(O)NH2, v=0
  746107.1542  0.0869 -4.4645 3 1485.5804223  71510 303B11399      B01298        syn-C2H3C(O)NH2, v=0
  746183.0398  0.0051 -4.9660 3  563.4403131  71510 303651451      651154        syn-C2H3C(O)NH2, v=0
  746219.6683  0.1096 -5.1922 3 1656.5647181  71510 303905436      905337        syn-C2H3C(O)NH2, v=0
  746219.6683  0.1096 -5.1922 3 1656.5647181  71510 303905437      905338        syn-C2H3C(O)NH2, v=0
  746224.2606  0.0838 -4.4716 3 1478.6056221  71510 303B01397      A91496        syn-C2H3C(O)NH2, v=0
  746224.2606  0.0838 -4.4716 3 1478.6056221  71510 303B01497      A91396        syn-C2H3C(O)NH2, v=0
  746345.0142  0.0025 -4.9966 3  369.7841 99  71510 303492029      491732        syn-C2H3C(O)NH2, v=0
  746375.0096  0.0025 -4.9965 3  369.7831 99  71510 303492030      491733        syn-C2H3C(O)NH2, v=0
  746388.4524  0.0807 -4.4789 3 1471.0424219  71510 303A91495      A81594        syn-C2H3C(O)NH2, v=0
  746388.4524  0.0807 -4.4789 3 1471.0424219  71510 303A91595      A81494        syn-C2H3C(O)NH2, v=0
  746435.0403  0.0564 -4.5718 3 1361.3506201  71510 303A02278      992377        syn-C2H3C(O)NH2, v=0
  746547.3207  0.1091 -5.1568 3 1634.6556179  71510 303895435      895336        syn-C2H3C(O)NH2, v=0
  746547.3207  0.1091 -5.1568 3 1634.6556179  71510 303895436      895337        syn-C2H3C(O)NH2, v=0
  746613.7153  0.0777 -4.4865 3 1462.8750217  71510 303A81593      A71692        syn-C2H3C(O)NH2, v=0
  746613.7153  0.0777 -4.4865 3 1462.8750217  71510 303A81693      A71592        syn-C2H3C(O)NH2, v=0
  746865.9525  0.1086 -5.1222 3 1612.9932177  71510 303885434      885335        syn-C2H3C(O)NH2, v=0
  746865.9525  0.1086 -5.1222 3 1612.9932177  71510 303885435      885336        syn-C2H3C(O)NH2, v=0
  746907.2144  0.0035 -4.8795 3  529.3255121  71510 303602140      601843        syn-C2H3C(O)NH2, v=0
  746918.7921  0.0747 -4.4949 3 1454.0843215  71510 303A71691      A61790        syn-C2H3C(O)NH2, v=0
  746918.7922  0.0747 -4.4949 3 1454.0843215  71510 303A71791      A61690        syn-C2H3C(O)NH2, v=0
  747052.9635  0.0021 -4.7917 3  150.6817 65  71510 303321419      311120        syn-C2H3C(O)NH2, v=0
  747098.3989  0.0021 -3.1332 3  569.4704125  71510 303622241      612140        syn-C2H3C(O)NH2, v=0
  747105.8565  0.0021 -3.1332 3  569.4702125  71510 303622240      612141        syn-C2H3C(O)NH2, v=0
  747175.7565  0.1081 -5.0885 3 1591.5774175  71510 303875433      875334        syn-C2H3C(O)NH2, v=0
  747175.7565  0.1081 -5.0885 3 1591.5774175  71510 303875434      875335        syn-C2H3C(O)NH2, v=0
  747221.1043  0.0034 -3.6773 3  339.3697103  71510 303511140      501041        syn-C2H3C(O)NH2, v=0
  747310.8683  0.0271 -5.1056 3  914.6950163  71510 303812260      811963        syn-C2H3C(O)NH2, v=0
  747322.5479  0.0021 -4.7915 3  150.6727 65  71510 303321418      311121        syn-C2H3C(O)NH2, v=0
  747329.4856  0.0718 -4.5043 3 1444.6464213  71510 303A61789      A51888        syn-C2H3C(O)NH2, v=0
  747329.4871  0.0718 -4.5043 3 1444.6464213  71510 303A61889      A51788        syn-C2H3C(O)NH2, v=0
  747476.9221  0.1077 -5.0556 3 1570.4081173  71510 303865432      865333        syn-C2H3C(O)NH2, v=0
  747476.9221  0.1077 -5.0556 3 1570.4081173  71510 303865433      865334        syn-C2H3C(O)NH2, v=0
  747662.0911  0.0128 -5.0197 3  766.4305147  71510 303732350      732053        syn-C2H3C(O)NH2, v=0
  747702.6101  0.0059 -4.9259 3  650.6830135  71510 303672245      671948        syn-C2H3C(O)NH2, v=0
  747769.6357  0.1074 -5.0237 3 1549.4851171  71510 303855431      855332        syn-C2H3C(O)NH2, v=0
  747769.6357  0.1074 -5.0237 3 1549.4851171  71510 303855432      855333        syn-C2H3C(O)NH2, v=0
  747808.1879  0.0511 -4.3515 3 1143.8164183  71510 303912369      902268        syn-C2H3C(O)NH2, v=0
  747882.5297  0.0690 -4.5152 3 1434.5315211  71510 303A51887      A41986        syn-C2H3C(O)NH2, v=0
  747882.5638  0.0690 -4.5152 3 1434.5315211  71510 303A51987      A41886        syn-C2H3C(O)NH2, v=0
  748033.5436  0.0123 -5.0316 3  842.5706155  71510 303772355      772058        syn-C2H3C(O)NH2, v=0
  748041.2676  0.1016 -4.8092 3 1407.1657203  71510 303A12477      A02576        syn-C2H3C(O)NH2, v=0
  748054.0804  0.1071 -4.9926 3 1528.8083169  71510 303845430      845331        syn-C2H3C(O)NH2, v=0
  748054.0804  0.1071 -4.9926 3 1528.8083169  71510 303845431      845332        syn-C2H3C(O)NH2, v=0
  748330.4364  0.1068 -4.9624 3 1508.3776167  71510 303835429      835330        syn-C2H3C(O)NH2, v=0
  748330.4364  0.1068 -4.9624 3 1508.3776167  71510 303835430      835331        syn-C2H3C(O)NH2, v=0
  748598.8806  0.1066 -4.9332 3 1488.1930165  71510 303825428      825329        syn-C2H3C(O)NH2, v=0
  748598.8806  0.1066 -4.9332 3 1488.1930165  71510 303825429      825330        syn-C2H3C(O)NH2, v=0
  748632.3385  0.0662 -4.5283 3 1423.7008209  71510 303A41985      A32084        syn-C2H3C(O)NH2, v=0
  748632.9980  0.0662 -4.5283 3 1423.7008209  71510 303A42085      A31984        syn-C2H3C(O)NH2, v=0
  748666.3327  0.0027 -3.2556 3  608.1061131  71510 303652145      642044        syn-C2H3C(O)NH2, v=0
  748808.4843  0.0159 -5.0263 3  725.0055147  71510 303731756      731459        syn-C2H3C(O)NH2, v=0
  748825.5365  0.0038 -4.2695 3  243.9519 85  71510 303421429      411130        syn-C2H3C(O)NH2, v=0
  748859.5873  0.1065 -4.9051 3 1468.2543163  71510 303815427      815328        syn-C2H3C(O)NH2, v=0
  748859.5873  0.1065 -4.9051 3 1468.2543163  71510 303815428      815329        syn-C2H3C(O)NH2, v=0
  749091.1436  0.0050 -4.6136 3  195.0214 87  71510 30343 340      42 241        syn-C2H3C(O)NH2, v=0
  749091.1441  0.0050 -4.6136 3  195.0214 87  71510 30343 440      42 141        syn-C2H3C(O)NH2, v=0
  749101.4403  0.0027 -3.2551 3  608.0941131  71510 303652144      642045        syn-C2H3C(O)NH2, v=0
  749112.7276  0.1063 -4.8779 3 1448.5615161  71510 303805426      805327        syn-C2H3C(O)NH2, v=0
  749112.7276  0.1063 -4.8779 3 1448.5615161  71510 303805427      805328        syn-C2H3C(O)NH2, v=0
  749180.4336  0.0543 -4.5684 3 1361.2947201  71510 303A02378      992277        syn-C2H3C(O)NH2, v=0
  749193.7131  0.0655 -4.6605 3 1371.8681201  71510 303A02377      992476        syn-C2H3C(O)NH2, v=0
  749260.3533  0.0071 -3.6454 3  524.8601125  71510 303621646      611547        syn-C2H3C(O)NH2, v=0
  749308.8228  0.0049 -4.9630 3  563.4404131  71510 303651551      651254        syn-C2H3C(O)NH2, v=0
  749338.6466  0.0056 -3.5147 3  643.1703137  71510 303681949      671850        syn-C2H3C(O)NH2, v=0
  749358.4700  0.1063 -4.8518 3 1429.1143159  71510 303795425      795326        syn-C2H3C(O)NH2, v=0
  749358.4700  0.1063 -4.8518 3 1429.1143159  71510 303795426      795327        syn-C2H3C(O)NH2, v=0
  749376.0642  0.0025 -4.2634 3  227.6586 83  71510 303411328      401031        syn-C2H3C(O)NH2, v=0
  749384.3615  0.0228 -5.1297 3  944.0419165  71510 303822360      822063        syn-C2H3C(O)NH2, v=0
  749534.6902  0.0019 -3.0581 3  548.8421121  71510 303602338      592237        syn-C2H3C(O)NH2, v=0
  749534.8436  0.0019 -3.0581 3  548.8421121  71510 303602337      592238        syn-C2H3C(O)NH2, v=0
  749596.9800  0.1062 -4.8268 3 1409.9128157  71510 303785424      785325        syn-C2H3C(O)NH2, v=0
  749596.9800  0.1062 -4.8268 3 1409.9128157  71510 303785425      785326        syn-C2H3C(O)NH2, v=0
  749660.8400  0.0636 -4.5450 3 1412.1024207  71510 303A32083      A22182        syn-C2H3C(O)NH2, v=0
  749671.7496  0.0636 -4.5450 3 1412.1022207  71510 303A32183      A22082        syn-C2H3C(O)NH2, v=0
  749684.2507  0.0060 -5.2349 3  417.3678111  71510 303551639      551144        syn-C2H3C(O)NH2, v=0
  749734.4132  0.0025 -5.0250 3  357.5466 97  71510 303482028      481731        syn-C2H3C(O)NH2, v=0
  749749.7720  0.0025 -5.0250 3  357.5461 97  71510 303482029      481732        syn-C2H3C(O)NH2, v=0
  749759.5573  0.0610 -5.2193 3  925.6469165  71510 303822062      821765        syn-C2H3C(O)NH2, v=0
  749807.1412  0.0060 -2.6100 3  426.0505 73  71510 3033635 1      3534 2        syn-C2H3C(O)NH2, v=0
  749807.1412  0.0060 -2.6100 3  426.0505 73  71510 3033635 2      3534 1        syn-C2H3C(O)NH2, v=0
  749828.4207  0.1062 -4.8030 3 1390.9569155  71510 303775423      775324        syn-C2H3C(O)NH2, v=0
  749828.4207  0.1062 -4.8030 3 1390.9569155  71510 303775424      775325        syn-C2H3C(O)NH2, v=0
  749862.8827  0.0211 -5.0384 3  817.5578155  71510 303772058      771761        syn-C2H3C(O)NH2, v=0
  750052.9522  0.1063 -4.7804 3 1372.2463153  71510 303765422      765323        syn-C2H3C(O)NH2, v=0
  750052.9522  0.1063 -4.7804 3 1372.2463153  71510 303765423      765324        syn-C2H3C(O)NH2, v=0
  750248.5409  0.0047 -2.6285 3  428.0150 77  71510 3033834 4      3733 5        syn-C2H3C(O)NH2, v=0
  750248.5409  0.0047 -2.6285 3  428.0150 77  71510 3033834 5      3733 4        syn-C2H3C(O)NH2, v=0
  750270.7322  0.1064 -4.7591 3 1353.7812151  71510 303755421      755322        syn-C2H3C(O)NH2, v=0
  750270.7322  0.1064 -4.7591 3 1353.7812151  71510 303755422      755323        syn-C2H3C(O)NH2, v=0
  750481.9156  0.1065 -4.7391 3 1335.5612149  71510 303745420      745321        syn-C2H3C(O)NH2, v=0
  750481.9156  0.1065 -4.7391 3 1335.5612149  71510 303745421      745322        syn-C2H3C(O)NH2, v=0
  750633.0708  0.0057 -4.9154 3  667.6390137  71510 303682247      681950        syn-C2H3C(O)NH2, v=0
  750678.8447  0.0036 -2.6495 3  431.4455 81  71510 3034033 7      3932 8        syn-C2H3C(O)NH2, v=0
  750678.8447  0.0036 -2.6495 3  431.4455 81  71510 3034033 8      3932 7        syn-C2H3C(O)NH2, v=0
  750686.6550  0.1066 -4.7206 3 1317.5865147  71510 303735419      735320        syn-C2H3C(O)NH2, v=0
  750686.6550  0.1066 -4.7206 3 1317.5865147  71510 303735420      735321        syn-C2H3C(O)NH2, v=0
  750732.0210  0.0031 -3.6489 3  358.3057105  71510 303521340      511041        syn-C2H3C(O)NH2, v=0
  750885.1002  0.1068 -4.7037 3 1299.8568145  71510 303725418      725319        syn-C2H3C(O)NH2, v=0
  750885.1002  0.1068 -4.7037 3 1299.8568145  71510 303725419      725320        syn-C2H3C(O)NH2, v=0
  750931.3408  0.0358 -4.1091 3  978.1307169  71510 303842263      832162        syn-C2H3C(O)NH2, v=0
  750977.1293  0.0018 -2.9933 3  529.9776117  71510 303582435      572334        syn-C2H3C(O)NH2, v=0
  750977.1315  0.0018 -2.9933 3  529.9776117  71510 303582434      572335        syn-C2H3C(O)NH2, v=0
  751056.5708  0.0611 -4.5672 3 1399.6638205  71510 303A22181      A12280        syn-C2H3C(O)NH2, v=0
  751077.3988  0.1070 -4.6884 3 1282.3721143  71510 303715417      715318        syn-C2H3C(O)NH2, v=0
  751077.3988  0.1070 -4.6884 3 1282.3721143  71510 303715418      715319        syn-C2H3C(O)NH2, v=0
  751090.9972  0.0028 -2.6731 3  436.3479 85  71510 303423210      413111        syn-C2H3C(O)NH2, v=0
  751090.9972  0.0028 -2.6731 3  436.3479 85  71510 303423211      413110        syn-C2H3C(O)NH2, v=0
  751208.5937  0.0610 -4.5671 3 1399.6606205  71510 303A22281      A12180        syn-C2H3C(O)NH2, v=0
  751263.6959  0.1072 -4.6749 3 1265.1322141  71510 303705416      705317        syn-C2H3C(O)NH2, v=0
  751263.6959  0.1072 -4.6749 3 1265.1322141  71510 303705417      705318        syn-C2H3C(O)NH2, v=0
  751305.1072  0.0040 -3.4185 3  650.3377137  71510 303682048      671949        syn-C2H3C(O)NH2, v=0
  751444.1342  0.1075 -4.6633 3 1248.1372139  71510 303695415      695316        syn-C2H3C(O)NH2, v=0
  751444.1342  0.1075 -4.6633 3 1248.1372139  71510 303695416      695317        syn-C2H3C(O)NH2, v=0
  751474.9451  0.0023 -2.6996 3  442.7296 89  71510 303443113      433014        syn-C2H3C(O)NH2, v=0
  751474.9451  0.0023 -2.6996 3  442.7296 89  71510 303443114      433013        syn-C2H3C(O)NH2, v=0
  751524.8528  0.0021 -4.7301 3  158.6912 67  71510 303331420      321121        syn-C2H3C(O)NH2, v=0
  751618.8538  0.1077 -4.6539 3 1231.3869137  71510 303685414      685315        syn-C2H3C(O)NH2, v=0
  751618.8538  0.1077 -4.6539 3 1231.3869137  71510 303685415      685316        syn-C2H3C(O)NH2, v=0
  751635.6106  0.0034 -4.8916 3  514.2034119  71510 303592138      591841        syn-C2H3C(O)NH2, v=0
  751661.0270  0.0023 -5.4566 3  107.3463 51  71510 303251511      241212        syn-C2H3C(O)NH2, v=0
  751661.0697  0.0023 -5.4566 3  107.3463 51  71510 303251510      241213        syn-C2H3C(O)NH2, v=0
  751787.9929  0.1080 -4.6469 3 1214.8813135  71510 303675413      675314        syn-C2H3C(O)NH2, v=0
  751787.9929  0.1080 -4.6469 3 1214.8813135  71510 303675414      675315        syn-C2H3C(O)NH2, v=0
  751796.9585  0.0018 -2.9363 3  512.7954113  71510 303562531      552432        syn-C2H3C(O)NH2, v=0
  751796.9585  0.0018 -2.9363 3  512.7954113  71510 303562532      552431        syn-C2H3C(O)NH2, v=0
  751816.4728  0.0021 -2.7293 3  450.5997 93  71510 303463016      452917        syn-C2H3C(O)NH2, v=0
  751816.4728  0.0021 -2.7293 3  450.5997 93  71510 303463017      452916        syn-C2H3C(O)NH2, v=0
  751922.2735  0.1098 -4.4679 3 1536.9090235  71510 303B7 7B0      B6 8A9        syn-C2H3C(O)NH2, v=0
  751922.2735  0.1098 -4.4679 3 1536.9090235  71510 303B7 8B0      B6 7A9        syn-C2H3C(O)NH2, v=0
  751923.6608  0.1057 -4.4757 3 1532.7136233  71510 303B6 8A8      B5 9A7        syn-C2H3C(O)NH2, v=0
  751923.6608  0.1057 -4.4757 3 1532.7136233  71510 303B6 9A8      B5 8A7        syn-C2H3C(O)NH2, v=0
  751929.2543  0.1143 -4.4597 3 1540.5714237  71510 303B8 6B2      B7 7B1        syn-C2H3C(O)NH2, v=0
  751929.2543  0.1143 -4.4597 3 1540.5714237  71510 303B8 7B2      B7 6B1        syn-C2H3C(O)NH2, v=0
  751936.7816  0.1019 -4.4831 3 1527.9792231  71510 303B5 9A6      B410A5        syn-C2H3C(O)NH2, v=0
  751936.7816  0.1019 -4.4831 3 1527.9792231  71510 303B510A6      B4 9A5        syn-C2H3C(O)NH2, v=0
  751941.8183  0.1194 -4.4510 3 1543.7059239  71510 303B9 5B4      B8 6B3        syn-C2H3C(O)NH2, v=0
  751941.8183  0.1194 -4.4510 3 1543.7059239  71510 303B9 6B4      B8 5B3        syn-C2H3C(O)NH2, v=0
  751951.6871  0.1084 -4.6426 3 1198.6202133  71510 303665412      665313        syn-C2H3C(O)NH2, v=0
  751951.6871  0.1084 -4.6426 3 1198.6202133  71510 303665413      665314        syn-C2H3C(O)NH2, v=0
  751957.6410  0.1253 -4.4418 3 1546.3170241  71510 303C0 4B6      B9 5B5        syn-C2H3C(O)NH2, v=0
  751957.6410  0.1253 -4.4418 3 1546.3170241  71510 303C0 5B6      B9 4B5        syn-C2H3C(O)NH2, v=0
  751965.7409  0.0984 -4.4903 3 1522.6989229  71510 303B410A4      B311A3        syn-C2H3C(O)NH2, v=0
  751965.7409  0.0984 -4.4903 3 1522.6989229  71510 303B411A4      B310A3        syn-C2H3C(O)NH2, v=0
  751974.7662  0.1322 -4.4321 3 1548.4088243  71510 303C1 3B8      C0 4B7        syn-C2H3C(O)NH2, v=0
  751974.7662  0.1322 -4.4321 3 1548.4088243  71510 303C1 4B8      C0 3B7        syn-C2H3C(O)NH2, v=0
  751991.5356  0.1404 -4.4217 3 1549.9845245  71510 303C2 2C0      C1 3B9        syn-C2H3C(O)NH2, v=0
  751991.5356  0.1404 -4.4217 3 1549.9845245  71510 303C2 3C0      C1 2B9        syn-C2H3C(O)NH2, v=0
  752006.5323  0.1502 -4.4108 3 1551.0472247  71510 303C3 1C2      C2 2C1        syn-C2H3C(O)NH2, v=0
  752006.5323  0.1502 -4.4108 3 1551.0472247  71510 303C3 2C2      C2 1C1        syn-C2H3C(O)NH2, v=0
  752015.5979  0.0950 -4.4972 3 1516.8649227  71510 303B311A2      B212A1        syn-C2H3C(O)NH2, v=0
  752015.5979  0.0950 -4.4972 3 1516.8649227  71510 303B312A2      B211A1        syn-C2H3C(O)NH2, v=0
  752018.5373  0.1619 -4.3992 3 1551.5995249  71510 303C4 0C4      C3 1C3        syn-C2H3C(O)NH2, v=0
  752018.5373  0.1619 -4.3992 3 1551.5995249  71510 303C4 1C4      C3 0C3        syn-C2H3C(O)NH2, v=0
  752043.9998  0.0021 -4.7297 3  158.6739 67  71510 303331419      321122        syn-C2H3C(O)NH2, v=0
  752092.6596  0.0916 -4.5040 3 1510.4679225  71510 303B212A0      B11399        syn-C2H3C(O)NH2, v=0
  752092.6596  0.0916 -4.5040 3 1510.4679225  71510 303B213A0      B11299        syn-C2H3C(O)NH2, v=0
  752095.5198  0.0020 -2.7624 3  459.9695 97  71510 303482919      472820        syn-C2H3C(O)NH2, v=0
  752095.5198  0.0020 -2.7624 3  459.9695 97  71510 303482920      472819        syn-C2H3C(O)NH2, v=0
  752110.0697  0.1087 -4.6412 3 1182.6036131  71510 303655411      655312        syn-C2H3C(O)NH2, v=0
  752110.0697  0.1087 -4.6412 3 1182.6036131  71510 303655412      655313        syn-C2H3C(O)NH2, v=0
  752155.1879  0.0258 -5.0814 3  789.2746153  71510 303761858      761561        syn-C2H3C(O)NH2, v=0
  752204.8928  0.0884 -4.5108 3 1503.4969223  71510 303B11398      B01497        syn-C2H3C(O)NH2, v=0
  752204.8928  0.0884 -4.5108 3 1503.4969223  71510 303B11498      B01397        syn-C2H3C(O)NH2, v=0
  752205.3483  0.1289 -5.5772 3 1228.5845187  71510 303932766      932469        syn-C2H3C(O)NH2, v=0
  752207.1590  0.0019 -2.8855 3  497.2393109  71510 303542628      532529        syn-C2H3C(O)NH2, v=0
  752207.1590  0.0019 -2.8855 3  497.2393109  71510 303542629      532528        syn-C2H3C(O)NH2, v=0
  752263.2719  0.1091 -4.6434 3 1166.8314129  71510 303645410      645311        syn-C2H3C(O)NH2, v=0
  752263.2719  0.1091 -4.6434 3 1166.8314129  71510 303645411      645312        syn-C2H3C(O)NH2, v=0
  752283.6911  0.0020 -2.7992 3  470.8531101  71510 303502822      492723        syn-C2H3C(O)NH2, v=0
  752283.6911  0.0020 -2.7992 3  470.8531101  71510 303502823      492722        syn-C2H3C(O)NH2, v=0
  752298.8872  0.0052 -3.6680 3  403.8813111  71510 303551342      541243        syn-C2H3C(O)NH2, v=0
  752340.4612  0.0019 -2.8400 3  483.2686105  71510 303522725      512626        syn-C2H3C(O)NH2, v=0
  752340.4612  0.0019 -2.8400 3  483.2686105  71510 303522726      512625        syn-C2H3C(O)NH2, v=0
  752362.5131  0.0852 -4.5177 3 1495.9392221  71510 303B01496      A91595        syn-C2H3C(O)NH2, v=0
  752362.5131  0.0852 -4.5177 3 1495.9392221  71510 303B01596      A91495        syn-C2H3C(O)NH2, v=0
  752411.4227  0.1095 -4.6496 3 1151.3035127  71510 3036354 9      635310        syn-C2H3C(O)NH2, v=0
  752411.4227  0.1095 -4.6496 3 1151.3035127  71510 303635410      635311        syn-C2H3C(O)NH2, v=0
  752424.8429  0.0049 -5.6923 3  280.6320 99  71510 30349 643      49 346        syn-C2H3C(O)NH2, v=0
  752424.9737  0.0049 -5.6923 3  280.6320 99  71510 30349 743      49 446        syn-C2H3C(O)NH2, v=0
  752458.1774  0.0594 -4.5999 3 1386.2847203  71510 303A12279      A02378        syn-C2H3C(O)NH2, v=0
  752496.2416  0.0406 -5.1463 3  856.1574159  71510 303791960      791663        syn-C2H3C(O)NH2, v=0
  752554.6487  0.1099 -4.6605 3 1136.0198125  71510 3036254 8      6253 9        syn-C2H3C(O)NH2, v=0
  752554.6487  0.1099 -4.6605 3 1136.0198125  71510 3036254 9      625310        syn-C2H3C(O)NH2, v=0
  752578.8543  0.0820 -4.5250 3 1487.7794219  71510 303A91594      A81693        syn-C2H3C(O)NH2, v=0
  752578.8543  0.0820 -4.5250 3 1487.7794219  71510 303A91694      A81593        syn-C2H3C(O)NH2, v=0
  752693.0744  0.1103 -4.6773 3 1120.9803123  71510 3036154 7      6153 8        syn-C2H3C(O)NH2, v=0
  752693.0744  0.1103 -4.6773 3 1120.9803123  71510 3036154 8      6153 9        syn-C2H3C(O)NH2, v=0
  752826.8223  0.1107 -4.7014 3 1106.1849121  71510 3036054 6      6053 7        syn-C2H3C(O)NH2, v=0
  752826.8223  0.1107 -4.7014 3 1106.1849121  71510 3036054 7      6053 8        syn-C2H3C(O)NH2, v=0
  752868.1044  0.0024 -5.0555 3  345.5752 95  71510 303472027      471730        syn-C2H3C(O)NH2, v=0
  752871.6920  0.0789 -4.5329 3 1478.9988217  71510 303A81692      A71791        syn-C2H3C(O)NH2, v=0
  752871.6920  0.0789 -4.5329 3 1478.9988217  71510 303A81792      A71691        syn-C2H3C(O)NH2, v=0
  752875.8095  0.0024 -5.0555 3  345.5750 95  71510 303472028      471731        syn-C2H3C(O)NH2, v=0
  752939.5038  0.0033 -4.8903 3  514.1599119  71510 303592139      591842        syn-C2H3C(O)NH2, v=0
  752956.0124  0.1112 -4.7348 3 1091.6336119  71510 3035954 5      5953 6        syn-C2H3C(O)NH2, v=0
  752956.0124  0.1112 -4.7348 3 1091.6336119  71510 3035954 6      5953 7        syn-C2H3C(O)NH2, v=0
  752984.5708  0.0114 -5.0212 3  822.9481153  71510 303762354      762057        syn-C2H3C(O)NH2, v=0
  753080.7630  0.1116 -4.7809 3 1077.3261117  71510 3035854 4      5853 5        syn-C2H3C(O)NH2, v=0
  753080.7630  0.1116 -4.7809 3 1077.3261117  71510 3035854 5      5853 6        syn-C2H3C(O)NH2, v=0
  753201.1900  0.1121 -4.8452 3 1063.2626115  71510 3035754 3      5753 4        syn-C2H3C(O)NH2, v=0
  753201.1900  0.1121 -4.8452 3 1063.2626115  71510 3035754 4      5753 5        syn-C2H3C(O)NH2, v=0
  753265.3421  0.0759 -4.5417 3 1469.5746215  71510 303A71790      A61889        syn-C2H3C(O)NH2, v=0
  753265.3429  0.0759 -4.5417 3 1469.5746215  71510 303A71890      A61789        syn-C2H3C(O)NH2, v=0
  753289.7921  0.0042 -3.6679 3  371.0335107  71510 303531241      521142        syn-C2H3C(O)NH2, v=0
  753317.4073  0.1126 -4.9378 3 1049.4428113  71510 3035654 2      5653 3        syn-C2H3C(O)NH2, v=0
  753317.4073  0.1126 -4.9378 3 1049.4428113  71510 3035654 3      5653 4        syn-C2H3C(O)NH2, v=0
  753429.5267  0.1131 -5.0821 3 1035.8668111  71510 3035554 1      5553 2        syn-C2H3C(O)NH2, v=0
  753429.5267  0.1131 -5.0821 3 1035.8668111  71510 3035554 2      5553 3        syn-C2H3C(O)NH2, v=0
  753502.9415  0.0023 -3.1610 3  584.9685127  71510 303632242      622141        syn-C2H3C(O)NH2, v=0
  753517.2541  0.0023 -3.1610 3  584.9680127  71510 303632241      622142        syn-C2H3C(O)NH2, v=0
  753531.1752  0.0069 -4.8833 3  184.2974 77  71510 303381028      37 731        syn-C2H3C(O)NH2, v=0
  753537.6579  0.1136 -5.3517 3 1022.5344109  71510 3035454 0      5453 1        syn-C2H3C(O)NH2, v=0
  753537.6579  0.1136 -5.3517 3 1022.5344109  71510 3035454 1      5453 2        syn-C2H3C(O)NH2, v=0
  753542.5576  0.0043 -4.3477 3  212.1733 89  71510 30344 440      43 341        syn-C2H3C(O)NH2, v=0
  753542.5651  0.0043 -4.3477 3  212.1733 89  71510 30344 540      43 241        syn-C2H3C(O)NH2, v=0
  753794.1519  0.0729 -4.5519 3 1459.4782213  71510 303A61888      A51987        syn-C2H3C(O)NH2, v=0
  753794.1709  0.0729 -4.5519 3 1459.4782213  71510 303A61988      A51887        syn-C2H3C(O)NH2, v=0
  753910.2982  0.0030 -3.6725 3  339.3637103  71510 303511240      50 941        syn-C2H3C(O)NH2, v=0
  753933.8001  0.0075 -5.5131 3  351.6366103  71510 303511437      51 942        syn-C2H3C(O)NH2, v=0
  754011.1637  0.0046 -4.9935 3  523.7521127  71510 303631350      631053        syn-C2H3C(O)NH2, v=0
  754142.9216  0.0029 -3.6548 3  377.2947107  71510 303531440      521141        syn-C2H3C(O)NH2, v=0
  754199.6144  0.0580 -4.5978 3 1386.2490203  71510 303A12379      A02278        syn-C2H3C(O)NH2, v=0
  754277.5181  0.2199 -5.6275 3 1253.2732191  71510 303952471      952174        syn-C2H3C(O)NH2, v=0
  754289.1189  0.0030 -3.2890 3  624.4992133  71510 303662146      652045        syn-C2H3C(O)NH2, v=0
  754421.6573  0.0045 -5.2594 3  409.8648109  71510 303541737      541242        syn-C2H3C(O)NH2, v=0
  754508.5653  0.0701 -4.5642 3 1448.6725211  71510 303A51986      A42085        syn-C2H3C(O)NH2, v=0
  754508.9425  0.0701 -4.5642 3 1448.6725211  71510 303A52086      A41985        syn-C2H3C(O)NH2, v=0
  754596.4250  0.0158 -3.8230 3  825.2068155  71510 303772157      762056        syn-C2H3C(O)NH2, v=0
  754661.6702  0.2386 -5.2098 3 1558.0826213  71510 303A62680      A52779        syn-C2H3C(O)NH2, v=0
  754681.7436  0.0081 -4.9724 3  663.3579141  71510 303701754      701457        syn-C2H3C(O)NH2, v=0
  754916.5306  0.0047 -5.2239 3  423.7272111  71510 303551738      551243        syn-C2H3C(O)NH2, v=0
  755039.4587  0.0035 -4.3237 3  233.2214 83  71510 303411428      401129        syn-C2H3C(O)NH2, v=0
  755047.8366  0.0030 -3.2883 3  624.4785133  71510 303662145      652046        syn-C2H3C(O)NH2, v=0
  755177.7178  0.0045 -4.9924 3  523.7521127  71510 303631450      631153        syn-C2H3C(O)NH2, v=0
  755484.7636  0.0673 -4.5797 3 1437.1085209  71510 303A42084      A32183        syn-C2H3C(O)NH2, v=0
  755491.1708  0.0673 -4.5797 3 1437.1084209  71510 303A42184      A32083        syn-C2H3C(O)NH2, v=0
  755529.9310  0.0022 -4.6715 3  166.9741 69  71510 303341421      331122        syn-C2H3C(O)NH2, v=0
  755593.5804  0.0252 -5.1337 3  871.6073157  71510 303782454      782157        syn-C2H3C(O)NH2, v=0
  755767.1995  0.0024 -5.0881 3  333.8686 93  71510 303462026      461729        syn-C2H3C(O)NH2, v=0
  755770.9847  0.0024 -5.0881 3  333.8685 93  71510 303462027      461730        syn-C2H3C(O)NH2, v=0
  755871.6556  0.0078 -5.1877 3  161.8079 73  71510 30336 927      35 630        syn-C2H3C(O)NH2, v=0
  755917.4481  0.0056 -4.6064 3  208.0067 81  71510 303401129      39 832        syn-C2H3C(O)NH2, v=0
  756218.5025  0.0020 -3.0832 3  563.7616123  71510 303612339      602238        syn-C2H3C(O)NH2, v=0
  756218.8205  0.0020 -3.0832 3  563.7616123  71510 303612338      602239        syn-C2H3C(O)NH2, v=0
  756273.5712  0.0274 -5.1607 3  964.9592167  71510 303832361      832064        syn-C2H3C(O)NH2, v=0
  756360.7697  0.1316 -5.6744 3 1938.6269203  71510 303A15546      A15447        syn-C2H3C(O)NH2, v=0
  756360.7697  0.1316 -5.6744 3 1938.6269203  71510 303A15547      A15448        syn-C2H3C(O)NH2, v=0
  756471.5565  0.0028 -3.7129 3  320.5538101  71510 303501040      49 941        syn-C2H3C(O)NH2, v=0
  756498.5612  0.0021 -4.6708 3  166.9418 69  71510 303341420      331123        syn-C2H3C(O)NH2, v=0
  756736.3381  0.0042 -5.5063 3  311.5779103  71510 30351 744      51 447        syn-C2H3C(O)NH2, v=0
  756736.9700  0.0042 -5.5063 3  311.5779103  71510 30351 844      51 547        syn-C2H3C(O)NH2, v=0
  756784.1668  0.1303 -5.6311 3 1914.0114201  71510 303A05545      A05446        syn-C2H3C(O)NH2, v=0
  756784.1668  0.1303 -5.6311 3 1914.0114201  71510 303A05546      A05447        syn-C2H3C(O)NH2, v=0
  756818.9323  0.0647 -4.6002 3 1424.7183207  71510 303A32182      A22281        syn-C2H3C(O)NH2, v=0
  756911.0136  0.0646 -4.6001 3 1424.7163207  71510 303A32282      A22181        syn-C2H3C(O)NH2, v=0
  757017.3699  0.0656 -4.6811 3 1397.0667203  71510 303A12378      A02477        syn-C2H3C(O)NH2, v=0
  757061.3379  0.0059 -2.6209 3  434.8023 75  71510 3033735 2      3634 3        syn-C2H3C(O)NH2, v=0
  757061.3379  0.0059 -2.6209 3  434.8023 75  71510 3033735 3      3634 2        syn-C2H3C(O)NH2, v=0
  757104.6134  0.0819 -5.4159 3 1102.7059177  71510 303882662      882365        syn-C2H3C(O)NH2, v=0
  757196.7791  0.1291 -5.5884 3 1889.6435199  71510 303995544      995445        syn-C2H3C(O)NH2, v=0
  757196.7791  0.1291 -5.5884 3 1889.6435199  71510 303995545      995446        syn-C2H3C(O)NH2, v=0
  757207.0269  0.0037 -4.1620 3  229.6079 91  71510 30345 540      44 441        syn-C2H3C(O)NH2, v=0
  757207.1171  0.0037 -4.1620 3  229.6079 91  71510 30345 640      44 341        syn-C2H3C(O)NH2, v=0
  757399.8499  0.0082 -5.4917 3  140.5539 69  71510 30334 826      33 529        syn-C2H3C(O)NH2, v=0
  757499.9726  0.0046 -2.6401 3  437.2598 79  71510 3033934 5      3833 6        syn-C2H3C(O)NH2, v=0
  757499.9726  0.0046 -2.6401 3  437.2598 79  71510 3033934 6      3833 5        syn-C2H3C(O)NH2, v=0
  757553.3902  0.0167 -5.0212 3  770.7026151  71510 303751957      751660        syn-C2H3C(O)NH2, v=0
  757598.8252  0.1280 -5.5465 3 1865.5231197  71510 303985543      985444        syn-C2H3C(O)NH2, v=0
  757598.8252  0.1280 -5.5465 3 1865.5231197  71510 303985544      985445        syn-C2H3C(O)NH2, v=0
  757608.9634  0.0044 -5.3150 3  396.1605107  71510 303531736      531241        syn-C2H3C(O)NH2, v=0
  757836.5543  0.0019 -3.0163 3  544.3403119  71510 303592436      582335        syn-C2H3C(O)NH2, v=0
  757836.5592  0.0019 -3.0163 3  544.3403119  71510 303592435      582336        syn-C2H3C(O)NH2, v=0
  757850.8773  0.0032 -4.9034 3  499.2967117  71510 303582137      581840        syn-C2H3C(O)NH2, v=0
  757898.6694  0.0539 -4.3255 3 1120.3163181  71510 303902368      892267        syn-C2H3C(O)NH2, v=0
  757917.7003  0.1155 -4.5090 3 1561.9904237  71510 303B8 7B1      B7 8B0        syn-C2H3C(O)NH2, v=0
  757917.7003  0.1155 -4.5090 3 1561.9904237  71510 303B8 8B1      B7 7B0        syn-C2H3C(O)NH2, v=0
  757918.0292  0.1113 -4.5166 3 1557.7950235  71510 303B7 8A9      B6 9A8        syn-C2H3C(O)NH2, v=0
  757918.0292  0.1113 -4.5166 3 1557.7950235  71510 303B7 9A9      B6 8A8        syn-C2H3C(O)NH2, v=0
  757925.4453  0.1203 -4.5010 3 1565.6530239  71510 303B9 6B3      B8 7B2        syn-C2H3C(O)NH2, v=0
  757925.4453  0.1203 -4.5010 3 1565.6530239  71510 303B9 7B3      B8 6B2        syn-C2H3C(O)NH2, v=0
  757925.6039  0.0035 -2.6618 3  441.1849 83  71510 3034133 8      4032 9        syn-C2H3C(O)NH2, v=0
  757925.6039  0.0035 -2.6618 3  441.1849 83  71510 3034133 9      4032 8        syn-C2H3C(O)NH2, v=0
  757929.7068  0.1073 -4.5239 3 1553.0611233  71510 303B6 9A7      B510A6        syn-C2H3C(O)NH2, v=0
  757929.7068  0.1073 -4.5239 3 1553.0611233  71510 303B610A7      B5 9A6        syn-C2H3C(O)NH2, v=0
  757938.5481  0.1256 -4.4924 3 1568.7880241  71510 303C0 5B5      B9 6B4        syn-C2H3C(O)NH2, v=0
  757938.5481  0.1256 -4.4924 3 1568.7880241  71510 303C0 6B5      B9 5B4        syn-C2H3C(O)NH2, v=0
  757954.7367  0.1318 -4.4834 3 1571.3997243  71510 303C1 4B7      C0 5B6        syn-C2H3C(O)NH2, v=0
  757954.7367  0.1318 -4.4834 3 1571.3997243  71510 303C1 5B7      C0 4B6        syn-C2H3C(O)NH2, v=0
  757956.7172  0.1036 -4.5308 3 1547.7818231  71510 303B510A5      B411A4        syn-C2H3C(O)NH2, v=0
  757956.7172  0.1036 -4.5308 3 1547.7818231  71510 303B511A5      B410A4        syn-C2H3C(O)NH2, v=0
  757972.0951  0.1390 -4.4738 3 1573.4919245  71510 303C2 3B9      C1 4B8        syn-C2H3C(O)NH2, v=0
  757972.0951  0.1390 -4.4738 3 1573.4919245  71510 303C2 4B9      C1 3B8        syn-C2H3C(O)NH2, v=0
  757988.9956  0.1475 -4.4636 3 1575.0682247  71510 303C3 2C1      C2 3C0        syn-C2H3C(O)NH2, v=0
  757988.9956  0.1475 -4.4636 3 1575.0682247  71510 303C3 3C1      C2 2C0        syn-C2H3C(O)NH2, v=0
  757990.5199  0.1270 -5.5053 3 1841.6501195  71510 303975542      975443        syn-C2H3C(O)NH2, v=0
  757990.5199  0.1270 -5.5053 3 1841.6501195  71510 303975543      975444        syn-C2H3C(O)NH2, v=0
  758003.9579  0.1000 -4.5375 3 1541.9495229  71510 303B411A3      B312A2        syn-C2H3C(O)NH2, v=0
  758003.9579  0.1000 -4.5375 3 1541.9495229  71510 303B412A3      B311A2        syn-C2H3C(O)NH2, v=0
  758004.0448  0.1577 -4.4527 3 1576.1314249  71510 303C4 1C3      C3 2C2        syn-C2H3C(O)NH2, v=0
  758004.0448  0.1577 -4.4527 3 1576.1314249  71510 303C4 2C3      C3 1C2        syn-C2H3C(O)NH2, v=0
  758016.0419  0.1699 -4.4413 3 1576.6842251  71510 303C5 0C5      C4 1C4        syn-C2H3C(O)NH2, v=0
  758016.0419  0.1699 -4.4413 3 1576.6842251  71510 303C5 1C5      C4 0C4        syn-C2H3C(O)NH2, v=0
  758026.9865  0.0052 -4.9167 3  650.3377135  71510 303672246      671949        syn-C2H3C(O)NH2, v=0
  758033.5557  0.0027 -3.7116 3  320.5528101  71510 303501140      49 841        syn-C2H3C(O)NH2, v=0
  758075.6634  0.0065 -4.9856 3  620.6459137  71510 303681553      681256        syn-C2H3C(O)NH2, v=0
  758077.5162  0.0966 -4.5440 3 1535.5550227  71510 303B312A1      B213A0        syn-C2H3C(O)NH2, v=0
  758077.5162  0.0966 -4.5440 3 1535.5550227  71510 303B313A1      B212A0        syn-C2H3C(O)NH2, v=0
  758115.5536  0.0022 -5.3608 3  113.5017 53  71510 303261512      251213        syn-C2H3C(O)NH2, v=0
  758115.6726  0.0022 -5.3608 3  113.5017 53  71510 303261511      251214        syn-C2H3C(O)NH2, v=0
  758185.0556  0.0932 -4.5505 3 1528.5878225  71510 303B21399      B11498        syn-C2H3C(O)NH2, v=0
  758185.0556  0.0932 -4.5505 3 1528.5878225  71510 303B21499      B11398        syn-C2H3C(O)NH2, v=0
  758330.4970  0.0028 -2.6863 3  446.5840 87  71510 303433211      423112        syn-C2H3C(O)NH2, v=0
  758330.4970  0.0028 -2.6863 3  446.5840 87  71510 303433212      423111        syn-C2H3C(O)NH2, v=0
  758336.3671  0.0899 -4.5571 3 1521.0353223  71510 303B11497      B01596        syn-C2H3C(O)NH2, v=0
  758336.3671  0.0899 -4.5571 3 1521.0353223  71510 303B11597      B01496        syn-C2H3C(O)NH2, v=0
  758347.9620  0.0626 -4.6297 3 1411.4064205  71510 303A22280      A12379        syn-C2H3C(O)NH2, v=0
  758372.0739  0.1260 -5.4648 3 1818.0244193  71510 303965541      965442        syn-C2H3C(O)NH2, v=0
  758372.0739  0.1260 -5.4648 3 1818.0244193  71510 303965542      965443        syn-C2H3C(O)NH2, v=0
  758449.9781  0.0023 -5.1231 3  322.4254 91  71510 303452025      451728        syn-C2H3C(O)NH2, v=0
  758451.7980  0.0023 -5.1231 3  322.4254 91  71510 303452026      451729        syn-C2H3C(O)NH2, v=0
  758512.4286  0.0034 -5.1305 3  150.1758 69  71510 303341124      33 627        syn-C2H3C(O)NH2, v=0
  758544.1747  0.0866 -4.5640 3 1512.8827221  71510 303B01595      A91694        syn-C2H3C(O)NH2, v=0
  758544.1747  0.0866 -4.5640 3 1512.8827221  71510 303B01695      A91594        syn-C2H3C(O)NH2, v=0
  758590.2983  0.0474 -5.2670 3  983.7030167  71510 303832558      832261        syn-C2H3C(O)NH2, v=0
  758611.8616  0.0032 -4.9026 3  499.2713117  71510 303582138      581841        syn-C2H3C(O)NH2, v=0
  758703.6995  0.0023 -2.7137 3  453.4649 91  71510 303453114      443015        syn-C2H3C(O)NH2, v=0
  758703.6995  0.0023 -2.7137 3  453.4649 91  71510 303453115      443014        syn-C2H3C(O)NH2, v=0
  758710.6711  0.0052 -4.9252 3  633.5320133  71510 303662244      661947        syn-C2H3C(O)NH2, v=0
  758743.6943  0.1251 -5.4250 3 1794.6458191  71510 303955540      955441        syn-C2H3C(O)NH2, v=0
  758743.6943  0.1251 -5.4250 3 1794.6458191  71510 303955541      955442        syn-C2H3C(O)NH2, v=0
  758774.7571  0.0019 -2.9576 3  526.6163115  71510 303572533      562432        syn-C2H3C(O)NH2, v=0
  758774.7572  0.0019 -2.9576 3  526.6163115  71510 303572532      562433        syn-C2H3C(O)NH2, v=0
  758825.3558  0.0833 -4.5715 3 1504.1119219  71510 303A91693      A81792        syn-C2H3C(O)NH2, v=0
  758825.3558  0.0833 -4.5715 3 1504.1119219  71510 303A91793      A81692        syn-C2H3C(O)NH2, v=0
  758899.4230  0.0044 -5.0338 3  485.2825123  71510 303611249      61 952        syn-C2H3C(O)NH2, v=0
  758943.7486  0.0022 -4.6159 3  175.5354 71  71510 303351422      341123        syn-C2H3C(O)NH2, v=0
  759015.5657  0.0050 -5.2073 3  437.7553113  71510 303561739      561244        syn-C2H3C(O)NH2, v=0
  759029.7929  0.0021 -2.7444 3  461.8370 95  71510 303473017      462918        syn-C2H3C(O)NH2, v=0
  759029.7929  0.0021 -2.7444 3  461.8370 95  71510 303473018      462917        syn-C2H3C(O)NH2, v=0
  759034.7144  0.0106 -5.0128 3  803.5688151  71510 303752353      752056        syn-C2H3C(O)NH2, v=0
  759056.9449  0.0047 -3.4622 3  667.6390139  71510 303692049      681950        syn-C2H3C(O)NH2, v=0
  759105.5846  0.1243 -5.3860 3 1771.5142189  71510 303945539      945440        syn-C2H3C(O)NH2, v=0
  759105.5846  0.1243 -5.3860 3 1771.5142189  71510 303945540      945441        syn-C2H3C(O)NH2, v=0
  759202.8571  0.0802 -4.5797 3 1494.7009217  71510 303A81791      A71890        syn-C2H3C(O)NH2, v=0
  759202.8576  0.0802 -4.5797 3 1494.7009217  71510 303A81891      A71790        syn-C2H3C(O)NH2, v=0
  759267.5154  0.0019 -2.9053 3  510.5296111  71510 303552629      542530        syn-C2H3C(O)NH2, v=0
  759267.5154  0.0019 -2.9053 3  510.5296111  71510 303552630      542529        syn-C2H3C(O)NH2, v=0
  759287.0820  0.0020 -2.7785 3  471.7124 99  71510 303492920      482821        syn-C2H3C(O)NH2, v=0
  759287.0820  0.0020 -2.7785 3  471.7124 99  71510 303492921      482820        syn-C2H3C(O)NH2, v=0
  759304.0821  0.0043 -5.0334 3  485.2825123  71510 303611349      611052        syn-C2H3C(O)NH2, v=0
  759443.4402  0.0617 -4.6284 3 1411.3840205  71510 303A22380      A12279        syn-C2H3C(O)NH2, v=0
  759444.9074  0.0020 -2.8164 3  483.1060103  71510 303512823      502724        syn-C2H3C(O)NH2, v=0
  759444.9074  0.0020 -2.8164 3  483.1060103  71510 303512824      502723        syn-C2H3C(O)NH2, v=0
  759457.9447  0.1235 -5.3478 3 1748.6295187  71510 303935538      935439        syn-C2H3C(O)NH2, v=0
  759457.9447  0.1235 -5.3478 3 1748.6295187  71510 303935539      935440        syn-C2H3C(O)NH2, v=0
  759459.5225  0.0019 -2.8585 3  496.0369107  71510 303532726      522627        syn-C2H3C(O)NH2, v=0
  759459.5225  0.0019 -2.8585 3  496.0369107  71510 303532727      522626        syn-C2H3C(O)NH2, v=0
  759642.9994  0.0034 -3.3241 3  641.1757135  71510 303672147      662046        syn-C2H3C(O)NH2, v=0
  759685.4646  0.0033 -4.3723 3  222.8115 81  71510 303401427      391128        syn-C2H3C(O)NH2, v=0
  759708.8492  0.0771 -4.5893 3 1484.6220215  71510 303A71889      A61988        syn-C2H3C(O)NH2, v=0
  759708.8598  0.0771 -4.5893 3 1484.6220215  71510 303A71989      A61888        syn-C2H3C(O)NH2, v=0
  759800.9712  0.1228 -5.3104 3 1725.9916185  71510 303925537      925438        syn-C2H3C(O)NH2, v=0
  759800.9712  0.1228 -5.3104 3 1725.9916185  71510 303925538      925439        syn-C2H3C(O)NH2, v=0
  759813.3772  0.3337 -5.4273 3 1650.1334219  71510 303A92782      A82881        syn-C2H3C(O)NH2, v=0
  759828.6246  0.0025 -3.1899 3  600.7353129  71510 303642243      632142        syn-C2H3C(O)NH2, v=0
  759855.6686  0.0025 -3.1899 3  600.7346129  71510 303642242      632143        syn-C2H3C(O)NH2, v=0
  759921.0456  0.0038 -5.3620 3  343.8010107  71510 30353 845      53 548        syn-C2H3C(O)NH2, v=0
  759923.7861  0.0038 -5.3620 3  343.8010107  71510 30353 945      53 648        syn-C2H3C(O)NH2, v=0
  759960.7662  0.0031 -4.0233 3  247.3138 93  71510 30346 640      45 541        syn-C2H3C(O)NH2, v=0
  759961.6564  0.0031 -4.0233 3  247.3138 93  71510 30346 740      45 441        syn-C2H3C(O)NH2, v=0
  760134.8571  0.1222 -5.2737 3 1703.6005183  71510 303915536      915437        syn-C2H3C(O)NH2, v=0
  760134.8571  0.1222 -5.2737 3 1703.6005183  71510 303915537      915438        syn-C2H3C(O)NH2, v=0
  760377.9821  0.0926 -4.8163 3 1432.7979205  71510 303A22478      A12577        syn-C2H3C(O)NH2, v=0
  760390.1715  0.0741 -4.6008 3 1473.8402213  71510 303A61987      A52086        syn-C2H3C(O)NH2, v=0
  760390.3863  0.0741 -4.6008 3 1473.8402213  71510 303A62087      A51986        syn-C2H3C(O)NH2, v=0
  760459.7923  0.1216 -5.2378 3 1681.4559181  71510 303905535      905436        syn-C2H3C(O)NH2, v=0
  760459.7923  0.1216 -5.2378 3 1681.4559181  71510 303905536      905437        syn-C2H3C(O)NH2, v=0
  760550.9195  0.0027 -4.2527 3  237.9060 85  71510 303421329      411032        syn-C2H3C(O)NH2, v=0
  760582.1993  0.0026 -3.7643 3  301.9171 99  71510 30349 940      48 841        syn-C2H3C(O)NH2, v=0
  760591.7844  0.0077 -3.6097 3  619.2370135  71510 303671849      661750        syn-C2H3C(O)NH2, v=0
  760695.0897  0.0021 -4.6146 3  175.4770 71  71510 303351421      341124        syn-C2H3C(O)NH2, v=0
  760775.9634  0.1211 -5.2028 3 1659.5578179  71510 303895534      895435        syn-C2H3C(O)NH2, v=0
  760775.9634  0.1211 -5.2028 3 1659.5578179  71510 303895535      895436        syn-C2H3C(O)NH2, v=0
  760856.0676  0.0321 -5.1446 3  935.1729165  71510 303822261      821964        syn-C2H3C(O)NH2, v=0
  760888.8195  0.0026 -3.7640 3  301.9169 99  71510 303491040      48 741        syn-C2H3C(O)NH2, v=0
  760932.5445  0.0023 -5.1604 3  311.2445 89  71510 303442024      441727        syn-C2H3C(O)NH2, v=0
  760933.4002  0.0023 -5.1604 3  311.2445 89  71510 303442025      441728        syn-C2H3C(O)NH2, v=0
  760944.7234  0.0034 -3.3228 3  641.1404135  71510 303672146      662047        syn-C2H3C(O)NH2, v=0
  761083.5540  0.1206 -5.1686 3 1637.9060177  71510 303885533      885434        syn-C2H3C(O)NH2, v=0
  761083.5540  0.1206 -5.1686 3 1637.9060177  71510 303885534      885435        syn-C2H3C(O)NH2, v=0
  761185.0456  0.4507 -5.6543 3 1744.7744225  71510 303B22884      B12983        syn-C2H3C(O)NH2, v=0
  761317.4153  0.0712 -4.6152 3 1462.3089211  71510 303A52085      A42184        syn-C2H3C(O)NH2, v=0
  761321.1605  0.0712 -4.6152 3 1462.3088211  71510 303A52185      A42084        syn-C2H3C(O)NH2, v=0
  761382.7445  0.1202 -5.1352 3 1616.5005175  71510 303875532      875433        syn-C2H3C(O)NH2, v=0
  761382.7445  0.1202 -5.1352 3 1616.5005175  71510 303875533      875434        syn-C2H3C(O)NH2, v=0
  761586.5145  0.0042 -5.0881 3  448.0426119  71510 303591148      59 851        syn-C2H3C(O)NH2, v=0
  761595.6614  0.0023 -4.5630 3  184.3820 73  71510 303361423      351124        syn-C2H3C(O)NH2, v=0
  761636.1636  0.0028 -3.9158 3  265.2777 95  71510 30347 740      46 641        syn-C2H3C(O)NH2, v=0
  761643.5058  0.0028 -3.9158 3  265.2777 95  71510 30347 840      46 541        syn-C2H3C(O)NH2, v=0
  761673.7125  0.1199 -5.1028 3 1595.3412173  71510 303865531      865432        syn-C2H3C(O)NH2, v=0
  761673.7125  0.1199 -5.1028 3 1595.3412173  71510 303865532      865433        syn-C2H3C(O)NH2, v=0
  761717.0489  0.0041 -5.0880 3  448.0426119  71510 303591248      59 951        syn-C2H3C(O)NH2, v=0
  761882.3116  0.0037 -5.2484 3  377.2922111  71510 30355 946      55 649        syn-C2H3C(O)NH2, v=0
  761893.1141  0.0037 -5.2483 3  377.2922111  71510 303551046      55 749        syn-C2H3C(O)NH2, v=0
  761956.6323  0.1196 -5.0712 3 1574.4280171  71510 303855530      855431        syn-C2H3C(O)NH2, v=0
  761956.6323  0.1196 -5.0712 3 1574.4280171  71510 303855531      855432        syn-C2H3C(O)NH2, v=0
  761986.5172  0.0026 -3.8311 3  283.4847 97  71510 30348 840      47 741        syn-C2H3C(O)NH2, v=0
  762037.8632  0.0026 -3.8311 3  283.4847 97  71510 30348 940      47 641        syn-C2H3C(O)NH2, v=0
  762069.3308  0.0049 -5.2430 3  145.6011 69  71510 303341025      33 528        syn-C2H3C(O)NH2, v=0
  762103.3329  0.0060 -5.0645 3  186.7522 87  71510 30343 241      42 142        syn-C2H3C(O)NH2, v=0
  762103.3329  0.0060 -5.0645 3  186.7522 87  71510 30343 341      42 042        syn-C2H3C(O)NH2, v=0
  762165.2461  0.0060 -5.4853 3  132.9656 67  71510 30333 925      32 428        syn-C2H3C(O)NH2, v=0
  762231.6759  0.1193 -5.0406 3 1553.7607169  71510 303845529      845430        syn-C2H3C(O)NH2, v=0
  762231.6759  0.1193 -5.0406 3 1553.7607169  71510 303845530      845431        syn-C2H3C(O)NH2, v=0
  762494.8969  0.0039 -5.1586 3  412.0426115  71510 303571047      57 750        syn-C2H3C(O)NH2, v=0
  762499.0119  0.1191 -5.0109 3 1533.3392167  71510 303835528      835429        syn-C2H3C(O)NH2, v=0
  762499.0119  0.1191 -5.0109 3 1533.3392167  71510 303835529      835430        syn-C2H3C(O)NH2, v=0
  762533.9673  0.0039 -5.1586 3  412.0426115  71510 303571147      57 850        syn-C2H3C(O)NH2, v=0
  762550.5283  0.0030 -4.4185 3  212.7279 79  71510 303391426      381127        syn-C2H3C(O)NH2, v=0
  762587.6763  0.0685 -4.6341 3 1449.9642209  71510 303A42183      A32282        syn-C2H3C(O)NH2, v=0
  762643.1256  0.0684 -4.6340 3 1449.9630209  71510 303A42283      A32182        syn-C2H3C(O)NH2, v=0
  762729.8999  0.0068 -3.6795 3  487.8684121  71510 303601545      591446        syn-C2H3C(O)NH2, v=0
  762758.8067  0.1190 -4.9822 3 1513.1636165  71510 303825527      825428        syn-C2H3C(O)NH2, v=0
  762758.8067  0.1190 -4.9822 3 1513.1636165  71510 303825528      825429        syn-C2H3C(O)NH2, v=0
  762787.8626  0.0289 -5.1073 3  885.4003161  71510 303802160      801863        syn-C2H3C(O)NH2, v=0
  762853.5254  0.0021 -3.1092 3  578.9442125  71510 303622340      612239        syn-C2H3C(O)NH2, v=0
  762854.1743  0.0021 -3.1092 3  578.9442125  71510 303622339      612240        syn-C2H3C(O)NH2, v=0
  763011.2235  0.1189 -4.9546 3 1493.2336163  71510 303815526      815427        syn-C2H3C(O)NH2, v=0
  763011.2235  0.1189 -4.9546 3 1493.2336163  71510 303815527      815428        syn-C2H3C(O)NH2, v=0
  763144.4671  0.0060 -4.9810 3  620.6462137  71510 303681653      681356        syn-C2H3C(O)NH2, v=0
  763229.2791  0.0023 -5.2004 3  300.3247 87  71510 303432023      431726        syn-C2H3C(O)NH2, v=0
  763229.6722  0.0023 -5.2004 3  300.3247 87  71510 303432024      431727        syn-C2H3C(O)NH2, v=0
  763256.4232  0.1188 -4.9280 3 1473.5492161  71510 303805525      805426        syn-C2H3C(O)NH2, v=0
  763256.4232  0.1188 -4.9280 3 1473.5492161  71510 303805526      805427        syn-C2H3C(O)NH2, v=0
  763261.8691  0.0025 -4.5127 3  193.5227 75  71510 303371424      361125        syn-C2H3C(O)NH2, v=0
  763485.7285  0.0031 -4.9168 3  484.6734115  71510 303572136      571839        syn-C2H3C(O)NH2, v=0
  763494.5641  0.1188 -4.9026 3 1454.1102159  71510 303795524      795425        syn-C2H3C(O)NH2, v=0
  763494.5641  0.1188 -4.9026 3 1454.1102159  71510 303795525      795426        syn-C2H3C(O)NH2, v=0
  763524.7383  0.0539 -4.6153 3 1346.3997199  71510 303992476      982375        syn-C2H3C(O)NH2, v=0
  763534.3854  0.0104 -5.0109 3  747.5525145  71510 303722349      722052        syn-C2H3C(O)NH2, v=0
  763569.1998  0.1475 -4.9972 3 1494.8563209  71510 303A42579      A32678        syn-C2H3C(O)NH2, v=0
  763672.8549  0.0027 -4.4648 3  202.9678 77  71510 303381425      371126        syn-C2H3C(O)NH2, v=0
  763725.8017  0.1188 -4.8783 3 1434.9167157  71510 303785523      785424        syn-C2H3C(O)NH2, v=0
  763725.8017  0.1188 -4.8783 3 1434.9167157  71510 303785524      785425        syn-C2H3C(O)NH2, v=0
  763869.4979  0.0075 -2.6148 3  442.3121 73  71510 3033636 0      3535 1        syn-C2H3C(O)NH2, v=0
  763869.4979  0.0075 -2.6148 3  442.3121 73  71510 3033636 1      3535 0        syn-C2H3C(O)NH2, v=0
  763911.4329  0.1171 -4.5581 3 1583.0765237  71510 303B8 8B0      B7 9A9        syn-C2H3C(O)NH2, v=0
  763911.4329  0.1171 -4.5581 3 1583.0765237  71510 303B8 9B0      B7 8A9        syn-C2H3C(O)NH2, v=0
  763912.1373  0.1215 -4.5506 3 1587.2718239  71510 303B9 7B2      B8 8B1        syn-C2H3C(O)NH2, v=0
  763912.1373  0.1215 -4.5506 3 1587.2718239  71510 303B9 8B2      B8 7B1        syn-C2H3C(O)NH2, v=0
  763920.6302  0.1265 -4.5428 3 1590.9347241  71510 303C0 6B4      B9 7B3        syn-C2H3C(O)NH2, v=0
  763920.6302  0.1265 -4.5428 3 1590.9347241  71510 303C0 7B4      B9 6B3        syn-C2H3C(O)NH2, v=0
  763921.6652  0.0031 -4.9163 3  484.6588115  71510 303572137      571840        syn-C2H3C(O)NH2, v=0
  763921.7045  0.1129 -4.5651 3 1578.3429235  71510 303B7 9A8      B610A7        syn-C2H3C(O)NH2, v=0
  763921.7045  0.1129 -4.5651 3 1578.3429235  71510 303B710A8      B6 9A7        syn-C2H3C(O)NH2, v=0
  763934.2616  0.1321 -4.5344 3 1594.0701243  71510 303C1 5B6      C0 6B5        syn-C2H3C(O)NH2, v=0
  763934.2616  0.1321 -4.5344 3 1594.0701243  71510 303C1 6B6      C0 5B5        syn-C2H3C(O)NH2, v=0
  763938.0737  0.0551 -4.5902 3 1321.3795197  71510 303982475      972374        syn-C2H3C(O)NH2, v=0
  763942.3735  0.0130 -3.7622 3  805.2613153  71510 303762156      752055        syn-C2H3C(O)NH2, v=0
  763946.8214  0.1091 -4.5718 3 1573.0645233  71510 303B610A6      B511A5        syn-C2H3C(O)NH2, v=0
  763946.8214  0.1091 -4.5718 3 1573.0645233  71510 303B611A6      B510A5        syn-C2H3C(O)NH2, v=0
  763950.2893  0.1188 -4.8552 3 1415.9685155  71510 303775522      775423        syn-C2H3C(O)NH2, v=0
  763950.2893  0.1188 -4.8552 3 1415.9685155  71510 303775523      775424        syn-C2H3C(O)NH2, v=0
  763950.8099  0.1385 -4.5254 3 1596.6823245  71510 303C2 4B8      C1 5B7        syn-C2H3C(O)NH2, v=0
  763950.8099  0.1385 -4.5254 3 1596.6823245  71510 303C2 5B8      C1 4B7        syn-C2H3C(O)NH2, v=0
  763968.3979  0.1460 -4.5160 3 1598.7752247  71510 303C3 3C0      C2 4B9        syn-C2H3C(O)NH2, v=0
  763968.3979  0.1460 -4.5160 3 1598.7752247  71510 303C3 4C0      C2 3B9        syn-C2H3C(O)NH2, v=0
  763985.4277  0.1549 -4.5059 3 1600.3520249  71510 303C4 2C2      C3 3C1        syn-C2H3C(O)NH2, v=0
  763985.4277  0.1549 -4.5059 3 1600.3520249  71510 303C4 3C2      C3 2C1        syn-C2H3C(O)NH2, v=0
  763991.5263  0.1053 -4.5783 3 1567.2338231  71510 303B511A4      B412A3        syn-C2H3C(O)NH2, v=0
  763991.5263  0.1053 -4.5783 3 1567.2338231  71510 303B512A4      B411A3        syn-C2H3C(O)NH2, v=0
  764000.5287  0.1655 -4.4952 3 1601.4157251  71510 303C5 1C4      C4 2C3        syn-C2H3C(O)NH2, v=0
  764000.5287  0.1655 -4.4952 3 1601.4157251  71510 303C5 2C4      C4 1C3        syn-C2H3C(O)NH2, v=0
  764012.5175  0.1781 -4.4838 3 1601.9689253  71510 303C6 0C6      C5 1C5        syn-C2H3C(O)NH2, v=0
  764012.5175  0.1781 -4.4838 3 1601.9689253  71510 303C6 1C6      C5 0C5        syn-C2H3C(O)NH2, v=0
  764061.6979  0.1017 -4.5846 3 1560.8417229  71510 303B412A2      B313A1        syn-C2H3C(O)NH2, v=0
  764061.6979  0.1017 -4.5846 3 1560.8417229  71510 303B413A2      B312A1        syn-C2H3C(O)NH2, v=0
  764092.0658  0.0670 -4.7052 3 1422.4551205  71510 303A22379      A12478        syn-C2H3C(O)NH2, v=0
  764159.0378  0.0661 -4.6608 3 1436.7163207  71510 303A32281      A22380        syn-C2H3C(O)NH2, v=0
  764164.7135  0.0982 -4.5908 3 1553.8781227  71510 303B313A0      B21499        syn-C2H3C(O)NH2, v=0
  764164.7135  0.0982 -4.5908 3 1553.8781227  71510 303B314A0      B21399        syn-C2H3C(O)NH2, v=0
  764168.1775  0.1189 -4.8334 3 1397.2654153  71510 303765521      765422        syn-C2H3C(O)NH2, v=0
  764168.1775  0.1189 -4.8334 3 1397.2654153  71510 303765522      765423        syn-C2H3C(O)NH2, v=0
  764309.9636  0.0947 -4.5971 3 1546.3307225  71510 303B21498      B11597        syn-C2H3C(O)NH2, v=0
  764309.9636  0.0947 -4.5971 3 1546.3307225  71510 303B21598      B11497        syn-C2H3C(O)NH2, v=0
  764313.9503  0.0058 -2.6323 3  443.7990 77  71510 3033835 3      3734 4        syn-C2H3C(O)NH2, v=0
  764313.9503  0.0058 -2.6323 3  443.7990 77  71510 3033835 4      3734 3        syn-C2H3C(O)NH2, v=0
  764379.6146  0.1190 -4.8130 3 1378.8075151  71510 303755520      755421        syn-C2H3C(O)NH2, v=0
  764379.6146  0.1190 -4.8130 3 1378.8075151  71510 303755521      755422        syn-C2H3C(O)NH2, v=0
  764452.7766  0.0022 -5.2717 3  119.9114 55  71510 303271513      261214        syn-C2H3C(O)NH2, v=0
  764453.0925  0.0022 -5.2717 3  119.9114 55  71510 303271512      261215        syn-C2H3C(O)NH2, v=0
  764509.6018  0.0913 -4.6036 3 1538.1850223  71510 303B11596      B01695        syn-C2H3C(O)NH2, v=0
  764509.6018  0.0913 -4.6036 3 1538.1850223  71510 303B11696      B01595        syn-C2H3C(O)NH2, v=0
  764530.4563  0.0045 -5.3915 3  382.6089105  71510 303521735      521240        syn-C2H3C(O)NH2, v=0
  764564.3443  0.0073 -3.5735 3  660.4890139  71510 303691950      681851        syn-C2H3C(O)NH2, v=0
  764584.7464  0.1192 -4.7940 3 1360.5946149  71510 303745519      745420        syn-C2H3C(O)NH2, v=0
  764584.7464  0.1192 -4.7940 3 1360.5946149  71510 303745520      745421        syn-C2H3C(O)NH2, v=0
  764636.2250  0.0038 -3.3610 3  658.1402137  71510 303682148      672047        syn-C2H3C(O)NH2, v=0
  764647.9457  0.0329 -4.0643 3  956.2346167  71510 303832262      822161        syn-C2H3C(O)NH2, v=0
  764662.1851  0.0020 -3.0402 3  558.9622121  71510 303602437      592336        syn-C2H3C(O)NH2, v=0
  764662.1958  0.0020 -3.0402 3  558.9622121  71510 303602436      592337        syn-C2H3C(O)NH2, v=0
  764662.8477  0.0022 -4.5609 3  184.2799 73  71510 303361422      351125        syn-C2H3C(O)NH2, v=0
  764749.2837  0.0045 -2.6522 3  446.7499 81  71510 3034034 6      3933 7        syn-C2H3C(O)NH2, v=0
  764749.2837  0.0045 -2.6522 3  446.7499 81  71510 3034034 7      3933 6        syn-C2H3C(O)NH2, v=0
  764779.6699  0.0879 -4.6106 3 1529.4236221  71510 303B01694      A91793        syn-C2H3C(O)NH2, v=0
  764779.6700  0.0879 -4.6106 3 1529.4236221  71510 303B01794      A91693        syn-C2H3C(O)NH2, v=0
  764783.7165  0.1194 -4.7765 3 1342.6267147  71510 303735518      735419        syn-C2H3C(O)NH2, v=0
  764783.7165  0.1194 -4.7765 3 1342.6267147  71510 303735519      735420        syn-C2H3C(O)NH2, v=0
  764803.5171  0.0550 -4.6413 3 1371.5556201  71510 303A02477      992376        syn-C2H3C(O)NH2, v=0
  764842.8684  0.0655 -4.6600 3 1436.7022207  71510 303A32381      A22280        syn-C2H3C(O)NH2, v=0
  764976.6662  0.1196 -4.7608 3 1324.9036145  71510 303725517      725418        syn-C2H3C(O)NH2, v=0
  764976.6662  0.1196 -4.7608 3 1324.9036145  71510 303725518      725419        syn-C2H3C(O)NH2, v=0
  765043.9391  0.1710 -5.5311 3 1172.5969185  71510 303922369      922072        syn-C2H3C(O)NH2, v=0
  765141.8512  0.0846 -4.6184 3 1520.0252219  71510 303A91792      A81891        syn-C2H3C(O)NH2, v=0
  765141.8515  0.0846 -4.6184 3 1520.0252219  71510 303A91892      A81791        syn-C2H3C(O)NH2, v=0
  765163.7343  0.1198 -4.7468 3 1307.4253143  71510 303715516      715417        syn-C2H3C(O)NH2, v=0
  765163.7343  0.1198 -4.7468 3 1307.4253143  71510 303715517      715418        syn-C2H3C(O)NH2, v=0
  765169.5518  0.0035 -2.6747 3  451.1702 85  71510 3034233 9      413210        syn-C2H3C(O)NH2, v=0
  765169.5518  0.0035 -2.6747 3  451.1702 85  71510 303423310      4132 9        syn-C2H3C(O)NH2, v=0
  765319.6843  0.0047 -4.9191 3  633.3110133  71510 303662245      661948        syn-C2H3C(O)NH2, v=0
  765345.0575  0.1201 -4.7348 3 1290.1917141  71510 303705515      705416        syn-C2H3C(O)NH2, v=0
  765345.0575  0.1201 -4.7348 3 1290.1917141  71510 303705516      705417        syn-C2H3C(O)NH2, v=0
  765353.1592  0.0023 -5.2430 3  289.6650 85  71510 303422022      421725        syn-C2H3C(O)NH2, v=0
  765353.3356  0.0023 -5.2430 3  289.6650 85  71510 303422023      421726        syn-C2H3C(O)NH2, v=0
  765520.7702  0.1204 -4.7249 3 1273.2027139  71510 303695514      695415        syn-C2H3C(O)NH2, v=0
  765520.7702  0.1204 -4.7249 3 1273.2027139  71510 303695515      695416        syn-C2H3C(O)NH2, v=0
  765555.8729  0.0331 -5.1956 3  986.0727169  71510 303842362      842065        syn-C2H3C(O)NH2, v=0
  765566.3003  0.0027 -2.7000 3  457.0667 89  71510 303443212      433113        syn-C2H3C(O)NH2, v=0
  765566.3003  0.0027 -2.7000 3  457.0667 89  71510 303443213      433112        syn-C2H3C(O)NH2, v=0
  765626.3272  0.0814 -4.6274 3 1509.9632217  71510 303A81890      A71989        syn-C2H3C(O)NH2, v=0
  765626.3331  0.0814 -4.6274 3 1509.9632217  71510 303A81990      A71889        syn-C2H3C(O)NH2, v=0
  765691.0049  0.1207 -4.7174 3 1256.4582137  71510 303685513      685414        syn-C2H3C(O)NH2, v=0
  765691.0049  0.1207 -4.7174 3 1256.4582137  71510 303685514      685415        syn-C2H3C(O)NH2, v=0
  765728.0376  0.0019 -2.9796 3  540.6935117  71510 303582534      572433        syn-C2H3C(O)NH2, v=0
  765728.0377  0.0019 -2.9796 3  540.6935117  71510 303582533      572434        syn-C2H3C(O)NH2, v=0
  765855.8914  0.1211 -4.7126 3 1239.9582135  71510 303675512      675413        syn-C2H3C(O)NH2, v=0
  765855.8914  0.1211 -4.7126 3 1239.9582135  71510 303675513      675414        syn-C2H3C(O)NH2, v=0
  765890.8086  0.0097 -5.0062 3  784.4410149  71510 303742352      742055        syn-C2H3C(O)NH2, v=0
  765927.6248  0.0023 -2.7284 3  464.4475 93  71510 303463115      453016        syn-C2H3C(O)NH2, v=0
  765927.6248  0.0023 -2.7284 3  464.4475 93  71510 303463116      453015        syn-C2H3C(O)NH2, v=0
  766015.5579  0.1215 -4.7108 3 1223.7026133  71510 303665511      665412        syn-C2H3C(O)NH2, v=0
  766015.5579  0.1215 -4.7108 3 1223.7026133  71510 303665512      665413        syn-C2H3C(O)NH2, v=0
  766065.6297  0.0028 -3.2199 3  616.7724131  71510 303652244      642143        syn-C2H3C(O)NH2, v=0
  766115.9498  0.0028 -3.2198 3  616.7710131  71510 303652243      642144        syn-C2H3C(O)NH2, v=0
  766170.1301  0.1219 -4.7125 3 1207.6913131  71510 303655510      655411        syn-C2H3C(O)NH2, v=0
  766170.1301  0.1219 -4.7125 3 1207.6913131  71510 303655511      655412        syn-C2H3C(O)NH2, v=0
  766236.8307  0.0021 -2.7600 3  473.3226 97  71510 303483018      472919        syn-C2H3C(O)NH2, v=0
  766236.8307  0.0021 -2.7600 3  473.3226 97  71510 303483019      472918        syn-C2H3C(O)NH2, v=0
  766276.6665  0.0783 -4.6381 3 1499.2041215  71510 303A71988      A62087        syn-C2H3C(O)NH2, v=0
  766276.7885  0.0783 -4.6381 3 1499.2041215  71510 303A72088      A61987        syn-C2H3C(O)NH2, v=0
  766309.5929  0.0019 -2.9258 3  524.0739113  71510 303562630      552531        syn-C2H3C(O)NH2, v=0
  766309.5929  0.0019 -2.9258 3  524.0739113  71510 303562631      552530        syn-C2H3C(O)NH2, v=0
  766319.7317  0.1223 -4.7182 3 1191.9242129  71510 3036455 9      645410        syn-C2H3C(O)NH2, v=0
  766319.7317  0.1223 -4.7182 3 1191.9242129  71510 303645510      645411        syn-C2H3C(O)NH2, v=0
  766464.4845  0.1227 -4.7287 3 1176.4012127  71510 3036355 8      6354 9        syn-C2H3C(O)NH2, v=0
  766464.4845  0.1227 -4.7287 3 1176.4012127  71510 3036355 9      635410        syn-C2H3C(O)NH2, v=0
  766470.4864  0.0020 -2.7952 3  483.7047101  71510 303502921      492822        syn-C2H3C(O)NH2, v=0
  766470.4864  0.0020 -2.7952 3  483.7047101  71510 303502922      492821        syn-C2H3C(O)NH2, v=0
  766477.2316  0.0590 -4.5659 3 1296.4844195  71510 303972474      962373        syn-C2H3C(O)NH2, v=0
  766564.7280  0.0019 -2.8776 3  509.0573109  71510 303542727      532628        syn-C2H3C(O)NH2, v=0
  766564.7280  0.0019 -2.8776 3  509.0573109  71510 303542728      532627        syn-C2H3C(O)NH2, v=0
  766595.5178  0.0020 -2.8343 3  495.6095105  71510 303522824      512725        syn-C2H3C(O)NH2, v=0
  766595.5178  0.0020 -2.8343 3  495.6095105  71510 303522825      512724        syn-C2H3C(O)NH2, v=0
  766604.5079  0.1232 -4.7451 3 1161.1224125  71510 3036255 7      6254 8        syn-C2H3C(O)NH2, v=0
  766604.5079  0.1232 -4.7451 3 1161.1224125  71510 3036255 8      6254 9        syn-C2H3C(O)NH2, v=0
  766688.0384  0.0054 -5.2084 3  451.9565115  71510 303571740      571245        syn-C2H3C(O)NH2, v=0
  766739.9196  0.1236 -4.7687 3 1146.0875123  71510 3036155 6      6154 7        syn-C2H3C(O)NH2, v=0
  766739.9196  0.1236 -4.7687 3 1146.0875123  71510 3036155 7      6154 8        syn-C2H3C(O)NH2, v=0
  766832.9239  0.0038 -3.3588 3  658.0811137  71510 303682147      672048        syn-C2H3C(O)NH2, v=0
  766840.9623  0.0123 -5.0124 3  725.0075147  71510 303731856      731559        syn-C2H3C(O)NH2, v=0
  766870.8351  0.1241 -4.8017 3 1131.2965121  71510 3036055 5      6054 6        syn-C2H3C(O)NH2, v=0
  766870.8351  0.1241 -4.8017 3 1131.2965121  71510 3036055 6      6054 7        syn-C2H3C(O)NH2, v=0
  766937.8792  0.0079 -3.6589 3  579.2392131  71510 303651748      641649        syn-C2H3C(O)NH2, v=0
  766997.3679  0.1246 -4.8473 3 1116.7495119  71510 3035955 4      5954 5        syn-C2H3C(O)NH2, v=0
  766997.3679  0.1246 -4.8473 3 1116.7495119  71510 3035955 5      5954 6        syn-C2H3C(O)NH2, v=0
  767119.6296  0.1251 -4.9111 3 1102.4462117  71510 3035855 3      5854 4        syn-C2H3C(O)NH2, v=0
  767119.6296  0.1251 -4.9111 3 1102.4462117  71510 3035855 4      5854 5        syn-C2H3C(O)NH2, v=0
  767158.1925  0.0753 -4.6514 3 1487.7037213  71510 303A62086      A52185        syn-C2H3C(O)NH2, v=0
  767160.3718  0.0753 -4.6514 3 1487.7037213  71510 303A62186      A52085        syn-C2H3C(O)NH2, v=0
  767237.7297  0.1256 -5.0033 3 1088.3866115  71510 3035755 2      5754 3        syn-C2H3C(O)NH2, v=0
  767237.7297  0.1256 -5.0033 3 1088.3866115  71510 3035755 3      5754 4        syn-C2H3C(O)NH2, v=0
  767274.2501  0.0051 -4.6224 3  204.0144 89  71510 30344 341      43 242        syn-C2H3C(O)NH2, v=0
  767274.2504  0.0051 -4.6224 3  204.0144 89  71510 30344 441      43 142        syn-C2H3C(O)NH2, v=0
  767315.9925  0.0022 -5.2885 3  279.2643 83  71510 303412021      411724        syn-C2H3C(O)NH2, v=0
  767316.0696  0.0022 -5.2885 3  279.2643 83  71510 303412022      411725        syn-C2H3C(O)NH2, v=0
  767351.7758  0.1262 -5.1471 3 1074.5707113  71510 3035655 1      5654 2        syn-C2H3C(O)NH2, v=0
  767351.7758  0.1262 -5.1471 3 1074.5707113  71510 3035655 2      5654 3        syn-C2H3C(O)NH2, v=0
  767366.5211  0.0577 -4.6686 3 1396.8585203  71510 303A12478      A02377        syn-C2H3C(O)NH2, v=0
  767461.8736  0.1267 -5.4163 3 1060.9985111  71510 3035555 0      5554 1        syn-C2H3C(O)NH2, v=0
  767461.8736  0.1267 -5.4163 3 1060.9985111  71510 3035555 1      5554 2        syn-C2H3C(O)NH2, v=0
  767636.9177  0.0044 -4.3980 3  232.9225 85  71510 303421230      41 933        syn-C2H3C(O)NH2, v=0
  767953.2579  0.0030 -3.8225 3  369.2094105  71510 303521538      511239        syn-C2H3C(O)NH2, v=0
  768017.0232  0.0058 -3.5093 3  685.2110141  71510 303702050      691951        syn-C2H3C(O)NH2, v=0
  768116.1874  0.0067 -5.2836 3  431.0984113  71510 303561640      561145        syn-C2H3C(O)NH2, v=0
  768133.2024  0.0100 -5.0182 3  680.4863143  71510 303711655      711358        syn-C2H3C(O)NH2, v=0
  768259.0485  0.0046 -4.9266 3  616.6996131  71510 303652243      651946        syn-C2H3C(O)NH2, v=0
  768273.8047  0.0051 -5.0005 3  579.1321133  71510 303661452      661155        syn-C2H3C(O)NH2, v=0
  768365.1625  0.0724 -4.6689 3 1475.4021211  71510 303A52184      A42283        syn-C2H3C(O)NH2, v=0
  768398.3675  0.0724 -4.6688 3 1475.4014211  71510 303A52284      A42183        syn-C2H3C(O)NH2, v=0
  768458.9087  0.0022 -4.5097 3  193.3497 75  71510 303371423      361126        syn-C2H3C(O)NH2, v=0
  768632.1392  0.0030 -4.9318 3  470.3293113  71510 303562135      561838        syn-C2H3C(O)NH2, v=0
  768877.3335  0.0030 -4.9316 3  470.3211113  71510 303562136      561839        syn-C2H3C(O)NH2, v=0
  769109.1183  0.0032 -3.6886 3  351.6400105  71510 303521141      511042        syn-C2H3C(O)NH2, v=0
  769128.5923  0.0022 -5.3371 3  269.1219 81  71510 303402020      401723        syn-C2H3C(O)NH2, v=0
  769128.6252  0.0022 -5.3371 3  269.1219 81  71510 303402021      401724        syn-C2H3C(O)NH2, v=0
  769136.5840  0.0043 -3.4000 3  675.3986139  71510 303692149      682048        syn-C2H3C(O)NH2, v=0
  769240.3095  0.0032 -3.6594 3  371.0146107  71510 303531341      521042        syn-C2H3C(O)NH2, v=0
  769331.5622  0.0031 -3.6555 3  390.4700109  71510 303541441      531142        syn-C2H3C(O)NH2, v=0
  769367.9860  0.0240 -5.0809 3  836.7643157  71510 303782059      781762        syn-C2H3C(O)NH2, v=0
  769435.8486  0.0023 -3.1361 3  594.3909127  71510 303632341      622240        syn-C2H3C(O)NH2, v=0
  769437.1518  0.0023 -3.1361 3  594.3909127  71510 303632340      622241        syn-C2H3C(O)NH2, v=0
  769441.9259  0.0027 -3.7680 3  382.6089107  71510 303531539      521240        syn-C2H3C(O)NH2, v=0
  769748.7537  0.0033 -3.8894 3  355.9693103  71510 303511537      501238        syn-C2H3C(O)NH2, v=0
  769903.8608  0.1231 -4.6000 3 1608.5578239  71510 303B9 8B1      B8 9B0        syn-C2H3C(O)NH2, v=0
  769903.8608  0.1231 -4.6000 3 1608.5578239  71510 303B9 9B1      B8 8B0        syn-C2H3C(O)NH2, v=0
  769905.5747  0.1278 -4.5928 3 1612.7532241  71510 303C0 7B3      B9 8B2        syn-C2H3C(O)NH2, v=0
  769905.5747  0.1278 -4.5928 3 1612.7532241  71510 303C0 8B3      B9 7B2        syn-C2H3C(O)NH2, v=0
  769912.7624  0.1188 -4.6069 3 1603.8246237  71510 303B8 9A9      B710A8        syn-C2H3C(O)NH2, v=0
  769912.7624  0.1188 -4.6069 3 1603.8246237  71510 303B810A9      B7 9A8        syn-C2H3C(O)NH2, v=0
  769914.7999  0.1329 -4.5850 3 1616.4164243  71510 303C1 6B5      C0 7B4        syn-C2H3C(O)NH2, v=0
  769914.7999  0.1329 -4.5850 3 1616.4164243  71510 303C1 7B5      C0 6B4        syn-C2H3C(O)NH2, v=0
  769927.0294  0.0698 -4.6932 3 1462.2146209  71510 303A42282      A32381        syn-C2H3C(O)NH2, v=0
  769928.9499  0.1388 -4.5768 3 1619.5522245  71510 303C2 5B7      C1 6B6        syn-C2H3C(O)NH2, v=0
  769928.9499  0.1388 -4.5768 3 1619.5522245  71510 303C2 6B7      C1 5B6        syn-C2H3C(O)NH2, v=0
  769936.0382  0.1147 -4.6134 3 1598.5471235  71510 303B710A7      B611A6        syn-C2H3C(O)NH2, v=0
  769936.0382  0.1147 -4.6134 3 1598.5471235  71510 303B711A7      B610A6        syn-C2H3C(O)NH2, v=0
  769945.8520  0.1455 -4.5680 3 1622.1650247  71510 303C3 4B9      C2 5B8        syn-C2H3C(O)NH2, v=0
  769945.8520  0.1455 -4.5680 3 1622.1650247  71510 303C3 5B9      C2 4B8        syn-C2H3C(O)NH2, v=0
  769963.6663  0.1534 -4.5587 3 1624.2584249  71510 303C4 3C1      C3 4C0        syn-C2H3C(O)NH2, v=0
  769963.6663  0.1534 -4.5587 3 1624.2584249  71510 303C4 4C1      C3 3C0        syn-C2H3C(O)NH2, v=0
  769978.2841  0.1108 -4.6196 3 1592.7178233  71510 303B611A5      B512A4        syn-C2H3C(O)NH2, v=0
  769978.2841  0.1108 -4.6196 3 1592.7178233  71510 303B612A5      B511A4        syn-C2H3C(O)NH2, v=0
  769980.8236  0.1626 -4.5487 3 1625.8358251  71510 303C5 2C3      C4 3C2        syn-C2H3C(O)NH2, v=0
  769980.8236  0.1626 -4.5487 3 1625.8358251  71510 303C5 3C3      C4 2C2        syn-C2H3C(O)NH2, v=0
  769995.9756  0.1736 -4.5381 3 1626.9000253  71510 303C6 1C5      C5 2C4        syn-C2H3C(O)NH2, v=0
  769995.9756  0.1736 -4.5381 3 1626.9000253  71510 303C6 2C5      C5 1C4        syn-C2H3C(O)NH2, v=0
  770007.9558  0.1866 -4.5268 3 1627.4536255  71510 303C7 0C7      C6 1C6        syn-C2H3C(O)NH2, v=0
  770007.9558  0.1866 -4.5268 3 1627.4536255  71510 303C7 1C7      C6 0C6        syn-C2H3C(O)NH2, v=0
  770045.1802  0.1071 -4.6257 3 1586.3281231  71510 303B512A3      B413A2        syn-C2H3C(O)NH2, v=0
  770045.1802  0.1071 -4.6257 3 1586.3281231  71510 303B513A3      B412A2        syn-C2H3C(O)NH2, v=0
  770143.8326  0.1034 -4.6316 3 1579.3679229  71510 303B413A1      B314A0        syn-C2H3C(O)NH2, v=0
  770143.8326  0.1034 -4.6316 3 1579.3679229  71510 303B414A1      B313A0        syn-C2H3C(O)NH2, v=0
  770165.8253  0.0546 -4.2943 3 1096.9668179  71510 303892367      882266        syn-C2H3C(O)NH2, v=0
  770251.4055  0.0049 -4.9986 3  579.1321133  71510 303661552      661255        syn-C2H3C(O)NH2, v=0
  770283.2549  0.0998 -4.6376 3 1571.8254227  71510 303B31499      B21598        syn-C2H3C(O)NH2, v=0
  770283.2549  0.0998 -4.6376 3 1571.8254227  71510 303B31599      B21498        syn-C2H3C(O)NH2, v=0
  770350.8283  0.0694 -4.6927 3 1462.2059209  71510 303A42382      A32281        syn-C2H3C(O)NH2, v=0
  770475.0657  0.0962 -4.6438 3 1563.6863225  71510 303B21597      B11696        syn-C2H3C(O)NH2, v=0
  770475.0657  0.0962 -4.6438 3 1563.6863225  71510 303B21697      B11596        syn-C2H3C(O)NH2, v=0
  770655.9628  0.0694 -4.7319 3 1448.0316207  71510 303A32380      A22479        syn-C2H3C(O)NH2, v=0
  770660.0873  0.0021 -5.1883 3  126.5763 57  71510 303281514      271215        syn-C2H3C(O)NH2, v=0
  770660.8887  0.0021 -5.1883 3  126.5763 57  71510 303281513      271216        syn-C2H3C(O)NH2, v=0
  770734.5285  0.0927 -4.6504 3 1554.9339223  71510 303B11695      B01794        syn-C2H3C(O)NH2, v=0
  770734.5285  0.0927 -4.6504 3 1554.9339223  71510 303B11795      B01694        syn-C2H3C(O)NH2, v=0
  770753.4302  0.0870 -4.8302 3 1458.6298207  71510 303A32479      A22578        syn-C2H3C(O)NH2, v=0
  770800.9150  0.0022 -5.3890 3  259.2367 79  71510 303392019      391722        syn-C2H3C(O)NH2, v=0
  770800.9287  0.0022 -5.3890 3  259.2367 79  71510 303392020      391723        syn-C2H3C(O)NH2, v=0
  770870.9503  0.0613 -4.6971 3 1422.3181205  71510 303A22479      A12378        syn-C2H3C(O)NH2, v=0
  770912.7203  0.0105 -3.7009 3  785.6662151  71510 303752155      742054        syn-C2H3C(O)NH2, v=0
  771082.1589  0.0893 -4.6577 3 1545.5475221  71510 303B01793      A91892        syn-C2H3C(O)NH2, v=0
  771082.1590  0.0893 -4.6577 3 1545.5475221  71510 303B01893      A91792        syn-C2H3C(O)NH2, v=0
  771122.5903  0.0074 -2.6260 3  451.0613 75  71510 3033736 1      3635 2        syn-C2H3C(O)NH2, v=0
  771122.5903  0.0074 -2.6260 3  451.0613 75  71510 3033736 2      3635 1        syn-C2H3C(O)NH2, v=0
  771126.9574  0.1430 -5.6756 3 1939.2550201  71510 303A05644      A05545        syn-C2H3C(O)NH2, v=0
  771126.9574  0.1430 -5.6756 3 1939.2550201  71510 303A05645      A05546        syn-C2H3C(O)NH2, v=0
  771294.3788  0.0202 -5.1826 3  973.4918167  71510 303832460      832163        syn-C2H3C(O)NH2, v=0
  771376.4107  0.0076 -5.4164 3  397.0121109  71510 303541539      541044        syn-C2H3C(O)NH2, v=0
  771396.9986  0.0228 -5.2054 3  994.8195169  71510 303842461      842164        syn-C2H3C(O)NH2, v=0
  771451.6935  0.0021 -3.0648 3  573.8439123  71510 303612438      602337        syn-C2H3C(O)NH2, v=0
  771451.7168  0.0021 -3.0648 3  573.8439123  71510 303612437      602338        syn-C2H3C(O)NH2, v=0
  771522.6631  0.0647 -4.5417 3 1271.7064193  71510 303962473      952372        syn-C2H3C(O)NH2, v=0
  771524.3484  0.1418 -5.6332 3 1914.9009199  71510 303995643      995544        syn-C2H3C(O)NH2, v=0
  771524.3484  0.1418 -5.6332 3 1914.9009199  71510 303995644      995545        syn-C2H3C(O)NH2, v=0
  771546.3171  0.0859 -4.6660 3 1535.5017219  71510 303A91891      A81990        syn-C2H3C(O)NH2, v=0
  771546.3203  0.0859 -4.6660 3 1535.5017219  71510 303A91991      A81890        syn-C2H3C(O)NH2, v=0
  771564.8131  0.0057 -2.6442 3  453.0406 79  71510 3033935 4      3834 5        syn-C2H3C(O)NH2, v=0
  771564.8131  0.0057 -2.6442 3  453.0406 79  71510 3033935 5      3834 4        syn-C2H3C(O)NH2, v=0
  771775.6480  0.0043 -4.3573 3  221.5701 91  71510 30345 441      44 342        syn-C2H3C(O)NH2, v=0
  771775.6518  0.0043 -4.3573 3  221.5701 91  71510 30345 541      44 242        syn-C2H3C(O)NH2, v=0
  771911.7060  0.1407 -5.5915 3 1890.7939197  71510 303985642      985543        syn-C2H3C(O)NH2, v=0
  771911.7060  0.1407 -5.5915 3 1890.7939197  71510 303985643      985544        syn-C2H3C(O)NH2, v=0
  771996.2741  0.0044 -2.6648 3  456.4854 83  71510 3034134 7      4033 8        syn-C2H3C(O)NH2, v=0
  771996.2741  0.0044 -2.6648 3  456.4854 83  71510 3034134 8      4033 7        syn-C2H3C(O)NH2, v=0
  772167.6019  0.0827 -4.6760 3 1524.7643217  71510 303A81989      A72088        syn-C2H3C(O)NH2, v=0
  772167.6709  0.0827 -4.6760 3 1524.7643217  71510 303A82089      A71988        syn-C2H3C(O)NH2, v=0
  772175.3451  0.0023 -4.4609 3  202.6850 77  71510 303381424      371127        syn-C2H3C(O)NH2, v=0
  772201.2730  0.0031 -3.2509 3  633.0815133  71510 303662245      652144        syn-C2H3C(O)NH2, v=0
  772289.2305  0.1397 -5.5505 3 1866.9340195  71510 303975641      975542        syn-C2H3C(O)NH2, v=0
  772289.2305  0.1397 -5.5505 3 1866.9340195  71510 303975642      975543        syn-C2H3C(O)NH2, v=0
  772293.4853  0.0031 -3.2508 3  633.0789133  71510 303662244      652145        syn-C2H3C(O)NH2, v=0
  772342.1691  0.0023 -5.4445 3  249.6079 77  71510 303382018      381721        syn-C2H3C(O)NH2, v=0
  772342.1746  0.0023 -5.4445 3  249.6079 77  71510 303382019      381722        syn-C2H3C(O)NH2, v=0
  772396.2598  0.0044 -4.9227 3  616.5613131  71510 303652244      651947        syn-C2H3C(O)NH2, v=0
  772410.4468  0.0034 -2.6881 3  461.4016 87  71510 303433310      423211        syn-C2H3C(O)NH2, v=0
  772410.4468  0.0034 -2.6881 3  461.4016 87  71510 303433311      423210        syn-C2H3C(O)NH2, v=0
  772655.2339  0.0020 -3.0024 3  555.0275119  71510 303592535      582434        syn-C2H3C(O)NH2, v=0
  772655.2342  0.0020 -3.0024 3  555.0275119  71510 303592534      582435        syn-C2H3C(O)NH2, v=0
  772657.1187  0.1388 -5.5103 3 1843.3209193  71510 303965640      965541        syn-C2H3C(O)NH2, v=0
  772657.1187  0.1388 -5.5103 3 1843.3209193  71510 303965641      965542        syn-C2H3C(O)NH2, v=0
  772780.8720  0.0043 -3.3965 3  675.3013139  71510 303692148      682049        syn-C2H3C(O)NH2, v=0
  772798.1155  0.0027 -2.7143 3  467.7961 91  71510 303453213      443114        syn-C2H3C(O)NH2, v=0
  772798.1155  0.0027 -2.7143 3  467.7961 91  71510 303453214      443113        syn-C2H3C(O)NH2, v=0
  772957.4745  0.0048 -3.4415 3  692.9584141  71510 303702150      692049        syn-C2H3C(O)NH2, v=0
  773006.4607  0.0795 -4.6884 3 1513.2934215  71510 303A72087      A62186        syn-C2H3C(O)NH2, v=0
  773007.7233  0.0795 -4.6884 3 1513.2934215  71510 303A72187      A62086        syn-C2H3C(O)NH2, v=0
  773015.5638  0.1380 -5.4708 3 1819.9547191  71510 303955639      955540        syn-C2H3C(O)NH2, v=0
  773015.5638  0.1380 -5.4708 3 1819.9547191  71510 303955640      955541        syn-C2H3C(O)NH2, v=0
  773146.3675  0.0023 -2.7436 3  475.6776 95  71510 303473116      463017        syn-C2H3C(O)NH2, v=0
  773146.3675  0.0023 -2.7436 3  475.6776 95  71510 303473117      463016        syn-C2H3C(O)NH2, v=0
  773186.5628  0.0185 -5.1631 3  952.3812165  71510 303822459      822162        syn-C2H3C(O)NH2, v=0
  773278.5159  0.0089 -5.0009 3  765.5723147  71510 303732351      732054        syn-C2H3C(O)NH2, v=0
  773332.2635  0.0019 -2.9470 3  537.8726115  71510 303572631      562532        syn-C2H3C(O)NH2, v=0
  773332.2635  0.0019 -2.9470 3  537.8726115  71510 303572632      562531        syn-C2H3C(O)NH2, v=0
  773358.5980  0.0029 -4.9485 3  456.2613111  71510 303552134      551837        syn-C2H3C(O)NH2, v=0
  773364.7561  0.1372 -5.4321 3 1796.8352189  71510 303945638      945539        syn-C2H3C(O)NH2, v=0
  773364.7561  0.1372 -5.4321 3 1796.8352189  71510 303945639      945540        syn-C2H3C(O)NH2, v=0
  773406.5234  0.0030 -3.6853 3  351.6366105  71510 303521241      51 942        syn-C2H3C(O)NH2, v=0
  773437.1555  0.0021 -2.7763 3  485.0567 99  71510 303493019      482920        syn-C2H3C(O)NH2, v=0
  773437.1555  0.0021 -2.7763 3  485.0567 99  71510 303493020      482919        syn-C2H3C(O)NH2, v=0
  773494.0203  0.0029 -4.9484 3  456.2567111  71510 303552135      551838        syn-C2H3C(O)NH2, v=0
  773645.2020  0.0020 -2.8126 3  495.9466103  71510 303512922      502823        syn-C2H3C(O)NH2, v=0
  773645.2020  0.0020 -2.8126 3  495.9466103  71510 303512923      502822        syn-C2H3C(O)NH2, v=0
  773655.2256  0.0019 -2.8974 3  522.3302111  71510 303552728      542629        syn-C2H3C(O)NH2, v=0
  773655.2256  0.0019 -2.8974 3  522.3302111  71510 303552729      542628        syn-C2H3C(O)NH2, v=0
  773701.2065  0.0267 -5.2317 3 1016.3571171  71510 303852462      852165        syn-C2H3C(O)NH2, v=0
  773704.8825  0.1365 -5.3941 3 1773.9623187  71510 303935637      935538        syn-C2H3C(O)NH2, v=0
  773704.8825  0.1365 -5.3941 3 1773.9623187  71510 303935638      935539        syn-C2H3C(O)NH2, v=0
  773734.8574  0.0020 -2.8528 3  508.3640107  71510 303532825      522726        syn-C2H3C(O)NH2, v=0
  773734.8574  0.0020 -2.8528 3  508.3640107  71510 303532826      522725        syn-C2H3C(O)NH2, v=0
  773760.9045  0.0023 -5.5039 3  240.2348 75  71510 303372017      371720        syn-C2H3C(O)NH2, v=0
  773760.9067  0.0023 -5.5039 3  240.2348 75  71510 303372018      371721        syn-C2H3C(O)NH2, v=0
  774001.4558  0.1276 -5.4372 3 1094.4984179  71510 303892267      891970        syn-C2H3C(O)NH2, v=0
  774036.1267  0.1358 -5.3570 3 1751.3359185  71510 303925636      925537        syn-C2H3C(O)NH2, v=0
  774036.1267  0.1358 -5.3570 3 1751.3359185  71510 303925637      925538        syn-C2H3C(O)NH2, v=0
  774124.7867  0.0030 -4.2558 3  248.3674 87  71510 303431330      421033        syn-C2H3C(O)NH2, v=0
  774152.3882  0.0765 -4.7045 3 1501.0324213  71510 303A62185      A52284        syn-C2H3C(O)NH2, v=0
  774172.1672  0.0765 -4.7045 3 1501.0320213  71510 303A62285      A52184        syn-C2H3C(O)NH2, v=0
  774314.1492  0.0027 -3.7280 3  396.1605109  71510 303541540      531241        syn-C2H3C(O)NH2, v=0
  774358.6696  0.1352 -5.3207 3 1728.9558183  71510 303915635      915536        syn-C2H3C(O)NH2, v=0
  774358.6696  0.1352 -5.3207 3 1728.9558183  71510 303915636      915537        syn-C2H3C(O)NH2, v=0
  774420.1167  0.0060 -3.6874 3  452.0507117  71510 303581444      571345        syn-C2H3C(O)NH2, v=0
  774422.5685  0.0037 -3.9638 3  342.9048101  71510 303501536      491237        syn-C2H3C(O)NH2, v=0
  774672.6890  0.1347 -5.2851 3 1706.8221181  71510 303905634      905535        syn-C2H3C(O)NH2, v=0
  774672.6890  0.1347 -5.2851 3 1706.8221181  71510 303905635      905536        syn-C2H3C(O)NH2, v=0
  774921.9286  0.0205 -5.1204 3  851.3160155  71510 303772453      772156        syn-C2H3C(O)NH2, v=0
  774946.9685  0.0046 -5.0272 3  538.8278129  71510 303641351      641054        syn-C2H3C(O)NH2, v=0
  774978.3596  0.1342 -5.2504 3 1684.9345179  71510 303895633      895534        syn-C2H3C(O)NH2, v=0
  774978.3596  0.1342 -5.2504 3 1684.9345179  71510 303895634      895535        syn-C2H3C(O)NH2, v=0
  775048.7808  0.0653 -4.7267 3 1447.9425207  71510 303A32480      A22379        syn-C2H3C(O)NH2, v=0
  775065.0867  0.0023 -5.5675 3  231.1167 73  71510 303362016      361719        syn-C2H3C(O)NH2, v=0
  775065.0875  0.0023 -5.5675 3  231.1167 73  71510 303362017      361720        syn-C2H3C(O)NH2, v=0
  775111.8097  0.0047 -5.4880 3  369.2094103  71510 303511734      511239        syn-C2H3C(O)NH2, v=0
  775275.8537  0.1338 -5.2166 3 1663.2930177  71510 303885632      885533        syn-C2H3C(O)NH2, v=0
  775275.8537  0.1338 -5.2166 3 1663.2930177  71510 303885633      885534        syn-C2H3C(O)NH2, v=0
  775292.7819  0.0042 -5.5318 3  322.9943105  71510 30352 745      52 448        syn-C2H3C(O)NH2, v=0
  775293.1200  0.0042 -5.5318 3  322.9943105  71510 30352 845      52 548        syn-C2H3C(O)NH2, v=0
  775367.7273  0.0086 -3.6415 3  766.4305149  71510 303742154      732053        syn-C2H3C(O)NH2, v=0
  775465.4196  0.0037 -5.1074 3  158.4131 71  71510 303351125      34 628        syn-C2H3C(O)NH2, v=0
  775518.4487  0.0037 -4.1725 3  239.4092 93  71510 30346 541      45 442        syn-C2H3C(O)NH2, v=0
  775518.4953  0.0037 -4.1725 3  239.4092 93  71510 30346 641      45 342        syn-C2H3C(O)NH2, v=0
  775565.3404  0.1335 -5.1837 3 1641.8975175  71510 303875631      875532        syn-C2H3C(O)NH2, v=0
  775565.3404  0.1335 -5.1837 3 1641.8975175  71510 303875632      875533        syn-C2H3C(O)NH2, v=0
  775664.2961  0.0045 -5.0265 3  538.8278129  71510 303641451      641154        syn-C2H3C(O)NH2, v=0
  775674.5989  0.0737 -4.7267 3 1487.9020211  71510 303A52283      A42382        syn-C2H3C(O)NH2, v=0
  775844.5955  0.0054 -3.4859 3  710.8293143  71510 303712151      702050        syn-C2H3C(O)NH2, v=0
  775846.9863  0.1332 -5.1516 3 1620.7479173  71510 303865630      865531        syn-C2H3C(O)NH2, v=0
  775846.9863  0.1332 -5.1516 3 1620.7479173  71510 303865631      865532        syn-C2H3C(O)NH2, v=0
  775895.3024  0.1294 -4.6425 3 1634.2390241  71510 303C0 8B2      B9 9B1        syn-C2H3C(O)NH2, v=0
  775895.3024  0.1294 -4.6425 3 1634.2390241  71510 303C0 9B2      B9 8B1        syn-C2H3C(O)NH2, v=0
  775898.0028  0.1343 -4.6354 3 1638.4345243  71510 303C1 7B4      C0 8B3        syn-C2H3C(O)NH2, v=0
  775898.0028  0.1343 -4.6354 3 1638.4345243  71510 303C1 8B4      C0 7B3        syn-C2H3C(O)NH2, v=0
  775902.8681  0.1249 -4.6492 3 1629.5061239  71510 303B9 9B0      B810A9        syn-C2H3C(O)NH2, v=0
  775902.8681  0.1249 -4.6492 3 1629.5061239  71510 303B910B0      B8 9A9        syn-C2H3C(O)NH2, v=0
  775907.9452  0.1397 -4.6278 3 1642.0980245  71510 303C2 6B6      C1 7B5        syn-C2H3C(O)NH2, v=0
  775907.9452  0.1397 -4.6278 3 1642.0980245  71510 303C2 7B6      C1 6B5        syn-C2H3C(O)NH2, v=0
  775922.6045  0.1458 -4.6197 3 1645.2343247  71510 303C3 5B8      C2 6B7        syn-C2H3C(O)NH2, v=0
  775922.6045  0.1458 -4.6197 3 1645.2343247  71510 303C3 6B8      C2 5B7        syn-C2H3C(O)NH2, v=0
  775924.3532  0.1206 -4.6555 3 1624.2294237  71510 303B810A8      B711A7        syn-C2H3C(O)NH2, v=0
  775924.3532  0.1206 -4.6555 3 1624.2294237  71510 303B811A8      B710A7        syn-C2H3C(O)NH2, v=0
  775935.4697  0.0735 -4.7264 3 1487.8966211  71510 303A52383      A42282        syn-C2H3C(O)NH2, v=0
  775939.8546  0.1528 -4.6111 3 1647.8476249  71510 303C4 4C0      C3 5B9        syn-C2H3C(O)NH2, v=0
  775939.8546  0.1528 -4.6111 3 1647.8476249  71510 303C4 5C0      C3 4B9        syn-C2H3C(O)NH2, v=0
  775945.0098  0.0023 -4.4147 3  212.2827 79  71510 303391425      381128        syn-C2H3C(O)NH2, v=0
  775957.8919  0.1610 -4.6019 3 1649.9416251  71510 303C5 3C2      C4 4C1        syn-C2H3C(O)NH2, v=0
  775957.8919  0.1610 -4.6019 3 1649.9416251  71510 303C5 4C2      C4 3C1        syn-C2H3C(O)NH2, v=0
  775961.0780  0.0025 -3.1639 3  610.1027129  71510 303642342      632241        syn-C2H3C(O)NH2, v=0
  775963.6548  0.0025 -3.1639 3  610.1026129  71510 303642341      632242        syn-C2H3C(O)NH2, v=0
  775964.2130  0.1166 -4.6615 3 1618.4015235  71510 303B711A6      B612A5        syn-C2H3C(O)NH2, v=0
  775964.2130  0.1166 -4.6615 3 1618.4015235  71510 303B712A6      B611A5        syn-C2H3C(O)NH2, v=0
  775972.4781  0.2139 -5.1981 3 1585.1242215  71510 303A72681      A62780        syn-C2H3C(O)NH2, v=0
  775975.1751  0.1706 -4.5920 3 1651.5196253  71510 303C6 2C4      C5 3C3        syn-C2H3C(O)NH2, v=0
  775975.1751  0.1706 -4.5920 3 1651.5196253  71510 303C6 3C4      C5 2C3        syn-C2H3C(O)NH2, v=0
  775990.3773  0.1820 -4.5815 3 1652.5843255  71510 303C7 1C6      C6 2C5        syn-C2H3C(O)NH2, v=0
  775990.3773  0.1820 -4.5815 3 1652.5843255  71510 303C7 2C6      C6 1C5        syn-C2H3C(O)NH2, v=0
  776002.3485  0.1955 -4.5703 3 1653.1383257  71510 303C8 0C8      C7 1C7        syn-C2H3C(O)NH2, v=0
  776002.3485  0.1955 -4.5703 3 1653.1383257  71510 303C8 1C8      C7 0C7        syn-C2H3C(O)NH2, v=0
  776027.9391  0.1126 -4.6673 3 1612.0140233  71510 303B612A4      B513A3        syn-C2H3C(O)NH2, v=0
  776027.9391  0.1126 -4.6673 3 1612.0140233  71510 303B613A4      B512A3        syn-C2H3C(O)NH2, v=0
  776063.0672  0.0165 -5.0631 3  742.9552149  71510 303741757      741460        syn-C2H3C(O)NH2, v=0
  776120.9552  0.1329 -5.1205 3 1599.8441171  71510 303855629      855530        syn-C2H3C(O)NH2, v=0
  776120.9552  0.1329 -5.1205 3 1599.8441171  71510 303855630      855531        syn-C2H3C(O)NH2, v=0
  776122.3806  0.1088 -4.6730 3 1605.0572231  71510 303B513A2      B414A1        syn-C2H3C(O)NH2, v=0
  776122.3806  0.1088 -4.6730 3 1605.0572231  71510 303B514A2      B413A1        syn-C2H3C(O)NH2, v=0
  776138.3241  0.0088 -5.0114 3  680.4869143  71510 303711755      711458        syn-C2H3C(O)NH2, v=0
  776256.1955  0.1050 -4.6787 3 1597.5192229  71510 303B414A0      B31599        syn-C2H3C(O)NH2, v=0
  776256.1955  0.1050 -4.6787 3 1597.5192229  71510 303B415A0      B31499        syn-C2H3C(O)NH2, v=0
  776262.1594  0.0024 -5.6358 3  222.2527 71  71510 303352015      351718        syn-C2H3C(O)NH2, v=0
  776262.1597  0.0024 -5.6358 3  222.2527 71  71510 303352016      351719        syn-C2H3C(O)NH2, v=0
  776387.4085  0.1327 -5.0904 3 1579.1860169  71510 303845628      845529        syn-C2H3C(O)NH2, v=0
  776387.4085  0.1327 -5.0904 3 1579.1860169  71510 303845629      845530        syn-C2H3C(O)NH2, v=0
  776402.6485  0.0377 -5.1864 3  955.8425167  71510 303832262      831965        syn-C2H3C(O)NH2, v=0
  776440.5003  0.1013 -4.6845 3 1589.3866227  71510 303B31598      B21697        syn-C2H3C(O)NH2, v=0
  776440.5003  0.1013 -4.6845 3 1589.3866227  71510 303B31698      B21597        syn-C2H3C(O)NH2, v=0
  776534.2959  0.0028 -3.7256 3  332.4033103  71510 303511041      50 942        syn-C2H3C(O)NH2, v=0
  776641.2880  0.0042 -4.9299 3  600.1747129  71510 303642242      641945        syn-C2H3C(O)NH2, v=0
  776646.5047  0.1326 -5.0612 3 1558.7735167  71510 303835627      835528        syn-C2H3C(O)NH2, v=0
  776646.5047  0.1326 -5.0612 3 1558.7735167  71510 303835628      835529        syn-C2H3C(O)NH2, v=0
  776689.8328  0.0977 -4.6907 3 1580.6429225  71510 303B21696      B11795        syn-C2H3C(O)NH2, v=0
  776689.8328  0.0977 -4.6907 3 1580.6429225  71510 303B21796      B11695        syn-C2H3C(O)NH2, v=0
  776723.5004  0.0021 -5.1100 3  133.4977 59  71510 303291515      281216        syn-C2H3C(O)NH2, v=0
  776725.4488  0.0021 -5.1100 3  133.4976 59  71510 303291514      281217        syn-C2H3C(O)NH2, v=0
  776819.4920  0.0173 -5.1466 3  931.4958163  71510 303812458      812161        syn-C2H3C(O)NH2, v=0
  776881.2342  0.0724 -4.7609 3 1473.7953209  71510 303A42381      A32480        syn-C2H3C(O)NH2, v=0
  776898.4000  0.1325 -5.0331 3 1538.6065165  71510 303825626      825527        syn-C2H3C(O)NH2, v=0
  776898.4000  0.1325 -5.0331 3 1538.6065165  71510 303825627      825528        syn-C2H3C(O)NH2, v=0
  777023.6272  0.0941 -4.6975 3 1571.2681223  71510 303B11794      B01893        syn-C2H3C(O)NH2, v=0
  777023.6273  0.0941 -4.6975 3 1571.2681223  71510 303B11894      B01793        syn-C2H3C(O)NH2, v=0
  777143.2482  0.1324 -5.0060 3 1518.6849163  71510 303815625      815526        syn-C2H3C(O)NH2, v=0
  777143.2482  0.1324 -5.0060 3 1518.6849163  71510 303815626      815527        syn-C2H3C(O)NH2, v=0
  777169.7109  0.0397 -5.2340 3 1007.3798171  71510 303852363      852066        syn-C2H3C(O)NH2, v=0
  777186.1310  0.0086 -5.0038 3  729.0230143  71510 303712348      712051        syn-C2H3C(O)NH2, v=0
  777381.2005  0.1324 -4.9801 3 1499.0087161  71510 303805624      805525        syn-C2H3C(O)NH2, v=0
  777381.2005  0.1324 -4.9801 3 1499.0087161  71510 303805625      805526        syn-C2H3C(O)NH2, v=0
  777444.8463  0.0072 -3.5856 3  747.5525147  71510 303732153      722052        syn-C2H3C(O)NH2, v=0
  777468.5726  0.0906 -4.7053 3 1561.2378221  71510 303B01892      A91991        syn-C2H3C(O)NH2, v=0
  777468.5744  0.0906 -4.7053 3 1561.2378221  71510 303B01992      A91891        syn-C2H3C(O)NH2, v=0
  777469.9105  0.0062 -3.5338 3  729.0230145  71510 303722152      712051        syn-C2H3C(O)NH2, v=0
  777487.4315  0.0027 -3.7248 3  332.4028103  71510 303511141      50 842        syn-C2H3C(O)NH2, v=0
  777581.9320  0.0039 -3.6788 3  383.9274109  71510 303541242      531143        syn-C2H3C(O)NH2, v=0
  777612.4058  0.1324 -4.9553 3 1479.5777159  71510 303795623      795524        syn-C2H3C(O)NH2, v=0
  777612.4058  0.1324 -4.9553 3 1479.5777159  71510 303795624      795525        syn-C2H3C(O)NH2, v=0
  777717.0145  0.0029 -4.9669 3  442.4667109  71510 303542133      541836        syn-C2H3C(O)NH2, v=0
  777790.4590  0.0029 -4.9668 3  442.4642109  71510 303542134      541837        syn-C2H3C(O)NH2, v=0
  777837.0105  0.1325 -4.9318 3 1460.3919157  71510 303785622      785523        syn-C2H3C(O)NH2, v=0
  777837.0105  0.1325 -4.9318 3 1460.3919157  71510 303785623      785524        syn-C2H3C(O)NH2, v=0
  777990.7919  0.0060 -5.2266 3  466.3369117  71510 303581741      581246        syn-C2H3C(O)NH2, v=0
  778008.4140  0.0289 -4.0115 3  934.6008165  71510 303822261      812160        syn-C2H3C(O)NH2, v=0
  778055.1590  0.1326 -4.9095 3 1441.4511155  71510 303775621      775522        syn-C2H3C(O)NH2, v=0
  778055.1590  0.1326 -4.9095 3 1441.4511155  71510 303775622      775523        syn-C2H3C(O)NH2, v=0
  778062.5684  0.0872 -4.7146 3 1550.5211219  71510 303A91990      A82089        syn-C2H3C(O)NH2, v=0
  778062.6072  0.0872 -4.7146 3 1550.5211219  71510 303A92090      A81989        syn-C2H3C(O)NH2, v=0
  778202.5577  0.0022 -3.0902 3  588.9864125  71510 303622439      612338        syn-C2H3C(O)NH2, v=0
  778202.6074  0.0022 -3.0902 3  588.9864125  71510 303622438      612339        syn-C2H3C(O)NH2, v=0
  778218.5940  0.0034 -3.2832 3  649.6642135  71510 303672246      662145        syn-C2H3C(O)NH2, v=0
  778266.9932  0.1327 -4.8886 3 1422.7553153  71510 303765620      765521        syn-C2H3C(O)NH2, v=0
  778266.9932  0.1327 -4.8886 3 1422.7553153  71510 303765621      765522        syn-C2H3C(O)NH2, v=0
  778353.5711  0.0320 -5.2619 3 1038.0986173  71510 303862463      862166        syn-C2H3C(O)NH2, v=0
  778374.2323  0.0073 -2.6377 3  460.0552 77  71510 3033836 2      3735 3        syn-C2H3C(O)NH2, v=0
  778374.2323  0.0073 -2.6377 3  460.0552 77  71510 3033836 3      3735 2        syn-C2H3C(O)NH2, v=0
  778385.0313  0.0034 -3.2830 3  649.6596135  71510 303672245      662146        syn-C2H3C(O)NH2, v=0
  778388.3130  0.0032 -4.0345 3  257.5205 95  71510 30347 641      46 542        syn-C2H3C(O)NH2, v=0
  778388.7857  0.0032 -4.0345 3  257.5205 95  71510 30347 741      46 442        syn-C2H3C(O)NH2, v=0
  778435.0648  0.1313 -4.9997 3 1521.3057211  71510 303A52580      A42679        syn-C2H3C(O)NH2, v=0
  778472.6528  0.1329 -4.8691 3 1404.3045151  71510 303755619      755520        syn-C2H3C(O)NH2, v=0
  778472.6528  0.1329 -4.8691 3 1404.3045151  71510 303755620      755521        syn-C2H3C(O)NH2, v=0
  778505.5233  0.0187 -5.0633 3  789.2782153  71510 303761958      761661        syn-C2H3C(O)NH2, v=0
  778661.7240  0.0039 -5.3889 3  355.8243109  71510 30354 846      54 549        syn-C2H3C(O)NH2, v=0
  778663.2225  0.0039 -5.3889 3  355.8243109  71510 30354 946      54 649        syn-C2H3C(O)NH2, v=0
  778672.2752  0.1331 -4.8512 3 1386.0984149  71510 303745618      745519        syn-C2H3C(O)NH2, v=0
  778672.2752  0.1331 -4.8512 3 1386.0984149  71510 303745619      745520        syn-C2H3C(O)NH2, v=0
  778687.2806  0.0072 -3.5604 3  703.0488143  71510 303712051      701952        syn-C2H3C(O)NH2, v=0
  778813.7534  0.0056 -2.6565 3  462.5273 81  71510 3034035 5      3934 6        syn-C2H3C(O)NH2, v=0
  778813.7534  0.0056 -2.6565 3  462.5273 81  71510 3034035 6      3934 5        syn-C2H3C(O)NH2, v=0
  778861.5946  0.0839 -4.7261 3 1539.0781217  71510 303A82088      A72187        syn-C2H3C(O)NH2, v=0
  778862.3230  0.0839 -4.7261 3 1539.0781217  71510 303A82188      A72087        syn-C2H3C(O)NH2, v=0
  778865.9958  0.1333 -4.8350 3 1368.1371147  71510 303735617      735518        syn-C2H3C(O)NH2, v=0
  778865.9958  0.1333 -4.8350 3 1368.1371147  71510 303735618      735519        syn-C2H3C(O)NH2, v=0
  778896.5045  0.0049 -3.4360 3  692.8012141  71510 303702149      692050        syn-C2H3C(O)NH2, v=0
  779053.9478  0.1336 -4.8205 3 1350.4205145  71510 303725616      725517        syn-C2H3C(O)NH2, v=0
  779053.9478  0.1336 -4.8205 3 1350.4205145  71510 303725617      725518        syn-C2H3C(O)NH2, v=0
  779084.6026  0.0044 -5.0663 3  499.7445125  71510 303621250      62 953        syn-C2H3C(O)NH2, v=0
  779178.5313  0.0040 -4.9275 3  600.0899129  71510 303642243      641946        syn-C2H3C(O)NH2, v=0
  779236.2622  0.1339 -4.8080 3 1332.9484143  71510 303715615      715516        syn-C2H3C(O)NH2, v=0
  779236.2622  0.1339 -4.8080 3 1332.9484143  71510 303715616      715517        syn-C2H3C(O)NH2, v=0
  779240.7352  0.0043 -2.6779 3  466.4666 85  71510 3034234 8      4133 9        syn-C2H3C(O)NH2, v=0
  779240.7352  0.0043 -2.6779 3  466.4666 85  71510 3034234 9      4133 8        syn-C2H3C(O)NH2, v=0
  779290.2884  0.0709 -4.5163 3 1247.0444191  71510 303952472      942371        syn-C2H3C(O)NH2, v=0
  779327.1122  0.0044 -5.0661 3  499.7446125  71510 303621350      621053        syn-C2H3C(O)NH2, v=0
  779413.0680  0.1342 -4.7977 3 1315.7209141  71510 303705614      705515        syn-C2H3C(O)NH2, v=0
  779413.0680  0.1342 -4.7977 3 1315.7209141  71510 303705615      705516        syn-C2H3C(O)NH2, v=0
  779554.6766  0.0020 -3.0259 3  569.6190121  71510 303602536      592435        syn-C2H3C(O)NH2, v=0
  779554.6772  0.0020 -3.0259 3  569.6190121  71510 303602535      592436        syn-C2H3C(O)NH2, v=0
  779584.4922  0.1346 -4.7897 3 1298.7377139  71510 303695613      695514        syn-C2H3C(O)NH2, v=0
  779584.4922  0.1346 -4.7897 3 1298.7377139  71510 303695614      695515        syn-C2H3C(O)NH2, v=0
  779648.0375  0.0034 -2.7021 3  471.8792 89  71510 303443311      433212        syn-C2H3C(O)NH2, v=0
  779648.0375  0.0034 -2.7021 3  471.8792 89  71510 303443312      433211        syn-C2H3C(O)NH2, v=0
  779649.4492  0.0843 -4.8494 3 1484.6566209  71510 303A42480      A32579        syn-C2H3C(O)NH2, v=0
  779700.3832  0.0696 -4.7576 3 1473.7379209  71510 303A42481      A32380        syn-C2H3C(O)NH2, v=0
  779750.6595  0.1349 -4.7845 3 1281.9989137  71510 303685612      685513        syn-C2H3C(O)NH2, v=0
  779750.6595  0.1349 -4.7845 3 1281.9989137  71510 303685613      685514        syn-C2H3C(O)NH2, v=0
  779819.9154  0.0049 -3.6814 3  417.4017113  71510 303561343      551244        syn-C2H3C(O)NH2, v=0
  779843.4985  0.0026 -3.7771 3  313.3510101  71510 30350 941      49 842        syn-C2H3C(O)NH2, v=0
  779911.6928  0.1353 -4.7822 3 1265.5044135  71510 303675611      675512        syn-C2H3C(O)NH2, v=0
  779911.6928  0.1353 -4.7822 3 1265.5044135  71510 303675612      675513        syn-C2H3C(O)NH2, v=0
  779944.8529  0.0024 -4.3713 3  222.1388 81  71510 303401426      391129        syn-C2H3C(O)NH2, v=0
  779949.5451  0.0808 -4.7409 3 1526.8556215  71510 303A72186      A62285        syn-C2H3C(O)NH2, v=0
  779961.2670  0.0808 -4.7409 3 1526.8553215  71510 303A72286      A62185        syn-C2H3C(O)NH2, v=0
  780023.1019  0.0026 -3.7770 3  313.3509101  71510 303501041      49 742        syn-C2H3C(O)NH2, v=0
  780025.6393  0.0027 -2.7292 3  478.7725 93  71510 303463214      453115        syn-C2H3C(O)NH2, v=0
  780025.6393  0.0027 -2.7292 3  478.7725 93  71510 303463215      453114        syn-C2H3C(O)NH2, v=0
  780062.5039  0.0076 -3.6988 3  540.4500127  71510 303631647      621548        syn-C2H3C(O)NH2, v=0
  780067.7129  0.1357 -4.7834 3 1249.2541133  71510 303665610      665511        syn-C2H3C(O)NH2, v=0
  780067.7129  0.1357 -4.7834 3 1249.2541133  71510 303665611      665512        syn-C2H3C(O)NH2, v=0
  780138.3622  0.1179 -5.5655 3 1204.0774185  71510 303922765      922468        syn-C2H3C(O)NH2, v=0
  780218.8387  0.1362 -4.7887 3 1233.2480131  71510 3036556 9      655510        syn-C2H3C(O)NH2, v=0
  780218.8387  0.1362 -4.7887 3 1233.2480131  71510 303655610      655511        syn-C2H3C(O)NH2, v=0
  780232.9747  0.0028 -3.9277 3  275.8912 97  71510 30348 741      47 642        syn-C2H3C(O)NH2, v=0
  780236.9932  0.0028 -3.9277 3  275.8912 97  71510 30348 841      47 542        syn-C2H3C(O)NH2, v=0
  780256.1766  0.0061 -5.0732 3  195.5436 89  71510 30344 242      43 143        syn-C2H3C(O)NH2, v=0
  780256.1766  0.0061 -5.0732 3  195.5436 89  71510 30344 342      43 043        syn-C2H3C(O)NH2, v=0
  780334.3361  0.0020 -2.9689 3  551.9263117  71510 303582632      572533        syn-C2H3C(O)NH2, v=0
  780334.3361  0.0020 -2.9689 3  551.9263117  71510 303582633      572532        syn-C2H3C(O)NH2, v=0
  780359.5606  0.0023 -2.7595 3  487.1555 97  71510 303483117      473018        syn-C2H3C(O)NH2, v=0
  780359.5606  0.0023 -2.7595 3  487.1555 97  71510 303483118      473017        syn-C2H3C(O)NH2, v=0
  780365.1871  0.1366 -4.7987 3 1217.4859129  71510 3036456 8      6455 9        syn-C2H3C(O)NH2, v=0
  780365.1871  0.1366 -4.7987 3 1217.4859129  71510 3036456 9      645510        syn-C2H3C(O)NH2, v=0
  780429.1928  0.0915 -5.3472 3 1018.9863173  71510 303862165      861868        syn-C2H3C(O)NH2, v=0
  780506.8730  0.1371 -4.8146 3 1201.9677127  71510 3036356 7      6355 8        syn-C2H3C(O)NH2, v=0
  780506.8730  0.1371 -4.8146 3 1201.9677127  71510 3036356 8      6355 9        syn-C2H3C(O)NH2, v=0
  780630.3197  0.0021 -2.7931 3  497.0395101  71510 303503020      492921        syn-C2H3C(O)NH2, v=0
  780630.3197  0.0021 -2.7931 3  497.0395101  71510 303503021      492920        syn-C2H3C(O)NH2, v=0
  780644.0095  0.1376 -4.8377 3 1186.6935125  71510 3036256 6      6255 7        syn-C2H3C(O)NH2, v=0
  780644.0095  0.1376 -4.8377 3 1186.6935125  71510 3036256 7      6255 8        syn-C2H3C(O)NH2, v=0
  780730.1224  0.0020 -2.9179 3  535.8560113  71510 303562729      552630        syn-C2H3C(O)NH2, v=0
  780730.1224  0.0020 -2.9179 3  535.8560113  71510 303562730      552629        syn-C2H3C(O)NH2, v=0
  780776.7078  0.1381 -4.8703 3 1171.6632123  71510 3036156 5      6155 6        syn-C2H3C(O)NH2, v=0
  780776.7078  0.1381 -4.8703 3 1171.6632123  71510 3036156 6      6155 7        syn-C2H3C(O)NH2, v=0
  780810.6765  0.0020 -2.8305 3  508.4384105  71510 303522923      512824        syn-C2H3C(O)NH2, v=0
  780810.6765  0.0020 -2.8305 3  508.4384105  71510 303522924      512823        syn-C2H3C(O)NH2, v=0
  780835.7751  0.0026 -3.8436 3  294.5069 99  71510 30349 841      48 742        syn-C2H3C(O)NH2, v=0
  780857.4324  0.0038 -5.2767 3  389.9233113  71510 30356 947      56 650        syn-C2H3C(O)NH2, v=0
  780862.2325  0.0020 -2.8719 3  521.3697109  71510 303542826      532727        syn-C2H3C(O)NH2, v=0
  780862.2325  0.0020 -2.8719 3  521.3697109  71510 303542827      532726        syn-C2H3C(O)NH2, v=0
  780863.4712  0.0038 -5.2767 3  389.9233113  71510 303561047      56 750        syn-C2H3C(O)NH2, v=0
  780864.8008  0.0026 -3.8436 3  294.5069 99  71510 30349 941      48 642        syn-C2H3C(O)NH2, v=0
  780905.0769  0.1387 -4.9155 3 1156.8766121  71510 3036056 4      6055 5        syn-C2H3C(O)NH2, v=0
  780905.0769  0.1387 -4.9155 3 1156.8766121  71510 3036056 5      6055 6        syn-C2H3C(O)NH2, v=0
  780954.0183  0.0081 -4.9969 3  746.9693145  71510 303722350      722053        syn-C2H3C(O)NH2, v=0
  781029.2243  0.1392 -4.9788 3 1142.3337119  71510 3035956 3      5955 4        syn-C2H3C(O)NH2, v=0
  781029.2243  0.1392 -4.9788 3 1142.3337119  71510 3035956 4      5955 5        syn-C2H3C(O)NH2, v=0
  781135.9322  0.0067 -5.0214 3  637.1543139  71510 303691554      691257        syn-C2H3C(O)NH2, v=0
  781149.2555  0.1398 -5.0706 3 1128.0345117  71510 3035856 2      5855 3        syn-C2H3C(O)NH2, v=0
  781149.2555  0.1398 -5.0706 3 1128.0345117  71510 3035856 3      5855 4        syn-C2H3C(O)NH2, v=0
  781248.3555  0.0042 -5.1193 3  461.8928121  71510 303601149      60 852        syn-C2H3C(O)NH2, v=0
  781265.2740  0.1403 -5.2140 3 1113.9789115  71510 3035756 1      5755 2        syn-C2H3C(O)NH2, v=0
  781265.2740  0.1403 -5.2140 3 1113.9789115  71510 3035756 2      5755 3        syn-C2H3C(O)NH2, v=0
  781310.8846  0.0039 -4.0401 3  330.0397 99  71510 303491535      481236        syn-C2H3C(O)NH2, v=0
  781324.7230  0.0042 -5.1192 3  461.8928121  71510 303601249      60 952        syn-C2H3C(O)NH2, v=0
  781335.4228  0.0331 -5.1507 3  905.4333163  71510 303812161      811864        syn-C2H3C(O)NH2, v=0
  781377.3818  0.1409 -5.4827 3 1100.1668113  71510 3035656 0      5655 1        syn-C2H3C(O)NH2, v=0
  781377.3818  0.1409 -5.4827 3 1100.1668113  71510 3035656 1      5655 2        syn-C2H3C(O)NH2, v=0
  781415.7580  0.0778 -4.7612 3 1513.7790213  71510 303A62284      A52383        syn-C2H3C(O)NH2, v=0
  781422.3912  0.0395 -5.2516 3  961.9915165  71510 303822557      822260        syn-C2H3C(O)NH2, v=0
  781536.2121  0.0268 -5.1196 3  808.0463155  71510 303771859      771562        syn-C2H3C(O)NH2, v=0
  781575.3130  0.0777 -4.7611 3 1513.7757213  71510 303A62384      A52283        syn-C2H3C(O)NH2, v=0
  781747.6961  0.0028 -4.9869 3  428.9433107  71510 303532132      531835        syn-C2H3C(O)NH2, v=0
  781768.8791  0.0040 -5.1884 3  425.2826117  71510 303581048      58 751        syn-C2H3C(O)NH2, v=0
  781786.8043  0.0028 -4.9869 3  428.9420107  71510 303532133      531836        syn-C2H3C(O)NH2, v=0
  781791.2157  0.0040 -5.1883 3  425.2826117  71510 303581148      58 851        syn-C2H3C(O)NH2, v=0
  781885.7469  0.1359 -4.6855 3 1660.1201243  71510 303C1 8B3      C0 9B2        syn-C2H3C(O)NH2, v=0
  781885.7469  0.1359 -4.6855 3 1660.1201243  71510 303C1 9B3      C0 8B2        syn-C2H3C(O)NH2, v=0
  781889.4119  0.1410 -4.6786 3 1664.3157245  71510 303C2 7B5      C1 8B4        syn-C2H3C(O)NH2, v=0
  781889.4119  0.1410 -4.6786 3 1664.3157245  71510 303C2 8B5      C1 7B4        syn-C2H3C(O)NH2, v=0
  781892.0096  0.1312 -4.6920 3 1655.3874241  71510 303C0 9B1      B910B0        syn-C2H3C(O)NH2, v=0
  781892.0096  0.1312 -4.6920 3 1655.3874241  71510 303C010B1      B9 9B0        syn-C2H3C(O)NH2, v=0
  781900.0572  0.1467 -4.6712 3 1667.9795247  71510 303C3 6B7      C2 7B6        syn-C2H3C(O)NH2, v=0
  781900.0572  0.1467 -4.6712 3 1667.9795247  71510 303C3 7B7      C2 6B6        syn-C2H3C(O)NH2, v=0
  781907.4971  0.0163 -5.1324 3  910.8442161  71510 303802457      802160        syn-C2H3C(O)NH2, v=0
  781911.7518  0.1267 -4.6981 3 1650.1114239  71510 303B910A9      B811A8        syn-C2H3C(O)NH2, v=0
  781911.7518  0.1267 -4.6981 3 1650.1114239  71510 303B911A9      B810A8        syn-C2H3C(O)NH2, v=0
  781915.2165  0.1530 -4.6632 3 1671.1162249  71510 303C4 5B9      C3 6B8        syn-C2H3C(O)NH2, v=0
  781915.2165  0.1530 -4.6632 3 1671.1162249  71510 303C4 6B9      C3 5B8        syn-C2H3C(O)NH2, v=0
  781932.8092  0.1604 -4.6547 3 1673.7302251  71510 303C5 4C1      C4 5C0        syn-C2H3C(O)NH2, v=0
  781932.8092  0.1604 -4.6547 3 1673.7302251  71510 303C5 5C1      C4 4C0        syn-C2H3C(O)NH2, v=0
  781949.2952  0.1225 -4.7039 3 1644.2849237  71510 303B811A7      B712A6        syn-C2H3C(O)NH2, v=0
  781949.2952  0.1225 -4.7039 3 1644.2849237  71510 303B812A7      B711A6        syn-C2H3C(O)NH2, v=0
  781951.0665  0.1689 -4.6456 3 1675.8248253  71510 303C6 3C3      C5 4C2        syn-C2H3C(O)NH2, v=0
  781951.0665  0.1689 -4.6456 3 1675.8248253  71510 303C6 4C3      C5 3C2        syn-C2H3C(O)NH2, v=0
  781968.4740  0.1789 -4.6358 3 1677.4034255  71510 303C7 2C5      C6 3C4        syn-C2H3C(O)NH2, v=0
  781968.4740  0.1789 -4.6358 3 1677.4034255  71510 303C7 3C5      C6 2C4        syn-C2H3C(O)NH2, v=0
  781983.7257  0.1907 -4.6254 3 1678.4686257  71510 303C8 1C7      C7 2C6        syn-C2H3C(O)NH2, v=0
  781983.7257  0.1907 -4.6254 3 1678.4686257  71510 303C8 2C7      C7 1C6        syn-C2H3C(O)NH2, v=0
  781995.6874  0.2046 -4.6144 3 1679.0229259  71510 303C9 0C9      C8 1C8        syn-C2H3C(O)NH2, v=0
  781995.6874  0.2046 -4.6144 3 1679.0229259  71510 303C9 1C9      C8 0C8        syn-C2H3C(O)NH2, v=0
  782009.9517  0.1184 -4.7095 3 1637.8996235  71510 303B712A5      B613A4        syn-C2H3C(O)NH2, v=0
  782009.9517  0.1184 -4.7095 3 1637.8996235  71510 303B713A5      B612A4        syn-C2H3C(O)NH2, v=0
  782100.3268  0.1144 -4.7149 3 1630.9458233  71510 303B613A3      B514A2        syn-C2H3C(O)NH2, v=0
  782100.3268  0.1144 -4.7149 3 1630.9458233  71510 303B614A3      B513A2        syn-C2H3C(O)NH2, v=0
  782228.7425  0.1105 -4.7203 3 1623.4124231  71510 303B514A1      B415A0        syn-C2H3C(O)NH2, v=0
  782228.7425  0.1105 -4.7203 3 1623.4124231  71510 303B515A1      B414A0        syn-C2H3C(O)NH2, v=0
  782394.9343  0.0027 -3.7023 3  409.8648111  71510 303551541      541242        syn-C2H3C(O)NH2, v=0
  782405.8439  0.1067 -4.7258 3 1615.2859229  71510 303B41599      B31698        syn-C2H3C(O)NH2, v=0
  782405.8439  0.1067 -4.7258 3 1615.2859229  71510 303B41699      B31598        syn-C2H3C(O)NH2, v=0
  782424.2086  0.0028 -3.1926 3  626.0806131  71510 303652343      642242        syn-C2H3C(O)NH2, v=0
  782429.2258  0.0028 -3.1926 3  626.0805131  71510 303652342      642243        syn-C2H3C(O)NH2, v=0
  782627.3233  0.0020 -5.0363 3  140.6766 61  71510 303301516      291217        syn-C2H3C(O)NH2, v=0
  782631.8777  0.0020 -5.0363 3  140.6764 61  71510 303301515      291218        syn-C2H3C(O)NH2, v=0
  782645.4907  0.1029 -4.7316 3 1606.5504227  71510 303B31697      B21796        syn-C2H3C(O)NH2, v=0
  782645.4907  0.1029 -4.7316 3 1606.5504227  71510 303B31797      B21696        syn-C2H3C(O)NH2, v=0
  782888.7071  0.0759 -4.7917 3 1499.7459211  71510 303A52382      A42481        syn-C2H3C(O)NH2, v=0
  782966.1147  0.0991 -4.7380 3 1597.1868225  71510 303B21795      B11894        syn-C2H3C(O)NH2, v=0
  782966.1147  0.0991 -4.7380 3 1597.1868225  71510 303B21895      B11794        syn-C2H3C(O)NH2, v=0
  782986.6538  0.0711 -5.4012 3 1079.5834175  71510 303872661      872364        syn-C2H3C(O)NH2, v=0
  783063.1562  0.0096 -3.6379 3  678.0521141  71510 303701951      691852        syn-C2H3C(O)NH2, v=0
  783392.8683  0.0955 -4.7453 3 1587.1713223  71510 303B11893      B01992        syn-C2H3C(O)NH2, v=0
  783392.8693  0.0955 -4.7453 3 1587.1713223  71510 303B11993      B01892        syn-C2H3C(O)NH2, v=0
  783888.9617  0.0631 -5.2630 3  946.0687167  71510 303832063      831766        syn-C2H3C(O)NH2, v=0
  783938.2687  0.0529 -4.2559 3 1073.7989177  71510 303882366      872265        syn-C2H3C(O)NH2, v=0
  783961.1930  0.0920 -4.7539 3 1576.4744221  71510 303B01991      A92090        syn-C2H3C(O)NH2, v=0
  783961.2148  0.0920 -4.7539 3 1576.4744221  71510 303B02091      A91990        syn-C2H3C(O)NH2, v=0
  784092.7574  0.0038 -4.9350 3  583.9482127  71510 303632241      631944        syn-C2H3C(O)NH2, v=0
  784094.1957  0.0038 -3.3166 3  666.5228137  71510 303682247      672146        syn-C2H3C(O)NH2, v=0
  784228.3026  0.0419 -5.1866 3  875.7530161  71510 303801961      801664        syn-C2H3C(O)NH2, v=0
  784390.0905  0.0039 -3.3163 3  666.5147137  71510 303682246      672147        syn-C2H3C(O)NH2, v=0
  784396.2363  0.0024 -4.3314 3  232.2481 83  71510 303411427      401130        syn-C2H3C(O)NH2, v=0
  784400.0167  0.0063 -5.0184 3  637.1544139  71510 303691654      691357        syn-C2H3C(O)NH2, v=0
  784681.9885  0.0739 -4.7897 3 1499.7093211  71510 303A52482      A42381        syn-C2H3C(O)NH2, v=0
  784722.9987  0.0886 -4.7645 3 1565.0582219  71510 303A92089      A82188        syn-C2H3C(O)NH2, v=0
  784723.4172  0.0885 -4.7645 3 1565.0582219  71510 303A92189      A82088        syn-C2H3C(O)NH2, v=0
  784788.6635  0.3053 -5.4115 3 1677.9711221  71510 303B02783      A92882        syn-C2H3C(O)NH2, v=0
  784912.0355  0.0024 -3.1165 3  604.3903127  71510 303632440      622339        syn-C2H3C(O)NH2, v=0
  784912.1398  0.0024 -3.1165 3  604.3903127  71510 303632439      622340        syn-C2H3C(O)NH2, v=0
  785179.0273  0.0091 -2.6327 3  467.7921 75  71510 3033737 0      3636 1        syn-C2H3C(O)NH2, v=0
  785179.0273  0.0091 -2.6327 3  467.7921 75  71510 3033737 1      3636 0        syn-C2H3C(O)NH2, v=0
  785342.0168  0.0056 -3.4775 3  710.5804143  71510 303712150      702051        syn-C2H3C(O)NH2, v=0
  785370.1554  0.0097 -3.6787 3  636.2359137  71510 303681850      671751        syn-C2H3C(O)NH2, v=0
  785431.3609  0.0388 -5.2960 3 1060.0391175  71510 303872464      872167        syn-C2H3C(O)NH2, v=0
  785453.2076  0.0052 -4.6319 3  213.2093 91  71510 30345 342      44 243        syn-C2H3C(O)NH2, v=0
  785453.2077  0.0052 -4.6319 3  213.2093 91  71510 30345 442      44 143        syn-C2H3C(O)NH2, v=0
  785482.8147  0.0028 -5.0088 3  415.6892105  71510 303522131      521834        syn-C2H3C(O)NH2, v=0
  785503.2569  0.0028 -5.0087 3  415.6886105  71510 303522132      521835        syn-C2H3C(O)NH2, v=0
  785619.1170  0.0038 -4.9335 3  583.8972127  71510 303632242      631945        syn-C2H3C(O)NH2, v=0
  785624.2743  0.0071 -2.6498 3  469.2938 79  71510 3033936 3      3835 4        syn-C2H3C(O)NH2, v=0
  785624.2743  0.0071 -2.6498 3  469.2938 79  71510 3033936 4      3835 3        syn-C2H3C(O)NH2, v=0
  785756.3676  0.0853 -4.7782 3 1552.8720217  71510 303A82187      A72286        syn-C2H3C(O)NH2, v=0
  785763.2808  0.0852 -4.7782 3 1552.8719217  71510 303A82287      A72186        syn-C2H3C(O)NH2, v=0
  786025.1239  0.0032 -3.6620 3  403.8261111  71510 303551442      541143        syn-C2H3C(O)NH2, v=0
  786060.5905  0.0055 -2.6693 3  472.2592 83  71510 3034135 6      4034 7        syn-C2H3C(O)NH2, v=0
  786060.5905  0.0055 -2.6693 3  472.2592 83  71510 3034135 7      4034 6        syn-C2H3C(O)NH2, v=0
  786190.8125  0.1546 -5.6380 3 1916.5421197  71510 303985741      985642        syn-C2H3C(O)NH2, v=0
  786190.8125  0.1546 -5.6380 3 1916.5421197  71510 303985742      985643        syn-C2H3C(O)NH2, v=0
  786424.5812  0.0021 -3.0502 3  584.4685123  71510 303612537      602436        syn-C2H3C(O)NH2, v=0
  786424.5827  0.0021 -3.0502 3  584.4685123  71510 303612536      602437        syn-C2H3C(O)NH2, v=0
  786482.4497  0.0042 -2.6915 3  476.6936 87  71510 3034334 9      423310        syn-C2H3C(O)NH2, v=0
  786482.4497  0.0042 -2.6915 3  476.6936 87  71510 303433410      4233 9        syn-C2H3C(O)NH2, v=0
  786555.3568  0.1537 -5.5973 3 1892.6948195  71510 303975740      975641        syn-C2H3C(O)NH2, v=0
  786555.3568  0.1537 -5.5973 3 1892.6948195  71510 303975741      975642        syn-C2H3C(O)NH2, v=0
  786838.7045  0.0052 -5.2663 3  153.6039 71  71510 303351026      34 529        syn-C2H3C(O)NH2, v=0
  786882.0628  0.0033 -2.7166 3  482.6033 91  71510 303453312      443213        syn-C2H3C(O)NH2, v=0
  786882.0628  0.0033 -2.7166 3  482.6033 91  71510 303453313      443212        syn-C2H3C(O)NH2, v=0
  786910.7272  0.1528 -5.5573 3 1869.0940193  71510 303965739      965640        syn-C2H3C(O)NH2, v=0
  786910.7272  0.1528 -5.5573 3 1869.0940193  71510 303965740      965641        syn-C2H3C(O)NH2, v=0
  787158.8587  0.0821 -4.7968 3 1539.8463215  71510 303A72285      A62384        syn-C2H3C(O)NH2, v=0
  787248.5573  0.0027 -2.7446 3  489.9961 95  71510 303473215      463116        syn-C2H3C(O)NH2, v=0
  787248.5573  0.0027 -2.7446 3  489.9961 95  71510 303473216      463115        syn-C2H3C(O)NH2, v=0
  787255.8563  0.0820 -4.7967 3 1539.8443215  71510 303A72385      A62284        syn-C2H3C(O)NH2, v=0
  787257.1046  0.1520 -5.5181 3 1845.7398191  71510 303955738      955639        syn-C2H3C(O)NH2, v=0
  787257.1046  0.1520 -5.5181 3 1845.7398191  71510 303955739      955640        syn-C2H3C(O)NH2, v=0
  787314.5522  0.0020 -2.9915 3  566.2354119  71510 303592633      582534        syn-C2H3C(O)NH2, v=0
  787314.5522  0.0020 -2.9915 3  566.2354119  71510 303592634      582533        syn-C2H3C(O)NH2, v=0
  787357.5221  0.0083 -5.6247 3  364.1066105  71510 303521438      52 943        syn-C2H3C(O)NH2, v=0
  787471.8212  0.0840 -4.8729 3 1510.8746211  71510 303A52481      A42580        syn-C2H3C(O)NH2, v=0
  787566.8234  0.0023 -2.7759 3  498.8815 99  71510 303493118      483019        syn-C2H3C(O)NH2, v=0
  787566.8234  0.0023 -2.7759 3  498.8815 99  71510 303493119      483018        syn-C2H3C(O)NH2, v=0
  787594.6671  0.1512 -5.4797 3 1822.6319189  71510 303945737      945638        syn-C2H3C(O)NH2, v=0
  787594.6671  0.1512 -5.4797 3 1822.6319189  71510 303945738      945639        syn-C2H3C(O)NH2, v=0
  787788.4815  0.0020 -2.9390 3  549.6352115  71510 303572730      562631        syn-C2H3C(O)NH2, v=0
  787788.4815  0.0020 -2.9390 3  549.6352115  71510 303572731      562630        syn-C2H3C(O)NH2, v=0
  787815.8584  0.0021 -2.8106 3  509.2714103  71510 303513021      502922        syn-C2H3C(O)NH2, v=0
  787815.8584  0.0021 -2.8106 3  509.2714103  71510 303513022      502921        syn-C2H3C(O)NH2, v=0
  787840.8520  0.0035 -5.5953 3  137.4916 65  71510 303321221      31 724        syn-C2H3C(O)NH2, v=0
  787875.1840  0.1427 -4.7290 3 1686.2010245  71510 303C2 8B4      C1 9B3        syn-C2H3C(O)NH2, v=0
  787875.1840  0.1427 -4.7290 3 1686.2010245  71510 303C2 9B4      C1 8B3        syn-C2H3C(O)NH2, v=0
  787879.7924  0.1480 -4.7223 3 1690.3967247  71510 303C3 7B6      C2 8B5        syn-C2H3C(O)NH2, v=0
  787879.7924  0.1480 -4.7223 3 1690.3967247  71510 303C3 8B6      C2 7B5        syn-C2H3C(O)NH2, v=0
  787880.1748  0.1377 -4.7354 3 1681.4686243  71510 303C1 9B2      C010B1        syn-C2H3C(O)NH2, v=0
  787880.1748  0.1377 -4.7354 3 1681.4686243  71510 303C110B2      C0 9B1        syn-C2H3C(O)NH2, v=0
  787891.1268  0.1539 -4.7150 3 1694.0608249  71510 303C4 6B8      C3 7B7        syn-C2H3C(O)NH2, v=0
  787891.1268  0.1539 -4.7150 3 1694.0608249  71510 303C4 7B8      C3 6B7        syn-C2H3C(O)NH2, v=0
  787898.2202  0.1331 -4.7413 3 1676.1932241  71510 303C010B0      B911A9        syn-C2H3C(O)NH2, v=0
  787898.2202  0.1331 -4.7413 3 1676.1932241  71510 303C011B0      B910A9        syn-C2H3C(O)NH2, v=0
  787906.7775  0.1606 -4.7071 3 1697.1981251  71510 303C5 5C0      C4 6B9        syn-C2H3C(O)NH2, v=0
  787906.7775  0.1606 -4.7071 3 1697.1981251  71510 303C5 6C0      C4 5B9        syn-C2H3C(O)NH2, v=0
  787923.5898  0.1506 -5.4421 3 1799.7703187  71510 303935736      935637        syn-C2H3C(O)NH2, v=0
  787923.5898  0.1506 -5.4421 3 1799.7703187  71510 303935737      935638        syn-C2H3C(O)NH2, v=0
  787924.7074  0.1682 -4.6988 3 1699.8126253  71510 303C6 4C2      C5 5C1        syn-C2H3C(O)NH2, v=0
  787924.7074  0.1682 -4.6988 3 1699.8126253  71510 303C6 5C2      C5 4C1        syn-C2H3C(O)NH2, v=0
  787933.5136  0.1287 -4.7469 3 1670.3679239  71510 303B911A8      B812A7        syn-C2H3C(O)NH2, v=0
  787933.5136  0.1287 -4.7469 3 1670.3679239  71510 303B912A8      B811A7        syn-C2H3C(O)NH2, v=0
  787943.1817  0.1771 -4.6898 3 1701.9079255  71510 303C7 3C4      C6 4C3        syn-C2H3C(O)NH2, v=0
  787943.1817  0.1771 -4.6898 3 1701.9079255  71510 303C7 4C4      C6 3C3        syn-C2H3C(O)NH2, v=0
  787960.7119  0.1875 -4.6801 3 1703.4870257  71510 303C8 2C6      C7 3C5        syn-C2H3C(O)NH2, v=0
  787960.7119  0.1875 -4.6801 3 1703.4870257  71510 303C8 3C6      C7 2C5        syn-C2H3C(O)NH2, v=0
  787966.3350  0.0020 -2.8491 3  521.1804107  71510 303532924      522825        syn-C2H3C(O)NH2, v=0
  787966.3350  0.0020 -2.8491 3  521.1804107  71510 303532925      522824        syn-C2H3C(O)NH2, v=0
  787976.0123  0.1997 -4.6698 3 1704.5528259  71510 303C9 1C8      C8 2C7        syn-C2H3C(O)NH2, v=0
  787976.0123  0.1997 -4.6698 3 1704.5528259  71510 303C9 2C8      C8 1C7        syn-C2H3C(O)NH2, v=0
  787976.9191  0.0020 -2.8917 3  534.6271111  71510 303552827      542728        syn-C2H3C(O)NH2, v=0
  787976.9191  0.0020 -2.8917 3  534.6271111  71510 303552828      542727        syn-C2H3C(O)NH2, v=0
  787987.9644  0.2141 -4.6589 3 1705.1075261  71510 303D0 0D0      C9 1C9        syn-C2H3C(O)NH2, v=0
  787987.9644  0.2141 -4.6589 3 1705.1075261  71510 303D0 1D0      C9 0C9        syn-C2H3C(O)NH2, v=0
  787991.1959  0.1244 -4.7522 3 1663.9846237  71510 303B812A6      B713A5        syn-C2H3C(O)NH2, v=0
  787991.1959  0.1244 -4.7522 3 1663.9846237  71510 303B813A6      B712A5        syn-C2H3C(O)NH2, v=0
  788077.6414  0.1203 -4.7574 3 1657.0339235  71510 303B713A4      B614A3        syn-C2H3C(O)NH2, v=0
  788077.6414  0.1203 -4.7574 3 1657.0339235  71510 303B714A4      B613A3        syn-C2H3C(O)NH2, v=0
  788150.2901  0.0153 -5.1203 3  890.4350159  71510 303792456      792159        syn-C2H3C(O)NH2, v=0
  788200.8549  0.1162 -4.7625 3 1649.5047233  71510 303B614A2      B515A1        syn-C2H3C(O)NH2, v=0
  788200.8549  0.1162 -4.7625 3 1649.5047233  71510 303B615A2      B514A1        syn-C2H3C(O)NH2, v=0
  788244.0452  0.1500 -5.4052 3 1777.1549185  71510 303925735      925636        syn-C2H3C(O)NH2, v=0
  788244.0452  0.1500 -5.4052 3 1777.1549185  71510 303925736      925637        syn-C2H3C(O)NH2, v=0
  788317.0042  0.0032 -3.6721 3  383.9162109  71510 303541342      531043        syn-C2H3C(O)NH2, v=0
  788353.6662  0.0020 -4.9668 3  148.1144 63  71510 303311517      301218        syn-C2H3C(O)NH2, v=0
  788363.9273  0.0020 -4.9668 3  148.1140 63  71510 303311516      301219        syn-C2H3C(O)NH2, v=0
  788371.0379  0.1122 -4.7677 3 1641.3841231  71510 303B515A0      B41699        syn-C2H3C(O)NH2, v=0
  788371.0379  0.1122 -4.7677 3 1641.3841231  71510 303B516A0      B41599        syn-C2H3C(O)NH2, v=0
  788377.5934  0.0137 -5.0532 3  742.9564149  71510 303741857      741560        syn-C2H3C(O)NH2, v=0
  788556.2027  0.1495 -5.3692 3 1754.7857183  71510 303915734      915635        syn-C2H3C(O)NH2, v=0
  788556.2027  0.1495 -5.3692 3 1754.7857183  71510 303915735      915636        syn-C2H3C(O)NH2, v=0
  788601.4161  0.1082 -4.7731 3 1632.6567229  71510 303B41698      B31797        syn-C2H3C(O)NH2, v=0
  788601.4161  0.1082 -4.7731 3 1632.6567229  71510 303B41798      B31697        syn-C2H3C(O)NH2, v=0
  788605.7464  0.0031 -5.4337 3  145.6885 67  71510 303331222      32 725        syn-C2H3C(O)NH2, v=0
  788711.7744  0.0073 -4.9940 3  728.6373143  71510 303712349      712052        syn-C2H3C(O)NH2, v=0
  788723.4278  0.0062 -4.7078 3  217.6430 83  71510 303411130      40 833        syn-C2H3C(O)NH2, v=0
  788761.0502  0.0797 -4.8241 3 1525.8835213  71510 303A62383      A52482        syn-C2H3C(O)NH2, v=0
  788819.4376  0.0031 -3.2223 3  642.3259133  71510 303662344      652243        syn-C2H3C(O)NH2, v=0
  788829.0606  0.0031 -3.2223 3  642.3256133  71510 303662343      652244        syn-C2H3C(O)NH2, v=0
  788860.2291  0.1490 -5.3341 3 1732.6624181  71510 303905733      905634        syn-C2H3C(O)NH2, v=0
  788860.2291  0.1490 -5.3341 3 1732.6624181  71510 303905734      905635        syn-C2H3C(O)NH2, v=0
  788909.4900  0.1044 -4.7790 3 1623.3037227  71510 303B31796      B21895        syn-C2H3C(O)NH2, v=0
  788909.4900  0.1044 -4.7790 3 1623.3037227  71510 303B31896      B21795        syn-C2H3C(O)NH2, v=0
  788945.8493  0.0073 -4.9987 3  710.8293141  71510 303702347      702050        syn-C2H3C(O)NH2, v=0
  788948.7728  0.0027 -5.0324 3  402.7029103  71510 303512130      511833        syn-C2H3C(O)NH2, v=0
  788959.2587  0.0027 -5.0324 3  402.7025103  71510 303512131      511834        syn-C2H3C(O)NH2, v=0
  789058.9672  0.0050 -5.6009 3  355.9693101  71510 303501733      501238        syn-C2H3C(O)NH2, v=0
  789156.2888  0.1486 -5.2998 3 1710.7850179  71510 303895732      895633        syn-C2H3C(O)NH2, v=0
  789156.2888  0.1486 -5.2998 3 1710.7850179  71510 303895733      895634        syn-C2H3C(O)NH2, v=0
  789318.9969  0.1006 -4.7858 3 1613.3025225  71510 303B21894      B11993        syn-C2H3C(O)NH2, v=0
  789318.9974  0.1006 -4.7858 3 1613.3025225  71510 303B21994      B11893        syn-C2H3C(O)NH2, v=0
  789444.5432  0.1482 -5.2663 3 1689.1534177  71510 303885731      885632        syn-C2H3C(O)NH2, v=0
  789444.5432  0.1482 -5.2663 3 1689.1534177  71510 303885732      885633        syn-C2H3C(O)NH2, v=0
  789562.5136  0.0025 -4.2958 3  242.6042 85  71510 303421428      411131        syn-C2H3C(O)NH2, v=0
  789590.7647  0.0040 -4.1127 3  317.4019 97  71510 303481534      471235        syn-C2H3C(O)NH2, v=0
  789724.9138  0.0756 -4.4879 3 1222.5073189  71510 303942471      932370        syn-C2H3C(O)NH2, v=0
  789725.1515  0.1479 -5.2338 3 1667.7676175  71510 303875730      875631        syn-C2H3C(O)NH2, v=0
  789725.1515  0.1479 -5.2338 3 1667.7676175  71510 303875731      875632        syn-C2H3C(O)NH2, v=0
  789746.7688  0.4238 -5.6364 3 1773.3998227  71510 303B32885      B22984        syn-C2H3C(O)NH2, v=0
  789794.9843  0.0043 -3.3514 3  683.6599139  71510 303692248      682147        syn-C2H3C(O)NH2, v=0
  789850.0139  0.0051 -5.0357 3  595.0225135  71510 303671453      671156        syn-C2H3C(O)NH2, v=0
  789863.0434  0.0271 -5.1244 3  856.1639159  71510 303792060      791763        syn-C2H3C(O)NH2, v=0
  789863.1356  0.0969 -4.7937 3 1602.6246223  71510 303B11992      B02091        syn-C2H3C(O)NH2, v=0
  789863.1478  0.0969 -4.7937 3 1602.6246223  71510 303B12092      B01991        syn-C2H3C(O)NH2, v=0
  789892.4939  0.0784 -4.8228 3 1525.8603213  71510 303A62483      A52382        syn-C2H3C(O)NH2, v=0
  789998.2702  0.1477 -5.2022 3 1646.6274173  71510 303865729      865630        syn-C2H3C(O)NH2, v=0
  789998.2702  0.1477 -5.2022 3 1646.6274173  71510 303865730      865631        syn-C2H3C(O)NH2, v=0
  790001.3056  0.0044 -4.3677 3  231.1688 93  71510 30346 442      45 343        syn-C2H3C(O)NH2, v=0
  790001.3074  0.0044 -4.3677 3  231.1688 93  71510 30346 542      45 243        syn-C2H3C(O)NH2, v=0
  790154.6596  0.0244 -3.9524 3  913.2658163  71510 303812260      802159        syn-C2H3C(O)NH2, v=0
  790264.0534  0.1475 -5.1716 3 1625.7327171  71510 303855728      855629        syn-C2H3C(O)NH2, v=0
  790264.0534  0.1475 -5.1716 3 1625.7327171  71510 303855729      855630        syn-C2H3C(O)NH2, v=0
  790294.9853  0.0032 -3.7015 3  364.1086107  71510 303531142      521043        syn-C2H3C(O)NH2, v=0
  790313.1016  0.0043 -3.3509 3  683.6457139  71510 303692247      682148        syn-C2H3C(O)NH2, v=0
  790522.6528  0.1473 -5.1420 3 1605.0835169  71510 303845727      845628        syn-C2H3C(O)NH2, v=0
  790522.6528  0.1473 -5.1420 3 1605.0835169  71510 303845728      845629        syn-C2H3C(O)NH2, v=0
  790537.6810  0.0035 -4.2752 3  259.0377 89  71510 303441331      431034        syn-C2H3C(O)NH2, v=0
  790590.1181  0.0934 -4.8036 3 1591.2337221  71510 303B02090      A92189        syn-C2H3C(O)NH2, v=0
  790590.3576  0.0934 -4.8036 3 1591.2337221  71510 303B02190      A92089        syn-C2H3C(O)NH2, v=0
  790697.9872  0.0075 -5.3509 3  445.0205115  71510 303571641      571146        syn-C2H3C(O)NH2, v=0
  790774.2179  0.1472 -5.1133 3 1584.6796167  71510 303835726      835627        syn-C2H3C(O)NH2, v=0
  790774.2179  0.1472 -5.1133 3 1584.6796167  71510 303835727      835628        syn-C2H3C(O)NH2, v=0
  790775.7229  0.0062 -5.5237 3  140.5536 69  71510 30334 926      33 429        syn-C2H3C(O)NH2, v=0
  790793.2529  0.0036 -4.9417 3  568.0129125  71510 303622240      621943        syn-C2H3C(O)NH2, v=0
  790798.6008  0.1190 -5.0101 3 1547.9596213  71510 303A62581      A52680        syn-C2H3C(O)NH2, v=0
  790836.1004  0.0072 -4.9878 3  193.3148 79  71510 303391029      38 732        syn-C2H3C(O)NH2, v=0
  790985.8254  0.0471 -5.2756 3 1028.8787173  71510 303862364      862067        syn-C2H3C(O)NH2, v=0
  791018.8956  0.1472 -5.0858 3 1564.5210165  71510 303825725      825626        syn-C2H3C(O)NH2, v=0
  791018.8956  0.1472 -5.0858 3 1564.5210165  71510 303825726      825627        syn-C2H3C(O)NH2, v=0
  791085.8477  0.0050 -5.0345 3  595.0226135  71510 303671553      671256        syn-C2H3C(O)NH2, v=0
  791256.8307  0.1472 -5.0594 3 1544.6076163  71510 303815724      815625        syn-C2H3C(O)NH2, v=0
  791256.8307  0.1472 -5.0594 3 1544.6076163  71510 303815725      815626        syn-C2H3C(O)NH2, v=0
  791488.1657  0.1472 -5.0341 3 1524.9393161  71510 303805723      805624        syn-C2H3C(O)NH2, v=0
  791488.1657  0.1472 -5.0341 3 1524.9393161  71510 303805724      805625        syn-C2H3C(O)NH2, v=0
  791572.3487  0.0899 -4.8162 3 1579.0821219  71510 303A92188      A82287        syn-C2H3C(O)NH2, v=0
  791576.4069  0.0899 -4.8162 3 1579.0820219  71510 303A92288      A82187        syn-C2H3C(O)NH2, v=0
  791577.1315  0.0026 -3.1435 3  620.0565129  71510 303642441      632340        syn-C2H3C(O)NH2, v=0
  791577.3469  0.0026 -3.1435 3  620.0565129  71510 303642440      632341        syn-C2H3C(O)NH2, v=0
  791649.7536  0.0093 -3.6166 3  721.1459145  71510 303722052      711953        syn-C2H3C(O)NH2, v=0
  791694.7678  0.0036 -4.9408 3  567.9828125  71510 303622241      621944        syn-C2H3C(O)NH2, v=0
  791713.0410  0.1473 -5.0101 3 1505.5160159  71510 303795722      795623        syn-C2H3C(O)NH2, v=0
  791713.0410  0.1473 -5.0101 3 1505.5160159  71510 303795723      795624        syn-C2H3C(O)NH2, v=0
  791739.9781  0.0166 -5.1076 3  831.3861153  71510 303762452      762155        syn-C2H3C(O)NH2, v=0
  791931.5947  0.1474 -4.9873 3 1486.3377157  71510 303785721      785622        syn-C2H3C(O)NH2, v=0
  791931.5947  0.1474 -4.9873 3 1486.3377157  71510 303785722      785623        syn-C2H3C(O)NH2, v=0
  792121.4910  0.0028 -5.2991 3  154.0582 69  71510 303341223      33 726        syn-C2H3C(O)NH2, v=0
  792143.9628  0.1475 -4.9660 3 1467.4042155  71510 303775720      775621        syn-C2H3C(O)NH2, v=0
  792143.9628  0.1475 -4.9660 3 1467.4042155  71510 303775721      775622        syn-C2H3C(O)NH2, v=0
  792167.8009  0.0027 -5.0579 3  389.9827101  71510 303502129      501832        syn-C2H3C(O)NH2, v=0
  792173.0774  0.0027 -5.0579 3  389.9826101  71510 303502130      501833        syn-C2H3C(O)NH2, v=0
  792350.2793  0.1477 -4.9460 3 1448.7155153  71510 303765719      765620        syn-C2H3C(O)NH2, v=0
  792350.2793  0.1477 -4.9460 3 1448.7155153  71510 303765720      765621        syn-C2H3C(O)NH2, v=0
  792350.8088  0.0065 -3.5213 3  728.6373145  71510 303722151      712052        syn-C2H3C(O)NH2, v=0
  792409.5407  0.0105 -5.0551 3  697.8125145  71510 303721656      721359        syn-C2H3C(O)NH2, v=0
  792429.5152  0.0090 -2.6446 3  476.7832 77  71510 3033837 1      3736 2        syn-C2H3C(O)NH2, v=0
  792429.5152  0.0090 -2.6446 3  476.7832 77  71510 3033837 2      3736 1        syn-C2H3C(O)NH2, v=0
  792550.6759  0.1480 -4.9276 3 1430.2715151  71510 303755718      755619        syn-C2H3C(O)NH2, v=0
  792550.6759  0.1480 -4.9276 3 1430.2715151  71510 303755719      755620        syn-C2H3C(O)NH2, v=0
  792745.2826  0.1482 -4.9109 3 1412.0721149  71510 303745717      745618        syn-C2H3C(O)NH2, v=0
  792745.2826  0.1482 -4.9109 3 1412.0721149  71510 303745718      745619        syn-C2H3C(O)NH2, v=0
  792872.5597  0.0070 -2.6624 3  478.7772 81  71510 3034036 4      3935 5        syn-C2H3C(O)NH2, v=0
  792872.5597  0.0070 -2.6624 3  478.7772 81  71510 3034036 5      3935 4        syn-C2H3C(O)NH2, v=0
  792908.6221  0.0866 -4.8332 3 1566.1043217  71510 303A82286      A72385        syn-C2H3C(O)NH2, v=0
  792934.2269  0.1485 -4.8960 3 1394.1173147  71510 303735716      735617        syn-C2H3C(O)NH2, v=0
  792934.2269  0.1485 -4.8960 3 1394.1173147  71510 303735717      735618        syn-C2H3C(O)NH2, v=0
  792967.2504  0.0866 -4.8332 3 1566.1031217  71510 303A82386      A72285        syn-C2H3C(O)NH2, v=0
  793008.8116  0.0030 -3.6993 3  364.1066107  71510 303531242      52 943        syn-C2H3C(O)NH2, v=0
  793081.4465  0.0066 -5.2620 3  480.9015119  71510 303591742      591247        syn-C2H3C(O)NH2, v=0
  793117.6348  0.1488 -4.8830 3 1376.4069145  71510 303725715      725616        syn-C2H3C(O)NH2, v=0
  793117.6348  0.1488 -4.8830 3 1376.4069145  71510 303725716      725617        syn-C2H3C(O)NH2, v=0
  793263.0362  0.0023 -3.0752 3  599.5768125  71510 303622538      612437        syn-C2H3C(O)NH2, v=0
  793263.0396  0.0023 -3.0752 3  599.5768125  71510 303622537      612438        syn-C2H3C(O)NH2, v=0
  793295.6301  0.1492 -4.8722 3 1358.9409143  71510 303715714      715615        syn-C2H3C(O)NH2, v=0
  793295.6301  0.1492 -4.8722 3 1358.9409143  71510 303715715      715616        syn-C2H3C(O)NH2, v=0
  793305.1363  0.0054 -2.6827 3  482.2365 85  71510 3034235 7      4134 8        syn-C2H3C(O)NH2, v=0
  793305.1363  0.0054 -2.6827 3  482.2365 85  71510 3034235 8      4134 7        syn-C2H3C(O)NH2, v=0
  793325.8522  0.0029 -3.6891 3  423.7272113  71510 303561542      551243        syn-C2H3C(O)NH2, v=0
  793468.3345  0.1495 -4.8638 3 1341.7193141  71510 303705713      705614        syn-C2H3C(O)NH2, v=0
  793468.3345  0.1495 -4.8638 3 1341.7193141  71510 303705714      705615        syn-C2H3C(O)NH2, v=0
  793635.8680  0.1499 -4.8581 3 1324.7419139  71510 303695712      695613        syn-C2H3C(O)NH2, v=0
  793635.8680  0.1499 -4.8581 3 1324.7419139  71510 303695713      695614        syn-C2H3C(O)NH2, v=0
  793721.1917  0.0042 -2.7057 3  487.1665 89  71510 303443410      433311        syn-C2H3C(O)NH2, v=0
  793721.1917  0.0042 -2.7057 3  487.1665 89  71510 303443411      433310        syn-C2H3C(O)NH2, v=0
  793724.8411  0.0435 -5.2304 3  976.7033169  71510 303842263      841966        syn-C2H3C(O)NH2, v=0
  793798.3487  0.1504 -4.8553 3 1308.0086137  71510 303685711      685612        syn-C2H3C(O)NH2, v=0
  793798.3487  0.1504 -4.8553 3 1308.0086137  71510 303685712      685613        syn-C2H3C(O)NH2, v=0
  793817.1420  0.0037 -4.1836 3  249.4123 95  71510 30347 542      46 443        syn-C2H3C(O)NH2, v=0
  793817.1659  0.0037 -4.1836 3  249.4123 95  71510 30347 642      46 343        syn-C2H3C(O)NH2, v=0
  793820.2837  0.0043 -5.5577 3  334.6122107  71510 30353 746      53 449        syn-C2H3C(O)NH2, v=0
  793820.4636  0.0043 -5.5577 3  334.6122107  71510 30353 846      53 549        syn-C2H3C(O)NH2, v=0
  793863.6031  0.1497 -4.7731 3 1712.4817247  71510 303C3 8B5      C2 9B4        syn-C2H3C(O)NH2, v=0
  793863.6031  0.1497 -4.7731 3 1712.4817247  71510 303C3 9B5      C2 8B4        syn-C2H3C(O)NH2, v=0
  793867.3522  0.1445 -4.7792 3 1707.7494245  71510 303C2 9B3      C110B2        syn-C2H3C(O)NH2, v=0
  793867.3522  0.1445 -4.7792 3 1707.7494245  71510 303C210B3      C1 9B2        syn-C2H3C(O)NH2, v=0
  793869.1348  0.1553 -4.7664 3 1716.6775249  71510 303C4 7B7      C3 8B6        syn-C2H3C(O)NH2, v=0
  793869.1348  0.1553 -4.7664 3 1716.6775249  71510 303C4 8B7      C3 7B6        syn-C2H3C(O)NH2, v=0
  793881.1450  0.1614 -4.7593 3 1720.3421251  71510 303C5 6B9      C4 7B8        syn-C2H3C(O)NH2, v=0
  793881.1450  0.1614 -4.7593 3 1720.3421251  71510 303C5 7B9      C4 6B8        syn-C2H3C(O)NH2, v=0
  793881.6928  0.0020 -4.9010 3  155.8126 65  71510 303321518      311219        syn-C2H3C(O)NH2, v=0
  793883.7446  0.1397 -4.7850 3 1702.4746243  71510 303C110B1      C011B0        syn-C2H3C(O)NH2, v=0
  793883.7446  0.1397 -4.7850 3 1702.4746243  71510 303C111B1      C010B0        syn-C2H3C(O)NH2, v=0
  793897.2786  0.1684 -4.7516 3 1723.4799253  71510 303C6 5C1      C5 6C0        syn-C2H3C(O)NH2, v=0
  793897.2786  0.1684 -4.7516 3 1723.4799253  71510 303C6 6C1      C5 5C0        syn-C2H3C(O)NH2, v=0
  793904.0243  0.0020 -4.9010 3  155.8118 65  71510 303321517      311220        syn-C2H3C(O)NH2, v=0
  793907.9636  0.1890 -5.1953 3 1612.3847217  71510 303A82682      A72781        syn-C2H3C(O)NH2, v=0
  793915.5407  0.1763 -4.7433 3 1726.0950255  71510 303C7 4C3      C6 5C2        syn-C2H3C(O)NH2, v=0
  793915.5407  0.1763 -4.7433 3 1726.0950255  71510 303C7 5C3      C6 4C2        syn-C2H3C(O)NH2, v=0
  793916.8513  0.1351 -4.7904 3 1696.6505241  71510 303C011A9      B912A8        syn-C2H3C(O)NH2, v=0
  793916.8513  0.1351 -4.7904 3 1696.6505241  71510 303C012A9      B911A8        syn-C2H3C(O)NH2, v=0
  793934.2291  0.1856 -4.7345 3 1728.1908257  71510 303C8 3C5      C7 4C4        syn-C2H3C(O)NH2, v=0
  793934.2291  0.1856 -4.7345 3 1728.1908257  71510 303C8 4C5      C7 3C4        syn-C2H3C(O)NH2, v=0
  793951.8806  0.1963 -4.7249 3 1729.7706259  71510 303C9 2C7      C8 3C6        syn-C2H3C(O)NH2, v=0
  793951.8806  0.1963 -4.7249 3 1729.7706259  71510 303C9 3C7      C8 2C6        syn-C2H3C(O)NH2, v=0
  793955.8926  0.1508 -4.8561 3 1291.5195135  71510 303675710      675611        syn-C2H3C(O)NH2, v=0
  793955.8926  0.1508 -4.8561 3 1291.5195135  71510 303675711      675612        syn-C2H3C(O)NH2, v=0
  793967.2291  0.2090 -4.7148 3 1730.8368261  71510 303D0 1C9      C9 2C8        syn-C2H3C(O)NH2, v=0
  793967.2291  0.2090 -4.7148 3 1730.8368261  71510 303D0 2C9      C9 1C8        syn-C2H3C(O)NH2, v=0
  793971.6503  0.1307 -4.7955 3 1690.2692239  71510 303B912A7      B813A6        syn-C2H3C(O)NH2, v=0
  793971.6503  0.1307 -4.7955 3 1690.2692239  71510 303B913A7      B812A6        syn-C2H3C(O)NH2, v=0
  793979.1711  0.2239 -4.7039 3 1731.3919263  71510 303D1 0D1      D0 1D0        syn-C2H3C(O)NH2, v=0
  793979.1711  0.2239 -4.7039 3 1731.3919263  71510 303D1 1D1      D0 0D0        syn-C2H3C(O)NH2, v=0
  794027.3012  0.0050 -4.4717 3  243.1793 87  71510 303431231      42 934        syn-C2H3C(O)NH2, v=0
  794054.2963  0.1263 -4.8004 3 1683.3213237  71510 303B813A5      B714A4        syn-C2H3C(O)NH2, v=0
  794054.2963  0.1263 -4.8004 3 1683.3213237  71510 303B814A5      B713A4        syn-C2H3C(O)NH2, v=0
  794108.6141  0.1513 -4.8609 3 1275.2744133  71510 3036657 9      665610        syn-C2H3C(O)NH2, v=0
  794108.6141  0.1513 -4.8609 3 1275.2744133  71510 303665710      665611        syn-C2H3C(O)NH2, v=0
  794112.2515  0.0033 -2.7316 3  493.5739 93  71510 303463313      453214        syn-C2H3C(O)NH2, v=0
  794112.2515  0.0033 -2.7316 3  493.5739 93  71510 303463314      453213        syn-C2H3C(O)NH2, v=0
  794172.4941  0.1221 -4.8052 3 1675.7963235  71510 303B714A3      B615A2        syn-C2H3C(O)NH2, v=0
  794172.4941  0.1221 -4.8052 3 1675.7963235  71510 303B715A3      B614A2        syn-C2H3C(O)NH2, v=0
  794202.2953  0.0068 -3.7132 3  502.8399123  71510 303611546      601447        syn-C2H3C(O)NH2, v=0
  794256.6255  0.1518 -4.8704 3 1259.2733131  71510 3036557 8      6556 9        syn-C2H3C(O)NH2, v=0
  794256.6255  0.1518 -4.8704 3 1259.2733131  71510 3036557 9      655610        syn-C2H3C(O)NH2, v=0
  794271.5789  0.0021 -3.0148 3  580.8005121  71510 303602634      592535        syn-C2H3C(O)NH2, v=0
  794271.5789  0.0021 -3.0148 3  580.8005121  71510 303602635      592534        syn-C2H3C(O)NH2, v=0
  794305.9453  0.0696 -4.8019 3 1458.1614207  71510 303A32579      A22478        syn-C2H3C(O)NH2, v=0
  794336.0273  0.1179 -4.8101 3 1667.6814233  71510 303B615A1      B516A0        syn-C2H3C(O)NH2, v=0
  794336.0273  0.1179 -4.8101 3 1667.6814233  71510 303B616A1      B515A0        syn-C2H3C(O)NH2, v=0
  794400.0374  0.1523 -4.8859 3 1243.5160129  71510 3036457 7      6456 8        syn-C2H3C(O)NH2, v=0
  794400.0374  0.1523 -4.8859 3 1243.5160129  71510 3036457 8      6456 9        syn-C2H3C(O)NH2, v=0
  794466.5431  0.0027 -2.7606 3  501.4670 97  71510 303483216      473117        syn-C2H3C(O)NH2, v=0
  794466.5431  0.0027 -2.7606 3  501.4670 97  71510 303483217      473116        syn-C2H3C(O)NH2, v=0
  794538.9587  0.1528 -4.9086 3 1228.0026127  71510 3036357 6      6356 7        syn-C2H3C(O)NH2, v=0
  794538.9587  0.1528 -4.9086 3 1228.0026127  71510 3036357 7      6356 8        syn-C2H3C(O)NH2, v=0
  794539.8412  0.0854 -4.8998 3 1537.2815213  71510 303A62482      A52581        syn-C2H3C(O)NH2, v=0
  794553.5269  0.0839 -4.8579 3 1552.2083215  71510 303A72384      A62483        syn-C2H3C(O)NH2, v=0
  794557.5284  0.1138 -4.8152 3 1658.9616231  71510 303B51699      B41798        syn-C2H3C(O)NH2, v=0
  794557.5284  0.1138 -4.8152 3 1658.9616231  71510 303B51799      B41698        syn-C2H3C(O)NH2, v=0
  794642.9884  0.0040 -5.1004 3  166.8433 73  71510 303361126      35 629        syn-C2H3C(O)NH2, v=0
  794673.4962  0.1534 -4.9406 3 1212.7330125  71510 3036257 5      6256 6        syn-C2H3C(O)NH2, v=0
  794673.4962  0.1534 -4.9406 3 1212.7330125  71510 3036257 6      6256 7        syn-C2H3C(O)NH2, v=0
  794767.7609  0.0023 -2.7928 3  510.8557101  71510 303503119      493020        syn-C2H3C(O)NH2, v=0
  794767.7609  0.0023 -2.7928 3  510.8557101  71510 303503120      493019        syn-C2H3C(O)NH2, v=0
  794803.7551  0.1539 -4.9854 3 1197.7071123  71510 3036157 4      6156 5        syn-C2H3C(O)NH2, v=0
  794803.7551  0.1539 -4.9854 3 1197.7071123  71510 3036157 5      6156 6        syn-C2H3C(O)NH2, v=0
  794814.9692  0.0720 -4.7742 3 1432.1176205  71510 303A22578      A12477        syn-C2H3C(O)NH2, v=0
  794829.3185  0.0021 -2.9608 3  563.6682117  71510 303582731      572632        syn-C2H3C(O)NH2, v=0
  794829.3185  0.0021 -2.9608 3  563.6682117  71510 303582732      572631        syn-C2H3C(O)NH2, v=0
  794853.6313  0.1098 -4.8207 3 1649.6189229  71510 303B41797      B31896        syn-C2H3C(O)NH2, v=0
  794853.6313  0.1098 -4.8207 3 1649.6189229  71510 303B41897      B31796        syn-C2H3C(O)NH2, v=0
  794884.6781  0.0078 -5.2729 3  170.2095 75  71510 30337 928      36 631        syn-C2H3C(O)NH2, v=0
  794929.8389  0.1545 -5.0483 3 1182.9248121  71510 3036057 3      6056 4        syn-C2H3C(O)NH2, v=0
  794929.8389  0.1545 -5.0483 3 1182.9248121  71510 3036057 4      6056 5        syn-C2H3C(O)NH2, v=0
  794938.0958  0.0470 -5.3337 3 1082.1749177  71510 303882465      882168        syn-C2H3C(O)NH2, v=0
  794993.2890  0.0021 -2.8286 3  521.7526105  71510 303523022      512923        syn-C2H3C(O)NH2, v=0
  794993.2890  0.0021 -2.8286 3  521.7526105  71510 303523023      512922        syn-C2H3C(O)NH2, v=0
  795051.8491  0.1551 -5.1396 3 1168.3861119  71510 3035957 2      5956 3        syn-C2H3C(O)NH2, v=0
  795051.8491  0.1551 -5.1396 3 1168.3861119  71510 3035957 3      5956 4        syn-C2H3C(O)NH2, v=0
  795073.4010  0.0024 -5.5822 3  113.1758 51  71510 303251610      241311        syn-C2H3C(O)NH2, v=0
  795073.4024  0.0024 -5.5822 3  113.1758 51  71510 3032516 9      241312        syn-C2H3C(O)NH2, v=0
  795078.1606  0.0020 -2.9122 3  548.1365113  71510 303562828      552729        syn-C2H3C(O)NH2, v=0
  795078.1606  0.0020 -2.9122 3  548.1365113  71510 303562829      552728        syn-C2H3C(O)NH2, v=0
  795111.5793  0.0021 -2.8683 3  534.1730109  71510 303542925      532826        syn-C2H3C(O)NH2, v=0
  795111.5793  0.0021 -2.8683 3  534.1730109  71510 303542926      532825        syn-C2H3C(O)NH2, v=0
  795139.8849  0.0035 -3.2529 3  658.8398135  71510 303672345      662244        syn-C2H3C(O)NH2, v=0
  795158.0698  0.0035 -3.2529 3  658.8393135  71510 303672344      662245        syn-C2H3C(O)NH2, v=0
  795159.0359  0.0026 -5.0854 3  377.5275 99  71510 303492128      491831        syn-C2H3C(O)NH2, v=0
  795161.6394  0.0026 -5.0854 3  377.5274 99  71510 303492129      491832        syn-C2H3C(O)NH2, v=0
  795169.8856  0.1557 -5.2825 3 1154.0909117  71510 3035857 1      5856 2        syn-C2H3C(O)NH2, v=0
  795169.8856  0.1557 -5.2825 3 1154.0909117  71510 3035857 2      5856 3        syn-C2H3C(O)NH2, v=0
  795246.7674  0.1059 -4.8269 3 1639.6313227  71510 303B31895      B21994        syn-C2H3C(O)NH2, v=0
  795246.7677  0.1059 -4.8269 3 1639.6313227  71510 303B31995      B21894        syn-C2H3C(O)NH2, v=0
  795249.7651  0.0143 -5.1098 3  870.2768157  71510 303782455      782158        syn-C2H3C(O)NH2, v=0
  795261.9954  0.0830 -4.8571 3 1552.1937215  71510 303A72484      A62383        syn-C2H3C(O)NH2, v=0
  795273.3498  0.0048 -3.3877 3  701.0785141  71510 303702249      692148        syn-C2H3C(O)NH2, v=0
  795284.0465  0.1563 -5.5508 3 1140.0391115  71510 3035757 0      5756 1        syn-C2H3C(O)NH2, v=0
  795284.0465  0.1563 -5.5508 3 1140.0391115  71510 3035757 1      5756 2        syn-C2H3C(O)NH2, v=0
  795507.1936  0.0705 -4.8307 3 1484.3394209  71510 303A42580      A32479        syn-C2H3C(O)NH2, v=0
  795512.7769  0.0080 -5.5527 3  148.3428 71  71510 30335 827      34 530        syn-C2H3C(O)NH2, v=0
  795582.3522  0.0046 -5.0613 3  554.1030131  71510 303651352      651055        syn-C2H3C(O)NH2, v=0
  795744.9552  0.0025 -4.2656 3  253.2002 87  71510 303431429      421132        syn-C2H3C(O)NH2, v=0
  795768.0859  0.1021 -4.8343 3 1628.9716225  71510 303B21993      B12092        syn-C2H3C(O)NH2, v=0
  795768.0927  0.1021 -4.8343 3 1628.9716225  71510 303B22093      B11992        syn-C2H3C(O)NH2, v=0
  796018.9256  0.0046 -5.0609 3  554.1030131  71510 303651452      651155        syn-C2H3C(O)NH2, v=0
  796166.7903  0.0049 -3.3868 3  701.0542141  71510 303702248      692149        syn-C2H3C(O)NH2, v=0
  796250.3732  0.0050 -5.2762 3  472.7366117  71510 303581840      581345        syn-C2H3C(O)NH2, v=0
  796319.2916  0.0028 -3.7393 3  344.4523105  71510 303521042      51 943        syn-C2H3C(O)NH2, v=0
  796388.0253  0.0065 -4.9921 3  710.5804141  71510 303702348      702051        syn-C2H3C(O)NH2, v=0
  796462.4406  0.0983 -4.8433 3 1617.6050223  71510 303B12091      B02190        syn-C2H3C(O)NH2, v=0
  796462.5772  0.0983 -4.8433 3 1617.6050223  71510 303B12191      B02090        syn-C2H3C(O)NH2, v=0
  796691.8732  0.0052 -5.2474 3  487.6286119  71510 303591841      591346        syn-C2H3C(O)NH2, v=0
  796721.8722  0.0091 -3.7208 3  595.6462133  71510 303661749      651650        syn-C2H3C(O)NH2, v=0
  796794.7319  0.0032 -4.0464 3  267.9287 97  71510 30348 642      47 543        syn-C2H3C(O)NH2, v=0
  796794.9816  0.0032 -4.0464 3  267.9287 97  71510 30348 742      47 443        syn-C2H3C(O)NH2, v=0
  796876.8360  0.0034 -4.9499 3  552.3633123  71510 303612239      611942        syn-C2H3C(O)NH2, v=0
  796893.9258  0.0027 -3.7388 3  344.4520105  71510 303521142      51 843        syn-C2H3C(O)NH2, v=0
  797360.8469  0.0040 -5.4162 3  368.0490111  71510 30355 847      55 550        syn-C2H3C(O)NH2, v=0
  797361.6617  0.0040 -5.4162 3  368.0490111  71510 30355 947      55 650        syn-C2H3C(O)NH2, v=0
  797396.8699  0.0948 -4.8550 3 1605.4862221  71510 303B02189      A92288        syn-C2H3C(O)NH2, v=0
  797399.2414  0.0948 -4.8550 3 1605.4861221  71510 303B02289      A92188        syn-C2H3C(O)NH2, v=0
  797399.9087  0.0034 -4.9494 3  552.3458123  71510 303612240      611943        syn-C2H3C(O)NH2, v=0
  797477.8252  0.0780 -4.7472 3 1406.1969203  71510 303A12577      A02476        syn-C2H3C(O)NH2, v=0
  797661.2088  0.0096 -5.0506 3  697.8129145  71510 303721756      721459        syn-C2H3C(O)NH2, v=0
  797939.2519  0.0026 -5.1150 3  365.3358 97  71510 303482127      481830        syn-C2H3C(O)NH2, v=0
  797940.5108  0.0026 -5.1150 3  365.3358 97  71510 303482128      481831        syn-C2H3C(O)NH2, v=0
  798005.2850  0.0735 -4.8607 3 1510.6629211  71510 303A52581      A42480        syn-C2H3C(O)NH2, v=0
  798194.5557  0.0029 -3.1714 3  635.9860131  71510 303652442      642341        syn-C2H3C(O)NH2, v=0
  798194.9937  0.0029 -3.1714 3  635.9860131  71510 303652441      642342        syn-C2H3C(O)NH2, v=0
  798364.1083  0.0491 -4.2093 3 1050.8503175  71510 303872365      862264        syn-C2H3C(O)NH2, v=0
  798382.9359  0.0041 -4.1777 3  305.0206 95  71510 303471533      461234        syn-C2H3C(O)NH2, v=0
  798406.8329  0.0063 -5.0826 3  204.5369 91  71510 30345 243      44 144        syn-C2H3C(O)NH2, v=0
  798406.8329  0.0063 -5.0826 3  204.5369 91  71510 30345 343      44 044        syn-C2H3C(O)NH2, v=0
  798517.2514  0.0028 -5.1931 3  162.5978 71  71510 303351224      34 727        syn-C2H3C(O)NH2, v=0
  798667.4889  0.0913 -4.8706 3 1592.5536219  71510 303A92287      A82386        syn-C2H3C(O)NH2, v=0
  798702.7315  0.0913 -4.8705 3 1592.5529219  71510 303A92387      A82286        syn-C2H3C(O)NH2, v=0
  798794.8804  0.0028 -3.9404 3  286.7060 99  71510 30349 742      48 643        syn-C2H3C(O)NH2, v=0
  798797.0659  0.0028 -3.9404 3  286.7060 99  71510 30349 842      48 543        syn-C2H3C(O)NH2, v=0
  798986.5682  0.0026 -3.7908 3  324.9852103  71510 30351 942      50 843        syn-C2H3C(O)NH2, v=0
  799084.5086  0.0045 -5.0992 3  514.4066127  71510 303631251      63 954        syn-C2H3C(O)NH2, v=0
  799090.7904  0.0026 -3.7907 3  324.9852103  71510 303511042      50 743        syn-C2H3C(O)NH2, v=0
  799159.0109  0.0063 -4.9956 3  692.9584139  71510 303692346      692049        syn-C2H3C(O)NH2, v=0
  799186.4580  0.0020 -4.8387 3  163.7727 67  71510 303331519      321220        syn-C2H3C(O)NH2, v=0
  799228.5550  0.0045 -5.0990 3  514.4066127  71510 303631351      631054        syn-C2H3C(O)NH2, v=0
  799233.4880  0.0020 -4.8386 3  163.7711 67  71510 303331518      321221        syn-C2H3C(O)NH2, v=0
  799624.7294  0.0026 -3.8568 3  305.7302101  71510 30350 842      49 743        syn-C2H3C(O)NH2, v=0
  799635.6363  0.0050 -5.3243 3  458.0004115  71510 303571839      571344        syn-C2H3C(O)NH2, v=0
  799641.0129  0.0026 -3.8568 3  305.7301101  71510 30350 942      49 643        syn-C2H3C(O)NH2, v=0
  799678.5277  0.0088 -2.6569 3  486.0190 79  71510 3033937 2      3836 3        syn-C2H3C(O)NH2, v=0
  799678.5277  0.0088 -2.6569 3  486.0190 79  71510 3033937 3      3836 2        syn-C2H3C(O)NH2, v=0
  799731.2577  0.0275 -5.3175 3 1068.9099175  71510 303872563      872266        syn-C2H3C(O)NH2, v=0
  799773.6911  0.0039 -5.3054 3  402.7557115  71510 30357 948      57 651        syn-C2H3C(O)NH2, v=0
  799777.0457  0.0039 -5.3054 3  402.7557115  71510 303571048      57 751        syn-C2H3C(O)NH2, v=0
  799850.9940  0.1570 -4.8176 3 1738.9622249  71510 303C4 8B6      C3 9B5        syn-C2H3C(O)NH2, v=0
  799850.9940  0.1570 -4.8176 3 1738.9622249  71510 303C4 9B6      C3 8B5        syn-C2H3C(O)NH2, v=0
  799853.5302  0.1516 -4.8236 3 1734.2300247  71510 303C3 9B4      C210B3        syn-C2H3C(O)NH2, v=0
  799853.5302  0.1516 -4.8236 3 1734.2300247  71510 303C310B4      C2 9B3        syn-C2H3C(O)NH2, v=0
  799857.4296  0.1628 -4.8111 3 1743.1581251  71510 303C5 7B8      C4 8B7        syn-C2H3C(O)NH2, v=0
  799857.4296  0.1628 -4.8111 3 1743.1581251  71510 303C5 8B8      C4 7B7        syn-C2H3C(O)NH2, v=0
  799868.3115  0.1466 -4.8292 3 1728.9557245  71510 303C210B2      C111B1        syn-C2H3C(O)NH2, v=0
  799868.3115  0.1466 -4.8292 3 1728.9557245  71510 303C211B2      C110B1        syn-C2H3C(O)NH2, v=0
  799870.1029  0.1692 -4.8041 3 1746.8231253  71510 303C6 6C0      C5 7B9        syn-C2H3C(O)NH2, v=0
  799870.1029  0.1692 -4.8041 3 1746.8231253  71510 303C6 7C0      C5 6B9        syn-C2H3C(O)NH2, v=0
  799883.3083  0.0310 -5.3436 3 1091.2633177  71510 303882564      882267        syn-C2H3C(O)NH2, v=0
  799886.7114  0.1765 -4.7966 3 1749.9614255  71510 303C7 5C2      C6 6C1        syn-C2H3C(O)NH2, v=0
  799886.7114  0.1765 -4.7966 3 1749.9614255  71510 303C7 6C2      C6 5C1        syn-C2H3C(O)NH2, v=0
  799899.2919  0.1418 -4.8343 3 1723.1327243  71510 303C111B0      C012A9        syn-C2H3C(O)NH2, v=0
  799899.2919  0.1418 -4.8343 3 1723.1327243  71510 303C112B0      C011A9        syn-C2H3C(O)NH2, v=0
  799905.3008  0.1848 -4.7884 3 1752.5771257  71510 303C8 4C4      C7 5C3        syn-C2H3C(O)NH2, v=0
  799905.3008  0.1848 -4.7884 3 1752.5771257  71510 303C8 5C4      C7 4C3        syn-C2H3C(O)NH2, v=0
  799924.2004  0.1943 -4.7797 3 1754.6736259  71510 303C9 3C6      C8 4C5        syn-C2H3C(O)NH2, v=0
  799924.2004  0.1943 -4.7797 3 1754.6736259  71510 303C9 4C6      C8 3C5        syn-C2H3C(O)NH2, v=0
  799941.9718  0.2056 -4.7702 3 1756.2539261  71510 303D0 2C8      C9 3C7        syn-C2H3C(O)NH2, v=0
  799941.9718  0.2056 -4.7702 3 1756.2539261  71510 303D0 3C8      C9 2C7        syn-C2H3C(O)NH2, v=0
  799951.2942  0.1371 -4.8392 3 1716.7532241  71510 303C012A8      B913A7        syn-C2H3C(O)NH2, v=0
  799951.2942  0.1371 -4.8392 3 1716.7532241  71510 303C013A8      B912A7        syn-C2H3C(O)NH2, v=0
  799957.3677  0.2187 -4.7602 3 1757.3207263  71510 303D1 1D0      D0 2C9        syn-C2H3C(O)NH2, v=0
  799957.3677  0.2187 -4.7602 3 1757.3207263  71510 303D1 2D0      D0 1C9        syn-C2H3C(O)NH2, v=0
  799969.2994  0.2341 -4.7494 3 1757.8762265  71510 303D2 0D2      D1 1D1        syn-C2H3C(O)NH2, v=0
  799969.2994  0.2341 -4.7494 3 1757.8762265  71510 303D2 1D2      D1 0D1        syn-C2H3C(O)NH2, v=0
  799980.1411  0.0208 -5.1058 3  808.0485155  71510 303771959      771662        syn-C2H3C(O)NH2, v=0
  800030.2643  0.1326 -4.8439 3 1709.8081239  71510 303B913A6      B814A5        syn-C2H3C(O)NH2, v=0
  800030.2643  0.1326 -4.8439 3 1709.8081239  71510 303B914A6      B813A5        syn-C2H3C(O)NH2, v=0
  800067.9883  0.0025 -3.1010 3  614.9444127  71510 303632539      622438        syn-C2H3C(O)NH2, v=0
  800067.9957  0.0025 -3.1010 3  614.9444127  71510 303632538      622439        syn-C2H3C(O)NH2, v=0
  800118.9252  0.0069 -2.6754 3  488.5057 83  71510 3034136 5      4035 6        syn-C2H3C(O)NH2, v=0
  800118.9252  0.0069 -2.6754 3  488.5057 83  71510 3034136 6      4035 5        syn-C2H3C(O)NH2, v=0
  800143.6228  0.1282 -4.8485 3 1702.2870237  71510 303B814A4      B715A3        syn-C2H3C(O)NH2, v=0
  800143.6228  0.1282 -4.8485 3 1702.2870237  71510 303B815A4      B714A3        syn-C2H3C(O)NH2, v=0
  800244.5959  0.0077 -3.5679 3  746.9693147  71510 303732152      722053        syn-C2H3C(O)NH2, v=0
  800300.7600  0.1239 -4.8530 3 1694.1776235  71510 303B715A2      B616A1        syn-C2H3C(O)NH2, v=0
  800300.7600  0.1239 -4.8530 3 1694.1776235  71510 303B716A2      B615A1        syn-C2H3C(O)NH2, v=0
  800302.2473  0.0883 -4.8929 3 1578.7208217  71510 303A82385      A72484        syn-C2H3C(O)NH2, v=0
  800370.3926  0.0200 -3.8894 3  892.2608161  71510 303802259      792158        syn-C2H3C(O)NH2, v=0
  800460.2493  0.0054 -3.4256 3  718.7824143  71510 303712250      702149        syn-C2H3C(O)NH2, v=0
  800513.7517  0.1197 -4.8578 3 1685.4652233  71510 303B616A0      B51799        syn-C2H3C(O)NH2, v=0
  800513.7517  0.1197 -4.8578 3 1685.4652233  71510 303B617A0      B51699        syn-C2H3C(O)NH2, v=0
  800523.3651  0.0026 -5.1467 3  353.4066 95  71510 303472126      471829        syn-C2H3C(O)NH2, v=0
  800523.9613  0.0026 -5.1467 3  353.4066 95  71510 303472127      471830        syn-C2H3C(O)NH2, v=0
  800547.1946  0.0053 -2.6965 3  492.4593 87  71510 3034335 8      4234 9        syn-C2H3C(O)NH2, v=0
  800547.1946  0.0053 -2.6965 3  492.4593 87  71510 3034335 9      4234 8        syn-C2H3C(O)NH2, v=0
  800700.7316  0.0037 -3.6912 3  397.0187111  71510 303551243      541144        syn-C2H3C(O)NH2, v=0
  800742.7241  0.0877 -4.8924 3 1578.7117217  71510 303A82485      A72384        syn-C2H3C(O)NH2, v=0
  800788.5901  0.0043 -5.1508 3  475.9436123  71510 303611150      61 853        syn-C2H3C(O)NH2, v=0
  800791.2286  0.1688 -5.6456 3 1918.9314195  71510 303975839      975740        syn-C2H3C(O)NH2, v=0
  800791.2286  0.1688 -5.6456 3 1918.9314195  71510 303975840      975741        syn-C2H3C(O)NH2, v=0
  800798.4249  0.1155 -4.8629 3 1676.1324231  71510 303B51798      B41897        syn-C2H3C(O)NH2, v=0
  800798.4249  0.1155 -4.8629 3 1676.1324231  71510 303B51898      B41797        syn-C2H3C(O)NH2, v=0
  800832.9185  0.0043 -5.1508 3  475.9436123  71510 303611250      61 953        syn-C2H3C(O)NH2, v=0
  800879.4053  0.0056 -5.2368 3  502.6842121  71510 303601842      601347        syn-C2H3C(O)NH2, v=0
  800956.7265  0.0041 -2.7204 3  497.8855 91  71510 303453411      443312        syn-C2H3C(O)NH2, v=0
  800956.7265  0.0041 -2.7204 3  497.8855 91  71510 303453412      443311        syn-C2H3C(O)NH2, v=0
  800959.2438  0.0041 -5.2185 3  438.7235119  71510 303591049      59 752        syn-C2H3C(O)NH2, v=0
  800971.9246  0.0041 -5.2185 3  438.7235119  71510 303591149      59 852        syn-C2H3C(O)NH2, v=0
  801092.9461  0.0880 -4.9293 3 1563.8755215  71510 303A72483      A62582        syn-C2H3C(O)NH2, v=0
  801133.7051  0.0375 -5.1954 3  925.6583165  71510 303822162      821865        syn-C2H3C(O)NH2, v=0
  801135.1220  0.1680 -5.6059 3 1895.3425193  71510 303965838      965739        syn-C2H3C(O)NH2, v=0
  801135.1220  0.1680 -5.6059 3 1895.3425193  71510 303965839      965740        syn-C2H3C(O)NH2, v=0
  801176.0038  0.1114 -4.8686 3 1666.1579229  71510 303B41896      B31995        syn-C2H3C(O)NH2, v=0
  801176.0039  0.1114 -4.8686 3 1666.1579229  71510 303B41996      B31895        syn-C2H3C(O)NH2, v=0
  801186.3313  0.1109 -5.0271 3 1574.8121215  71510 303A72582      A62681        syn-C2H3C(O)NH2, v=0
  801204.0025  0.0022 -3.0388 3  595.6221123  71510 303612636      602535        syn-C2H3C(O)NH2, v=0
  801204.0026  0.0022 -3.0388 3  595.6221123  71510 303612635      602536        syn-C2H3C(O)NH2, v=0
  801338.3222  0.0033 -2.7472 3  504.7914 95  71510 303473314      463215        syn-C2H3C(O)NH2, v=0
  801338.3222  0.0033 -2.7472 3  504.7914 95  71510 303473315      463214        syn-C2H3C(O)NH2, v=0
  801377.1655  0.0039 -3.2846 3  675.6237137  71510 303682346      672245        syn-C2H3C(O)NH2, v=0
  801411.0298  0.0039 -3.2846 3  675.6228137  71510 303682345      672246        syn-C2H3C(O)NH2, v=0
  801454.2772  0.0778 -4.8919 3 1537.1419213  71510 303A62582      A52481        syn-C2H3C(O)NH2, v=0
  801470.4362  0.1673 -5.5670 3 1871.9998191  71510 303955837      955738        syn-C2H3C(O)NH2, v=0
  801470.4362  0.1673 -5.5670 3 1871.9998191  71510 303955838      955739        syn-C2H3C(O)NH2, v=0
  801631.3446  0.0254 -5.2946 3 1046.7726173  71510 303862562      862265        syn-C2H3C(O)NH2, v=0
  801675.7602  0.1074 -4.8754 3 1655.5155227  71510 303B31994      B22093        syn-C2H3C(O)NH2, v=0
  801675.7639  0.1074 -4.8754 3 1655.5155227  71510 303B32094      B21993        syn-C2H3C(O)NH2, v=0
  801679.2581  0.0027 -2.7771 3  513.1855 99  71510 303493217      483118        syn-C2H3C(O)NH2, v=0
  801679.2581  0.0027 -2.7771 3  513.1855 99  71510 303493218      483117        syn-C2H3C(O)NH2, v=0
  801706.7439  0.0023 -5.4815 3  119.3170 53  71510 303261611      251312        syn-C2H3C(O)NH2, v=0
  801706.7483  0.0023 -5.4815 3  119.3170 53  71510 303261610      251313        syn-C2H3C(O)NH2, v=0
  801747.0610  0.0085 -5.5162 3  410.3035111  71510 303551540      551045        syn-C2H3C(O)NH2, v=0
  801768.1574  0.0322 -5.2346 3  940.6445163  71510 303812556      812259        syn-C2H3C(O)NH2, v=0
  801797.3381  0.1666 -5.5289 3 1848.9032189  71510 303945836      945737        syn-C2H3C(O)NH2, v=0
  801797.3381  0.1666 -5.5289 3 1848.9032189  71510 303945837      945738        syn-C2H3C(O)NH2, v=0
  801851.5989  0.0021 -2.9833 3  577.9555119  71510 303592732      582633        syn-C2H3C(O)NH2, v=0
  801851.5989  0.0021 -2.9833 3  577.9555119  71510 303592733      582632        syn-C2H3C(O)NH2, v=0
  801852.3449  0.0173 -5.1010 3  761.1007151  71510 303751758      751461        syn-C2H3C(O)NH2, v=0
  801961.9631  0.0023 -2.8104 3  523.0785103  71510 303513120      503021        syn-C2H3C(O)NH2, v=0
  801961.9631  0.0023 -2.8104 3  523.0785103  71510 303513121      503020        syn-C2H3C(O)NH2, v=0
  801977.1121  0.0055 -3.4242 3  718.7415143  71510 303712249      702150        syn-C2H3C(O)NH2, v=0
  802115.9923  0.1660 -5.4916 3 1826.0526187  71510 303935835      935736        syn-C2H3C(O)NH2, v=0
  802115.9923  0.1660 -5.4916 3 1826.0526187  71510 303935836      935737        syn-C2H3C(O)NH2, v=0
  802162.1099  0.0022 -2.8473 3  534.4834107  71510 303533023      522924        syn-C2H3C(O)NH2, v=0
  802162.1099  0.0022 -2.8473 3  534.4834107  71510 303533024      522923        syn-C2H3C(O)NH2, v=0
  802165.1663  0.0021 -2.9333 3  561.8984115  71510 303572829      562730        syn-C2H3C(O)NH2, v=0
  802165.1663  0.0021 -2.9333 3  561.8984115  71510 303572830      562729        syn-C2H3C(O)NH2, v=0
  802245.7866  0.0021 -2.8881 3  547.4165111  71510 303552926      542827        syn-C2H3C(O)NH2, v=0
  802245.7866  0.0021 -2.8881 3  547.4165111  71510 303552927      542826        syn-C2H3C(O)NH2, v=0
  802290.7595  0.0364 -5.3732 3 1113.8257179  71510 303892565      892268        syn-C2H3C(O)NH2, v=0
  802339.4975  0.1035 -4.8838 3 1644.1721225  71510 303B22092      B12191        syn-C2H3C(O)NH2, v=0
  802339.5751  0.1035 -4.8838 3 1644.1721225  71510 303B22192      B12091        syn-C2H3C(O)NH2, v=0
  802426.5607  0.1654 -5.4551 3 1803.4479185  71510 303925834      925735        syn-C2H3C(O)NH2, v=0
  802426.5607  0.1654 -5.4551 3 1803.4479185  71510 303925835      925736        syn-C2H3C(O)NH2, v=0
  802442.7591  0.0033 -4.9597 3  536.9950121  71510 303602238      601941        syn-C2H3C(O)NH2, v=0
  802450.1422  0.0775 -4.4545 3 1198.1160187  71510 303932470      922369        syn-C2H3C(O)NH2, v=0
  802691.0704  0.0867 -4.7203 3 1380.3908201  71510 303A02576      992475        syn-C2H3C(O)NH2, v=0
  802729.2025  0.1650 -5.4195 3 1781.0891183  71510 303915833      915734        syn-C2H3C(O)NH2, v=0
  802729.2025  0.1650 -5.4195 3 1781.0891183  71510 303915834      915735        syn-C2H3C(O)NH2, v=0
  802741.0095  0.0033 -4.9594 3  536.9851121  71510 303602239      601942        syn-C2H3C(O)NH2, v=0
  802924.7886  0.0025 -5.1807 3  341.7388 93  71510 303462125      461828        syn-C2H3C(O)NH2, v=0
  802925.0650  0.0025 -5.1807 3  341.7388 93  71510 303462126      461829        syn-C2H3C(O)NH2, v=0
  802925.1221  0.0132 -5.1006 3  850.3775155  71510 303772454      772157        syn-C2H3C(O)NH2, v=0
  803024.0747  0.1645 -5.3847 3 1758.9759181  71510 303905832      905733        syn-C2H3C(O)NH2, v=0
  803024.0747  0.1645 -5.3847 3 1758.9759181  71510 303905833      905734        syn-C2H3C(O)NH2, v=0
  803229.2770  0.0998 -4.8944 3 1632.0845223  71510 303B12190      B02289        syn-C2H3C(O)NH2, v=0
  803230.6569  0.0998 -4.8944 3 1632.0845223  71510 303B12290      B02189        syn-C2H3C(O)NH2, v=0
  803278.6620  0.0026 -4.2423 3  264.0289 89  71510 303441430      431133        syn-C2H3C(O)NH2, v=0
  803311.3317  0.1642 -5.3508 3 1737.1084179  71510 303895831      895732        syn-C2H3C(O)NH2, v=0
  803311.3317  0.1642 -5.3508 3 1737.1084179  71510 303895832      895733        syn-C2H3C(O)NH2, v=0
  803503.8149  0.0071 -5.0579 3  653.8606141  71510 303701555      701258        syn-C2H3C(O)NH2, v=0
  803591.1256  0.1639 -5.3177 3 1715.4865177  71510 303885830      885731        syn-C2H3C(O)NH2, v=0
  803591.1256  0.1639 -5.3177 3 1715.4865177  71510 303885831      885732        syn-C2H3C(O)NH2, v=0
  803628.2185  0.0053 -4.6421 3  222.6061 93  71510 30346 343      45 244        syn-C2H3C(O)NH2, v=0
  803628.2185  0.0053 -4.6421 3  222.6061 93  71510 30346 443      45 144        syn-C2H3C(O)NH2, v=0
  803740.4369  0.1801 -5.5884 3 1195.6974187  71510 303932370      932073        syn-C2H3C(O)NH2, v=0
  803819.9342  0.0057 -3.7060 3  466.3959119  71510 303591445      581346        syn-C2H3C(O)NH2, v=0
  803859.3460  0.0034 -3.6724 3  417.3678113  71510 303561443      551144        syn-C2H3C(O)NH2, v=0
  803860.3237  0.0059 -4.9914 3  692.8012139  71510 303692347      692050        syn-C2H3C(O)NH2, v=0
  803863.6061  0.1636 -5.2857 3 1694.1100175  71510 303875829      875730        syn-C2H3C(O)NH2, v=0
  803863.6061  0.1636 -5.2857 3 1694.1100175  71510 303875830      875731        syn-C2H3C(O)NH2, v=0
  804128.9206  0.1635 -5.2546 3 1672.9789173  71510 303865828      865729        syn-C2H3C(O)NH2, v=0
  804128.9206  0.1635 -5.2546 3 1672.9789173  71510 303865829      865730        syn-C2H3C(O)NH2, v=0
  804237.0962  0.0020 -4.7795 3  171.9967 69  71510 303341520      331221        syn-C2H3C(O)NH2, v=0
  804333.0829  0.0020 -4.7794 3  171.9935 69  71510 303341519      331222        syn-C2H3C(O)NH2, v=0
  804387.2144  0.1633 -5.2244 3 1652.0931171  71510 303855827      855728        syn-C2H3C(O)NH2, v=0
  804387.2144  0.1633 -5.2244 3 1652.0931171  71510 303855828      855729        syn-C2H3C(O)NH2, v=0
  804436.5015  0.0962 -4.9087 3 1619.1947221  71510 303B02288      A92387        syn-C2H3C(O)NH2, v=0
  804457.5756  0.0962 -4.9087 3 1619.1943221  71510 303B02388      A92287        syn-C2H3C(O)NH2, v=0
  804638.6305  0.1632 -5.1954 3 1631.4525169  71510 303845826      845727        syn-C2H3C(O)NH2, v=0
  804638.6305  0.1632 -5.1954 3 1631.4525169  71510 303845827      845728        syn-C2H3C(O)NH2, v=0
  804760.6703  0.0032 -3.2002 3  652.1795133  71510 303662443      652342        syn-C2H3C(O)NH2, v=0
  804761.5476  0.0032 -3.2002 3  652.1795133  71510 303662442      652343        syn-C2H3C(O)NH2, v=0
  804883.3096  0.1632 -5.1673 3 1611.0570167  71510 303835825      835726        syn-C2H3C(O)NH2, v=0
  804883.3096  0.1632 -5.1673 3 1611.0570167  71510 303835826      835727        syn-C2H3C(O)NH2, v=0
  805121.3904  0.1632 -5.1404 3 1590.9066165  71510 303825824      825725        syn-C2H3C(O)NH2, v=0
  805121.3904  0.1632 -5.1404 3 1590.9066165  71510 303825825      825726        syn-C2H3C(O)NH2, v=0
  805155.6908  0.0025 -5.2171 3  330.3315 91  71510 303452124      451827        syn-C2H3C(O)NH2, v=0
  805155.8161  0.0025 -5.2171 3  330.3315 91  71510 303452125      451828        syn-C2H3C(O)NH2, v=0
  805165.1951  0.0125 -3.7070 3  695.8515143  71510 303711952      701853        syn-C2H3C(O)NH2, v=0
  805255.6853  0.0060 -3.4654 3  736.7766145  71510 303722251      712150        syn-C2H3C(O)NH2, v=0
  805331.0077  0.0240 -5.2745 3 1024.8594171  71510 303852561      852264        syn-C2H3C(O)NH2, v=0
  805353.0096  0.1632 -5.1147 3 1571.0011163  71510 303815823      815724        syn-C2H3C(O)NH2, v=0
  805353.0096  0.1632 -5.1147 3 1571.0011163  71510 303815824      815725        syn-C2H3C(O)NH2, v=0
  805577.3847  0.0068 -5.0561 3  653.8607141  71510 303701655      701358        syn-C2H3C(O)NH2, v=0
  805578.3015  0.1633 -5.0902 3 1551.3405161  71510 303805822      805723        syn-C2H3C(O)NH2, v=0
  805578.3015  0.1633 -5.0902 3 1551.3405161  71510 303805823      805724        syn-C2H3C(O)NH2, v=0
  805584.1732  0.0827 -4.9242 3 1563.7845215  71510 303A72583      A62482        syn-C2H3C(O)NH2, v=0
  805797.3987  0.1635 -5.0670 3 1531.9247159  71510 303795821      795722        syn-C2H3C(O)NH2, v=0
  805797.3987  0.1635 -5.0670 3 1531.9247159  71510 303795822      795723        syn-C2H3C(O)NH2, v=0
  805837.3465  0.1645 -4.8626 3 1765.6423251  71510 303C5 8B7      C4 9B6        syn-C2H3C(O)NH2, v=0
  805837.3465  0.1645 -4.8626 3 1765.6423251  71510 303C5 9B7      C4 8B6        syn-C2H3C(O)NH2, v=0
  805838.6973  0.1589 -4.8685 3 1760.9102249  71510 303C4 9B5      C310B4        syn-C2H3C(O)NH2, v=0
  805838.6973  0.1589 -4.8685 3 1760.9102249  71510 303C410B5      C3 9B4        syn-C2H3C(O)NH2, v=0
  805844.6675  0.1706 -4.8563 3 1769.8385253  71510 303C6 7B9      C5 8B8        syn-C2H3C(O)NH2, v=0
  805844.6675  0.1706 -4.8563 3 1769.8385253  71510 303C6 8B9      C5 7B8        syn-C2H3C(O)NH2, v=0
  805851.9077  0.1537 -4.8739 3 1755.6365247  71510 303C310B3      C211B2        syn-C2H3C(O)NH2, v=0
  805851.9077  0.1537 -4.8739 3 1755.6365247  71510 303C311B3      C210B2        syn-C2H3C(O)NH2, v=0
  805857.9916  0.1773 -4.8495 3 1773.5039255  71510 303C7 6C1      C6 7C0        syn-C2H3C(O)NH2, v=0
  805857.9916  0.1773 -4.8495 3 1773.5039255  71510 303C7 7C1      C6 6C0        syn-C2H3C(O)NH2, v=0
  805875.0671  0.1849 -4.8420 3 1776.6428257  71510 303C8 5C3      C7 6C2        syn-C2H3C(O)NH2, v=0
  805875.0671  0.1849 -4.8420 3 1776.6428257  71510 303C8 6C3      C7 5C2        syn-C2H3C(O)NH2, v=0
  805880.8197  0.1487 -4.8789 3 1749.8145245  71510 303C211B1      C112B0        syn-C2H3C(O)NH2, v=0
  805880.8197  0.1487 -4.8789 3 1749.8145245  71510 303C212B1      C111B0        syn-C2H3C(O)NH2, v=0
  805883.4688  0.0046 -3.6942 3  431.1190115  71510 303571344      561245        syn-C2H3C(O)NH2, v=0
  805893.9791  0.1935 -4.8340 3 1779.2591259  71510 303C9 4C5      C8 5C4        syn-C2H3C(O)NH2, v=0
  805893.9791  0.1935 -4.8340 3 1779.2591259  71510 303C9 5C5      C8 4C4        syn-C2H3C(O)NH2, v=0
  805913.0874  0.2035 -4.8253 3 1781.3562261  71510 303D0 3C7      C9 4C6        syn-C2H3C(O)NH2, v=0
  805913.0874  0.2035 -4.8253 3 1781.3562261  71510 303D0 4C7      C9 3C6        syn-C2H3C(O)NH2, v=0
  805930.1077  0.1439 -4.8835 3 1743.4367243  71510 303C112A9      C013A8        syn-C2H3C(O)NH2, v=0
  805930.1077  0.1439 -4.8835 3 1743.4367243  71510 303C113A9      C012A8        syn-C2H3C(O)NH2, v=0
  805930.9773  0.2151 -4.8160 3 1782.9371263  71510 303D1 2C9      D0 3C8        syn-C2H3C(O)NH2, v=0
  805930.9773  0.2151 -4.8160 3 1782.9371263  71510 303D1 3C9      D0 2C8        syn-C2H3C(O)NH2, v=0
  805946.4200  0.2287 -4.8061 3 1784.0044265  71510 303D2 1D1      D1 2D0        syn-C2H3C(O)NH2, v=0
  805946.4200  0.2287 -4.8061 3 1784.0044265  71510 303D2 2D1      D1 1D0        syn-C2H3C(O)NH2, v=0
  805958.3410  0.2446 -4.7954 3 1784.5603267  71510 303D3 0D3      D2 1D2        syn-C2H3C(O)NH2, v=0
  805958.3410  0.2446 -4.7954 3 1784.5603267  71510 303D3 1D3      D2 0D2        syn-C2H3C(O)NH2, v=0
  806005.5193  0.1392 -4.8880 3 1736.4942241  71510 303C013A7      B914A6        syn-C2H3C(O)NH2, v=0
  806005.5193  0.1392 -4.8880 3 1736.4942241  71510 303C014A7      B913A6        syn-C2H3C(O)NH2, v=0
  806010.4317  0.1636 -5.0451 3 1512.7537157  71510 303785820      785721        syn-C2H3C(O)NH2, v=0
  806010.4317  0.1636 -5.0451 3 1512.7537157  71510 303785821      785722        syn-C2H3C(O)NH2, v=0
  806030.2412  0.0929 -4.9290 3 1605.4216219  71510 303A92386      A82485        syn-C2H3C(O)NH2, v=0
  806114.2060  0.1346 -4.8923 3 1728.9769239  71510 303B914A5      B815A4        syn-C2H3C(O)NH2, v=0
  806114.2060  0.1346 -4.8923 3 1728.9769239  71510 303B915A5      B814A4        syn-C2H3C(O)NH2, v=0
  806217.5288  0.1638 -5.0247 3 1493.8273155  71510 303775819      775720        syn-C2H3C(O)NH2, v=0
  806217.5288  0.1638 -5.0247 3 1493.8273155  71510 303775820      775721        syn-C2H3C(O)NH2, v=0
  806229.8127  0.2720 -5.4035 3 1706.0357223  71510 303B12784      B02883        syn-C2H3C(O)NH2, v=0
  806243.6585  0.0135 -5.0963 3  811.8092151  71510 303752451      752154        syn-C2H3C(O)NH2, v=0
  806265.1867  0.1301 -4.8965 3 1720.8727237  71510 303B815A3      B716A2        syn-C2H3C(O)NH2, v=0
  806265.1867  0.1301 -4.8965 3 1720.8727237  71510 303B816A3      B715A2        syn-C2H3C(O)NH2, v=0
  806302.2755  0.0926 -4.9287 3 1605.4160219  71510 303A92486      A82385        syn-C2H3C(O)NH2, v=0
  806418.8167  0.1641 -5.0058 3 1475.1455153  71510 303765818      765719        syn-C2H3C(O)NH2, v=0
  806418.8167  0.1641 -5.0058 3 1475.1455153  71510 303765819      765720        syn-C2H3C(O)NH2, v=0
  806470.0149  0.1257 -4.9009 3 1712.1674235  71510 303B716A1      B617A0        syn-C2H3C(O)NH2, v=0
  806470.0149  0.1257 -4.9009 3 1712.1674235  71510 303B717A1      B616A0        syn-C2H3C(O)NH2, v=0
  806479.8773  0.0110 -2.6529 3  493.9828 77  71510 3033838 0      3737 1        syn-C2H3C(O)NH2, v=0
  806479.8773  0.0110 -2.6529 3  493.9828 77  71510 3033838 1      3737 0        syn-C2H3C(O)NH2, v=0
  806614.4199  0.1644 -4.9886 3 1456.7082151  71510 303755817      755718        syn-C2H3C(O)NH2, v=0
  806614.4199  0.1644 -4.9886 3 1456.7082151  71510 303755818      755719        syn-C2H3C(O)NH2, v=0
  806664.3431  0.0031 -3.6858 3  437.7553115  71510 303571543      561244        syn-C2H3C(O)NH2, v=0
  806743.7650  0.1214 -4.9057 3 1702.8441233  71510 303B61799      B51898        syn-C2H3C(O)NH2, v=0
  806743.7650  0.1214 -4.9057 3 1702.8441233  71510 303B61899      B51798        syn-C2H3C(O)NH2, v=0
  806804.1037  0.0565 -5.3749 3 1104.5033179  71510 303892466      892169        syn-C2H3C(O)NH2, v=0
  806804.4611  0.1647 -4.9732 3 1438.5153149  71510 303745816      745717        syn-C2H3C(O)NH2, v=0
  806804.4611  0.1647 -4.9732 3 1438.5153149  71510 303745817      745718        syn-C2H3C(O)NH2, v=0
  806816.6942  0.0550 -5.3198 3 1050.5683175  71510 303872365      872068        syn-C2H3C(O)NH2, v=0
  806837.2259  0.0027 -3.1276 3  630.5722129  71510 303642540      632439        syn-C2H3C(O)NH2, v=0
  806837.2419  0.0027 -3.1276 3  630.5722129  71510 303642539      632440        syn-C2H3C(O)NH2, v=0
  806840.3954  0.0039 -4.2336 3  292.9230 93  71510 303461532      451233        syn-C2H3C(O)NH2, v=0
  806858.1624  0.0598 -5.3825 3 1056.8142173  71510 303862660      862363        syn-C2H3C(O)NH2, v=0
  806909.2566  0.0051 -5.3925 3  443.4137113  71510 303561838      561343        syn-C2H3C(O)NH2, v=0
  806925.9227  0.0087 -2.6697 3  495.4994 81  71510 3034037 3      3936 4        syn-C2H3C(O)NH2, v=0
  806925.9227  0.0087 -2.6697 3  495.4994 81  71510 3034037 4      3936 3        syn-C2H3C(O)NH2, v=0
  806989.0610  0.1650 -4.9598 3 1420.5667147  71510 303735815      735716        syn-C2H3C(O)NH2, v=0
  806989.0610  0.1650 -4.9598 3 1420.5667147  71510 303735816      735717        syn-C2H3C(O)NH2, v=0
  807017.0059  0.1034 -5.5478 3 1179.8972183  71510 303912764      912467        syn-C2H3C(O)NH2, v=0
  807094.8893  0.0440 -5.4065 3 1136.5908181  71510 303902566      902269        syn-C2H3C(O)NH2, v=0
  807106.5433  0.1171 -4.9110 3 1692.8823231  71510 303B51897      B41996        syn-C2H3C(O)NH2, v=0
  807106.5434  0.1171 -4.9110 3 1692.8823231  71510 303B51997      B41896        syn-C2H3C(O)NH2, v=0
  807168.3387  0.1654 -4.9485 3 1402.8625145  71510 303725814      725715        syn-C2H3C(O)NH2, v=0
  807168.3387  0.1654 -4.9485 3 1402.8625145  71510 303725815      725716        syn-C2H3C(O)NH2, v=0
  807227.1875  0.0025 -5.2561 3  319.1835 89  71510 303442123      441826        syn-C2H3C(O)NH2, v=0
  807227.2430  0.0025 -5.2561 3  319.1835 89  71510 303442124      441827        syn-C2H3C(O)NH2, v=0
  807304.3006  0.0915 -4.9610 3 1590.6559217  71510 303A82484      A72583        syn-C2H3C(O)NH2, v=0
  807342.4113  0.1658 -4.9396 3 1385.4024143  71510 303715813      715714        syn-C2H3C(O)NH2, v=0
  807342.4113  0.1658 -4.9396 3 1385.4024143  71510 303715814      715715        syn-C2H3C(O)NH2, v=0
  807363.2003  0.0068 -2.6890 3  498.4793 85  71510 3034236 6      4135 7        syn-C2H3C(O)NH2, v=0
  807363.2003  0.0068 -2.6890 3  498.4793 85  71510 3034236 7      4135 6        syn-C2H3C(O)NH2, v=0
  807506.6414  0.0122 -3.6784 3  739.4950147  71510 303732053      721954        syn-C2H3C(O)NH2, v=0
  807511.3940  0.1662 -4.9334 3 1368.1865141  71510 303705812      705713        syn-C2H3C(O)NH2, v=0
  807511.3940  0.1662 -4.9334 3 1368.1865141  71510 303705813      705714        syn-C2H3C(O)NH2, v=0
  807520.7322  0.0044 -3.3173 3  692.6791139  71510 303692347      682246        syn-C2H3C(O)NH2, v=0
  807564.9240  0.0032 -4.9710 3  521.9047119  71510 303592237      591940        syn-C2H3C(O)NH2, v=0
  807582.8850  0.0044 -3.3172 3  692.6774139  71510 303692346      682247        syn-C2H3C(O)NH2, v=0
  807585.8986  0.1130 -4.9172 3 1682.2566229  71510 303B41995      B32094        syn-C2H3C(O)NH2, v=0
  807585.9007  0.1130 -4.9172 3 1682.2566229  71510 303B42095      B31994        syn-C2H3C(O)NH2, v=0
  807675.4004  0.1667 -4.9302 3 1351.2147139  71510 303695811      695712        syn-C2H3C(O)NH2, v=0
  807675.4004  0.1667 -4.9302 3 1351.2147139  71510 303695812      695713        syn-C2H3C(O)NH2, v=0
  807732.0777  0.0031 -4.9709 3  521.8991119  71510 303592238      591941        syn-C2H3C(O)NH2, v=0
  807758.8339  0.0029 -5.1142 3  171.3100 73  71510 303361225      35 728        syn-C2H3C(O)NH2, v=0
  807762.6038  0.0032 -3.6864 3  397.0121111  71510 303551343      541044        syn-C2H3C(O)NH2, v=0
  807786.5617  0.0053 -2.7109 3  502.9278 89  71510 3034435 9      433410        syn-C2H3C(O)NH2, v=0
  807786.5617  0.0053 -2.7109 3  502.9278 89  71510 303443510      4334 9        syn-C2H3C(O)NH2, v=0
  807790.2656  0.0061 -3.4630 3  736.7087145  71510 303722250      712151        syn-C2H3C(O)NH2, v=0
  807834.5420  0.1671 -4.9305 3 1334.4869137  71510 303685810      685711        syn-C2H3C(O)NH2, v=0
  807834.5420  0.1671 -4.9305 3 1334.4869137  71510 303685811      685712        syn-C2H3C(O)NH2, v=0
  807988.9290  0.1676 -4.9348 3 1318.0030135  71510 3036758 9      675710        syn-C2H3C(O)NH2, v=0
  807988.9290  0.1676 -4.9348 3 1318.0030135  71510 303675810      675711        syn-C2H3C(O)NH2, v=0
  808110.3211  0.0024 -3.0636 3  610.7008125  71510 303622637      612536        syn-C2H3C(O)NH2, v=0
  808110.3213  0.0024 -3.0636 3  610.7008125  71510 303622636      612537        syn-C2H3C(O)NH2, v=0
  808132.9091  0.0055 -4.9944 3  675.3986137  71510 303682345      682048        syn-C2H3C(O)NH2, v=0
  808138.6694  0.1682 -4.9439 3 1301.7630133  71510 3036658 8      6657 9        syn-C2H3C(O)NH2, v=0
  808138.6694  0.1682 -4.9439 3 1301.7630133  71510 3036658 9      665710        syn-C2H3C(O)NH2, v=0
  808177.6436  0.0160 -3.8256 3  871.6073159  71510 303792258      782157        syn-C2H3C(O)NH2, v=0
  808188.8103  0.0041 -2.7356 3  508.8508 93  71510 303463412      453313        syn-C2H3C(O)NH2, v=0
  808188.8103  0.0041 -2.7356 3  508.8508 93  71510 303463413      453312        syn-C2H3C(O)NH2, v=0
  808220.0030  0.0045 -4.3787 3  240.9694 95  71510 30347 443      46 344        syn-C2H3C(O)NH2, v=0
  808220.0039  0.0045 -4.3787 3  240.9694 95  71510 30347 543      46 244        syn-C2H3C(O)NH2, v=0
  808220.8603  0.1090 -4.9248 3 1670.9353227  71510 303B32093      B22192        syn-C2H3C(O)NH2, v=0
  808220.9042  0.1090 -4.9248 3 1670.9353227  71510 303B32193      B22092        syn-C2H3C(O)NH2, v=0
  808249.7824  0.0022 -5.3883 3  125.7105 55  71510 303271612      261313        syn-C2H3C(O)NH2, v=0
  808249.7954  0.0022 -5.3883 3  125.7105 55  71510 303271611      261314        syn-C2H3C(O)NH2, v=0
  808283.8697  0.1687 -4.9589 3 1285.7668131  71510 3036558 7      6557 8        syn-C2H3C(O)NH2, v=0
  808283.8697  0.1687 -4.9589 3 1285.7668131  71510 3036558 8      6557 9        syn-C2H3C(O)NH2, v=0
  808424.6346  0.1693 -4.9811 3 1270.0144129  71510 3036458 6      6457 7        syn-C2H3C(O)NH2, v=0
  808424.6346  0.1693 -4.9811 3 1270.0144129  71510 3036458 7      6457 8        syn-C2H3C(O)NH2, v=0
  808559.9832  0.0032 -2.7633 3  516.2558 97  71510 303483315      473216        syn-C2H3C(O)NH2, v=0
  808559.9832  0.0032 -2.7633 3  516.2558 97  71510 303483316      473215        syn-C2H3C(O)NH2, v=0
  808561.0672  0.1698 -5.0128 3 1254.5056127  71510 3036358 5      6357 6        syn-C2H3C(O)NH2, v=0
  808561.0672  0.1698 -5.0128 3 1254.5056127  71510 3036358 6      6357 7        syn-C2H3C(O)NH2, v=0
  808693.2689  0.1704 -5.0570 3 1239.2405125  71510 3036258 4      6257 5        syn-C2H3C(O)NH2, v=0
  808693.2689  0.1704 -5.0570 3 1239.2405125  71510 3036258 5      6257 6        syn-C2H3C(O)NH2, v=0
  808785.4521  0.0061 -5.2433 3  517.9111123  71510 303611843      611348        syn-C2H3C(O)NH2, v=0
  808817.8319  0.1672 -5.2012 3 1639.8559219  71510 303A92683      A82782        syn-C2H3C(O)NH2, v=0
  808821.3391  0.1710 -5.1195 3 1224.2189123  71510 3036158 3      6157 4        syn-C2H3C(O)NH2, v=0
  808821.3391  0.1710 -5.1195 3 1224.2189123  71510 3036158 4      6157 5        syn-C2H3C(O)NH2, v=0
  808854.2328  0.0022 -3.0064 3  592.4974121  71510 303602733      592634        syn-C2H3C(O)NH2, v=0
  808854.2328  0.0022 -3.0064 3  592.4974121  71510 303602734      592633        syn-C2H3C(O)NH2, v=0
  808886.3516  0.0027 -2.7943 3  525.1519101  71510 303503218      493119        syn-C2H3C(O)NH2, v=0
  808886.3516  0.0027 -2.7943 3  525.1519101  71510 303503219      493118        syn-C2H3C(O)NH2, v=0
  808945.3761  0.1717 -5.2104 3 1209.4408121  71510 3036058 2      6057 3        syn-C2H3C(O)NH2, v=0
  808945.3761  0.1717 -5.2104 3 1209.4408121  71510 3036058 3      6057 4        syn-C2H3C(O)NH2, v=0
  808994.0217  0.0021 -4.7233 3  180.4868 71  71510 303351521      341222        syn-C2H3C(O)NH2, v=0
  809065.4759  0.1723 -5.3528 3 1194.9062119  71510 3035958 1      5957 2        syn-C2H3C(O)NH2, v=0
  809065.4759  0.1723 -5.3528 3 1194.9062119  71510 3035958 2      5957 3        syn-C2H3C(O)NH2, v=0
  809068.9230  0.1051 -4.9346 3 1658.8774225  71510 303B22191      B12290        syn-C2H3C(O)NH2, v=0
  809069.7225  0.1051 -4.9346 3 1658.8774225  71510 303B22291      B12190        syn-C2H3C(O)NH2, v=0
  809149.0051  0.0024 -2.8286 3  535.5501105  71510 303523121      513022        syn-C2H3C(O)NH2, v=0
  809149.0051  0.0024 -2.8286 3  535.5501105  71510 303523122      513021        syn-C2H3C(O)NH2, v=0
  809149.4910  0.0025 -5.2977 3  308.2942 87  71510 303432122      431825        syn-C2H3C(O)NH2, v=0
  809149.5150  0.0025 -5.2977 3  308.2942 87  71510 303432123      431826        syn-C2H3C(O)NH2, v=0
  809168.2876  0.0278 -5.1585 3  827.0124157  71510 303781860      781563        syn-C2H3C(O)NH2, v=0
  809181.7333  0.1729 -5.6207 3 1180.6149117  71510 3035858 0      5857 1        syn-C2H3C(O)NH2, v=0
  809181.7333  0.1729 -5.6207 3 1180.6149117  71510 3035858 1      5857 2        syn-C2H3C(O)NH2, v=0
  809184.1055  0.0021 -4.7231 3  180.4805 71  71510 303351520      341223        syn-C2H3C(O)NH2, v=0
  809237.1090  0.0022 -2.9550 3  575.9130117  71510 303582830      572731        syn-C2H3C(O)NH2, v=0
  809237.1090  0.0022 -2.9550 3  575.9130117  71510 303582831      572730        syn-C2H3C(O)NH2, v=0
  809321.8004  0.0022 -2.8666 3  547.4641109  71510 303543024      532925        syn-C2H3C(O)NH2, v=0
  809321.8004  0.0022 -2.8666 3  547.4641109  71510 303543025      532924        syn-C2H3C(O)NH2, v=0
  809368.3081  0.0021 -2.9086 3  560.9112113  71510 303562927      552828        syn-C2H3C(O)NH2, v=0
  809368.3081  0.0021 -2.9086 3  560.9112113  71510 303562928      552827        syn-C2H3C(O)NH2, v=0
  809446.2124  0.0094 -3.6179 3  765.5723149  71510 303742153      732054        syn-C2H3C(O)NH2, v=0
  809516.4264  0.0067 -3.5073 3  755.0673147  71510 303732252      722151        syn-C2H3C(O)NH2, v=0
  810085.3988  0.1069 -5.0493 3 1601.8584217  71510 303A82583      A72682        syn-C2H3C(O)NH2, v=0
  810093.8034  0.0151 -5.0942 3  761.1013151  71510 303751858      751561        syn-C2H3C(O)NH2, v=0
  810193.9189  0.0878 -4.9577 3 1590.5971217  71510 303A82584      A72483        syn-C2H3C(O)NH2, v=0
  810215.8707  0.1013 -4.9477 3 1646.0281223  71510 303B12289      B02388        syn-C2H3C(O)NH2, v=0
  810228.4093  0.1013 -4.9477 3 1646.0278223  71510 303B12389      B02288        syn-C2H3C(O)NH2, v=0
  810239.6740  0.0041 -4.3133 3  269.9133 91  71510 303451332      441035        syn-C2H3C(O)NH2, v=0
  810543.9382  0.0230 -5.2568 3 1003.1791169  71510 303842560      842263        syn-C2H3C(O)NH2, v=0
  810693.1103  0.0960 -4.6923 3 1354.6973199  71510 303992575      982474        syn-C2H3C(O)NH2, v=0
  810925.0273  0.0120 -5.0927 3  830.7437153  71510 303762453      762156        syn-C2H3C(O)NH2, v=0
  810928.0772  0.1322 -5.4877 3 1116.7667181  71510 303902268      901971        syn-C2H3C(O)NH2, v=0
  810932.0281  0.0025 -5.3422 3  297.6625 85  71510 303422121      421824        syn-C2H3C(O)NH2, v=0
  810932.0382  0.0025 -5.3422 3  297.6625 85  71510 303422122      421825        syn-C2H3C(O)NH2, v=0
  810951.3958  0.0031 -3.7157 3  376.7757109  71510 303541143      531044        syn-C2H3C(O)NH2, v=0
  811024.7510  0.0054 -5.0714 3  611.1119137  71510 303681454      681157        syn-C2H3C(O)NH2, v=0
  811043.8887  0.0053 -4.9917 3  675.3013137  71510 303682346      682049        syn-C2H3C(O)NH2, v=0
  811097.4997  0.0302 -5.1685 3  875.7570161  71510 303802061      801764        syn-C2H3C(O)NH2, v=0
  811271.4186  0.0036 -3.2298 3  668.6381135  71510 303672444      662343        syn-C2H3C(O)NH2, v=0
  811273.1497  0.0036 -3.2298 3  668.6381135  71510 303672443      662344        syn-C2H3C(O)NH2, v=0
  811751.7881  0.0978 -4.9661 3 1632.3113221  71510 303B02387      A92486        syn-C2H3C(O)NH2, v=0
  811788.5364  0.0053 -5.0707 3  611.1119137  71510 303681554      681257        syn-C2H3C(O)NH2, v=0
  811822.6505  0.1724 -4.9082 3 1792.5221253  71510 303C6 8B8      C5 9B7        syn-C2H3C(O)NH2, v=0
  811822.6505  0.1724 -4.9082 3 1792.5221253  71510 303C6 9B8      C5 8B7        syn-C2H3C(O)NH2, v=0
  811822.8423  0.1665 -4.9139 3 1787.7901251  71510 303C5 9B6      C410B5        syn-C2H3C(O)NH2, v=0
  811822.8423  0.1665 -4.9139 3 1787.7901251  71510 303C510B6      C4 9B5        syn-C2H3C(O)NH2, v=0
  811830.8389  0.1787 -4.9020 3 1796.7186255  71510 303C7 7C0      C6 8B9        syn-C2H3C(O)NH2, v=0
  811830.8389  0.1787 -4.9020 3 1796.7186255  71510 303C7 8C0      C6 7B9        syn-C2H3C(O)NH2, v=0
  811834.5202  0.1611 -4.9191 3 1782.5168249  71510 303C410B4      C311B3        syn-C2H3C(O)NH2, v=0
  811834.5202  0.1611 -4.9191 3 1782.5168249  71510 303C411B4      C310B3        syn-C2H3C(O)NH2, v=0
  811844.8021  0.1857 -4.8953 3 1800.3844257  71510 303C8 6C2      C7 7C1        syn-C2H3C(O)NH2, v=0
  811844.8021  0.1857 -4.8953 3 1800.3844257  71510 303C8 7C2      C7 6C1        syn-C2H3C(O)NH2, v=0
  811861.4190  0.1559 -4.9239 3 1776.6958247  71510 303C311B2      C212B1        syn-C2H3C(O)NH2, v=0
  811861.4190  0.1559 -4.9239 3 1776.6958247  71510 303C312B2      C211B1        syn-C2H3C(O)NH2, v=0
  811862.3372  0.1936 -4.8880 3 1803.5239259  71510 303C9 5C4      C8 6C3        syn-C2H3C(O)NH2, v=0
  811862.3372  0.1936 -4.8880 3 1803.5239259  71510 303C9 6C4      C8 5C3        syn-C2H3C(O)NH2, v=0
  811881.5673  0.2025 -4.8801 3 1806.1408261  71510 303D0 4C6      C9 5C5        syn-C2H3C(O)NH2, v=0
  811881.5673  0.2025 -4.8801 3 1806.1408261  71510 303D0 5C6      C9 4C5        syn-C2H3C(O)NH2, v=0
  811900.8817  0.2129 -4.8715 3 1808.2386263  71510 303D1 3C8      D0 4C7        syn-C2H3C(O)NH2, v=0
  811900.8817  0.2129 -4.8715 3 1808.2386263  71510 303D1 4C8      D0 3C7        syn-C2H3C(O)NH2, v=0
  811908.0714  0.1509 -4.9283 3 1770.3196245  71510 303C212B0      C113A9        syn-C2H3C(O)NH2, v=0
  811908.0714  0.1509 -4.9283 3 1770.3196245  71510 303C213B0      C112A9        syn-C2H3C(O)NH2, v=0
  811918.7367  0.0976 -4.9659 3 1632.3079221  71510 303B02487      A92386        syn-C2H3C(O)NH2, v=0
  811918.8888  0.2250 -4.8623 3 1809.8201265  71510 303D2 2D0      D1 3C9        syn-C2H3C(O)NH2, v=0
  811918.8888  0.2250 -4.8623 3 1809.8201265  71510 303D2 3D0      D1 2C9        syn-C2H3C(O)NH2, v=0
  811934.3777  0.2390 -4.8525 3 1810.8879267  71510 303D3 1D2      D2 2D1        syn-C2H3C(O)NH2, v=0
  811934.3777  0.2390 -4.8525 3 1810.8879267  71510 303D3 2D2      D2 1D1        syn-C2H3C(O)NH2, v=0
  811946.2877  0.2555 -4.8419 3 1811.4442269  71510 303D4 0D4      D3 1D3        syn-C2H3C(O)NH2, v=0
  811946.2877  0.2555 -4.8419 3 1811.4442269  71510 303D4 1D4      D3 0D3        syn-C2H3C(O)NH2, v=0
  811980.0363  0.1460 -4.9326 3 1763.3797243  71510 303C113A8      C014A7        syn-C2H3C(O)NH2, v=0
  811980.0363  0.1460 -4.9326 3 1763.3797243  71510 303C114A8      C013A7        syn-C2H3C(O)NH2, v=0
  812033.0301  0.0080 -3.7430 3  556.2448129  71510 303641648      631549        syn-C2H3C(O)NH2, v=0
  812084.2098  0.1412 -4.9366 3 1755.8660241  71510 303C014A6      B915A5        syn-C2H3C(O)NH2, v=0
  812084.2098  0.1412 -4.9366 3 1755.8660241  71510 303C015A6      B914A5        syn-C2H3C(O)NH2, v=0
  812104.0604  0.0038 -4.1955 3  259.6171 97  71510 30348 543      47 444        syn-C2H3C(O)NH2, v=0
  812104.0726  0.0038 -4.1955 3  259.6171 97  71510 30348 643      47 344        syn-C2H3C(O)NH2, v=0
  812206.4147  0.0074 -5.3150 3  495.6538121  71510 303601743      601248        syn-C2H3C(O)NH2, v=0
  812229.2605  0.1366 -4.9406 3 1747.7668239  71510 303B915A4      B816A3        syn-C2H3C(O)NH2, v=0
  812229.2605  0.1366 -4.9406 3 1747.7668239  71510 303B916A4      B815A3        syn-C2H3C(O)NH2, v=0
  812299.2138  0.0031 -4.9838 3  507.0894117  71510 303582236      581939        syn-C2H3C(O)NH2, v=0
  812321.1494  0.0044 -5.5839 3  346.4317109  71510 30354 747      54 450        syn-C2H3C(O)NH2, v=0
  812321.2447  0.0044 -5.5839 3  346.4317109  71510 30354 847      54 550        syn-C2H3C(O)NH2, v=0
  812391.3007  0.0031 -4.9837 3  507.0864117  71510 303582237      581940        syn-C2H3C(O)NH2, v=0
  812426.2510  0.1320 -4.9447 3 1739.0684237  71510 303B816A2      B717A1        syn-C2H3C(O)NH2, v=0
  812426.2510  0.1320 -4.9447 3 1739.0684237  71510 303B817A2      B716A1        syn-C2H3C(O)NH2, v=0
  812520.2866  0.0435 -4.1547 3 1028.1603173  71510 303862364      852263        syn-C2H3C(O)NH2, v=0
  812530.1441  0.0028 -4.2279 3  275.0832 91  71510 303451431      441134        syn-C2H3C(O)NH2, v=0
  812565.9433  0.0497 -5.2761 3  997.7551171  71510 303852264      851967        syn-C2H3C(O)NH2, v=0
  812583.5361  0.0025 -5.3898 3  287.2878 83  71510 303412120      411823        syn-C2H3C(O)NH2, v=0
  812583.5402  0.0025 -5.3898 3  287.2878 83  71510 303412121      411824        syn-C2H3C(O)NH2, v=0
  812639.8813  0.0030 -3.7143 3  376.7746109  71510 303541243      53 944        syn-C2H3C(O)NH2, v=0
  812689.5528  0.1275 -4.9490 3 1729.7542235  71510 303B717A0      B61899        syn-C2H3C(O)NH2, v=0
  812689.5528  0.1275 -4.9490 3 1729.7542235  71510 303B718A0      B61799        syn-C2H3C(O)NH2, v=0
  813038.2351  0.1231 -4.9539 3 1719.8045233  71510 303B61898      B51997        syn-C2H3C(O)NH2, v=0
  813038.2352  0.1231 -4.9539 3 1719.8045233  71510 303B61998      B51897        syn-C2H3C(O)NH2, v=0
  813041.8569  0.0074 -3.5517 3  773.6626149  71510 303742253      732152        syn-C2H3C(O)NH2, v=0
  813203.2665  0.0054 -5.2972 3  161.8062 73  71510 303361027      35 530        syn-C2H3C(O)NH2, v=0
  813295.5523  0.0956 -4.9945 3 1617.6223219  71510 303A92485      A82584        syn-C2H3C(O)NH2, v=0
  813398.4125  0.0130 -3.7634 3  851.3160157  71510 303782257      772156        syn-C2H3C(O)NH2, v=0
  813404.6951  0.0021 -4.6698 3  189.2457 73  71510 303361522      351223        syn-C2H3C(O)NH2, v=0
  813428.3630  0.0118 -3.7467 3  653.4558139  71510 303691851      681752        syn-C2H3C(O)NH2, v=0
  813498.2627  0.1188 -4.9596 3 1709.1947231  71510 303B51996      B42095        syn-C2H3C(O)NH2, v=0
  813498.2639  0.1188 -4.9596 3 1709.1947231  71510 303B52096      B41995        syn-C2H3C(O)NH2, v=0
  813556.8613  0.0049 -3.3511 3  710.0077141  71510 303702348      692247        syn-C2H3C(O)NH2, v=0
  813568.3590  0.0030 -3.1549 3  646.4607131  71510 303652541      642440        syn-C2H3C(O)NH2, v=0
  813568.3928  0.0030 -3.1549 3  646.4607131  71510 303652540      642441        syn-C2H3C(O)NH2, v=0
  813669.2970  0.0049 -3.3510 3  710.0046141  71510 303702347      692248        syn-C2H3C(O)NH2, v=0
  813682.2459  0.0069 -3.5035 3  754.9566147  71510 303732251      722152        syn-C2H3C(O)NH2, v=0
  813727.6868  0.0109 -2.6655 3  503.2158 79  71510 3033938 1      3837 2        syn-C2H3C(O)NH2, v=0
  813727.6868  0.0109 -2.6655 3  503.2158 79  71510 3033938 2      3837 1        syn-C2H3C(O)NH2, v=0
  813770.2626  0.0021 -4.6695 3  189.2335 73  71510 303361521      351224        syn-C2H3C(O)NH2, v=0
  814023.1152  0.0430 -5.2268 3  895.5416163  71510 303811962      811665        syn-C2H3C(O)NH2, v=0
  814106.1380  0.1146 -4.9666 3 1697.8946229  71510 303B42094      B32193        syn-C2H3C(O)NH2, v=0
  814106.1628  0.1146 -4.9666 3 1697.8946229  71510 303B42194      B32093        syn-C2H3C(O)NH2, v=0
  814112.1420  0.0025 -5.4407 3  277.1691 81  71510 303402119      401822        syn-C2H3C(O)NH2, v=0
  814112.1437  0.0025 -5.4407 3  277.1691 81  71510 303402120      401823        syn-C2H3C(O)NH2, v=0
  814171.5518  0.0086 -2.6830 3  505.2246 83  71510 3034137 4      4036 5        syn-C2H3C(O)NH2, v=0
  814171.5518  0.0086 -2.6830 3  505.2246 83  71510 3034137 5      4036 4        syn-C2H3C(O)NH2, v=0
  814233.4076  0.0037 -4.2812 3  281.1326 91  71510 303451531      441232        syn-C2H3C(O)NH2, v=0
  814366.2788  0.0537 -5.4435 3 1159.5540183  71510 303912567      912270        syn-C2H3C(O)NH2, v=0
  814605.2074  0.0067 -2.7030 3  508.6983 87  71510 3034336 7      4235 8        syn-C2H3C(O)NH2, v=0
  814605.2074  0.0067 -2.7030 3  508.6983 87  71510 3034336 8      4235 7        syn-C2H3C(O)NH2, v=0
  814693.3925  0.0021 -5.3017 3  132.3572 57  71510 303281613      271314        syn-C2H3C(O)NH2, v=0
  814693.4289  0.0021 -5.3017 3  132.3572 57  71510 303281612      271315        syn-C2H3C(O)NH2, v=0
  814915.1907  0.1105 -4.9755 3 1685.8650227  71510 303B32192      B22291        syn-C2H3C(O)NH2, v=0
  814915.6521  0.1105 -4.9755 3 1685.8650227  71510 303B32292      B22191        syn-C2H3C(O)NH2, v=0
  814921.9298  0.3853 -5.6242 3 1802.2606229  71510 303B42886      B32985        syn-C2H3C(O)NH2, v=0
  814988.9351  0.0026 -3.0890 3  626.0372127  71510 303632638      622537        syn-C2H3C(O)NH2, v=0
  814988.9356  0.0026 -3.0890 3  626.0372127  71510 303632637      622538        syn-C2H3C(O)NH2, v=0
  815023.0256  0.0052 -2.7258 3  513.6421 91  71510 303453510      443411        syn-C2H3C(O)NH2, v=0
  815023.0256  0.0052 -2.7258 3  513.6421 91  71510 303453511      443410        syn-C2H3C(O)NH2, v=0
  815087.5975  0.0939 -5.3927 3 1040.4256175  71510 303872166      871869        syn-C2H3C(O)NH2, v=0
  815138.6078  0.0931 -4.9924 3 1617.5846219  71510 303A92585      A82484        syn-C2H3C(O)NH2, v=0
  815181.8461  0.0032 -4.0590 3  278.5386 99  71510 30349 643      48 544        syn-C2H3C(O)NH2, v=0
  815181.9773  0.0032 -4.0590 3  278.5386 99  71510 30349 743      48 444        syn-C2H3C(O)NH2, v=0
  815417.1904  0.0041 -2.7514 3  520.0626 95  71510 303473413      463314        syn-C2H3C(O)NH2, v=0
  815417.1904  0.0041 -2.7514 3  520.0626 95  71510 303473414      463313        syn-C2H3C(O)NH2, v=0
  815525.4298  0.0025 -5.4952 3  267.3059 79  71510 303392118      391821        syn-C2H3C(O)NH2, v=0
  815525.4304  0.0025 -5.4952 3  267.3059 79  71510 303392119      391822        syn-C2H3C(O)NH2, v=0
  815561.1663  0.0082 -3.5990 3  792.5725151  71510 303752254      742153        syn-C2H3C(O)NH2, v=0
  815657.4444  0.1839 -5.6175 3 1898.7340191  71510 303955936      955837        syn-C2H3C(O)NH2, v=0
  815657.4444  0.1839 -5.6175 3 1898.7340191  71510 303955937      955838        syn-C2H3C(O)NH2, v=0
  815765.2091  0.0113 -5.0930 3  715.3358147  71510 303731657      731360        syn-C2H3C(O)NH2, v=0
  815776.9321  0.0032 -2.7801 3  527.9675 99  71510 303493316      483217        syn-C2H3C(O)NH2, v=0
  815776.9321  0.0032 -2.7801 3  527.9675 99  71510 303493317      483216        syn-C2H3C(O)NH2, v=0
  815836.0716  0.0024 -3.0303 3  607.2946123  71510 303612734      602635        syn-C2H3C(O)NH2, v=0
  815836.0716  0.0024 -3.0303 3  607.2946123  71510 303612735      602634        syn-C2H3C(O)NH2, v=0
  815893.3030  0.0028 -3.7540 3  356.7009107  71510 303531043      52 944        syn-C2H3C(O)NH2, v=0
  815924.0333  0.0044 -5.1070 3  175.4687 75  71510 303371127      36 630        syn-C2H3C(O)NH2, v=0
  815974.5673  0.1833 -5.5797 3 1875.6483189  71510 303945935      945836        syn-C2H3C(O)NH2, v=0
  815974.5673  0.1833 -5.5797 3 1875.6483189  71510 303945936      945837        syn-C2H3C(O)NH2, v=0
  815975.6809  0.0048 -5.0959 3  569.5778133  71510 303661353      661056        syn-C2H3C(O)NH2, v=0
  816005.3337  0.1066 -4.9875 3 1673.0541225  71510 303B22290      B12389        syn-C2H3C(O)NH2, v=0
  816012.7581  0.1066 -4.9875 3 1673.0540225  71510 303B22390      B12289        syn-C2H3C(O)NH2, v=0
  816021.9986  0.0041 -5.4439 3  380.4752113  71510 30356 848      56 551        syn-C2H3C(O)NH2, v=0
  816022.4393  0.0041 -5.4439 3  380.4752113  71510 30356 948      56 651        syn-C2H3C(O)NH2, v=0
  816083.9971  0.0646 -5.3052 3  966.6815169  71510 303842064      841767        syn-C2H3C(O)NH2, v=0
  816087.4600  0.0027 -2.8120 3  537.3663103  71510 303513219      503120        syn-C2H3C(O)NH2, v=0
  816087.4600  0.0027 -2.8120 3  537.3663103  71510 303513220      503119        syn-C2H3C(O)NH2, v=0
  816116.8160  0.0049 -4.9948 3  658.1402135  71510 303672344      672047        syn-C2H3C(O)NH2, v=0
  816143.7126  0.0108 -3.7047 3  831.3861155  71510 303772256      762155        syn-C2H3C(O)NH2, v=0
  816235.9873  0.0027 -3.7537 3  356.7007107  71510 303531143      52 844        syn-C2H3C(O)NH2, v=0
  816238.8876  0.0047 -5.0957 3  569.5779133  71510 303661453      661156        syn-C2H3C(O)NH2, v=0
  816283.8036  0.1827 -5.5427 3 1852.8083187  71510 303935934      935835        syn-C2H3C(O)NH2, v=0
  816283.8036  0.1827 -5.5427 3 1852.8083187  71510 303935935      935836        syn-C2H3C(O)NH2, v=0
  816293.1224  0.0022 -2.9774 3  590.1809119  71510 303592831      582732        syn-C2H3C(O)NH2, v=0
  816293.1224  0.0022 -2.9774 3  590.1809119  71510 303592832      582731        syn-C2H3C(O)NH2, v=0
  816328.4460  0.0024 -2.8473 3  548.2707107  71510 303533122      523023        syn-C2H3C(O)NH2, v=0
  816328.4460  0.0024 -2.8473 3  548.2707107  71510 303533123      523022        syn-C2H3C(O)NH2, v=0
  816471.8193  0.0022 -2.8865 3  560.6951111  71510 303553025      542926        syn-C2H3C(O)NH2, v=0
  816471.8193  0.0022 -2.8865 3  560.6951111  71510 303553026      542925        syn-C2H3C(O)NH2, v=0
  816478.4674  0.0022 -2.9297 3  574.6575115  71510 303572928      562829        syn-C2H3C(O)NH2, v=0
  816478.4674  0.0022 -2.9297 3  574.6575115  71510 303572929      562828        syn-C2H3C(O)NH2, v=0
  816555.3527  0.0064 -5.0925 3  213.7320 93  71510 30346 244      45 145        syn-C2H3C(O)NH2, v=0
  816555.3527  0.0064 -5.0925 3  213.7320 93  71510 30346 344      45 045        syn-C2H3C(O)NH2, v=0
  816585.3057  0.1822 -5.5066 3 1830.2140185  71510 303925933      925834        syn-C2H3C(O)NH2, v=0
  816585.3057  0.1822 -5.5066 3 1830.2140185  71510 303925934      925835        syn-C2H3C(O)NH2, v=0
  816688.8408  0.0030 -4.9982 3  492.5470115  71510 303572235      571938        syn-C2H3C(O)NH2, v=0
  816729.2198  0.0093 -3.6499 3  811.8092153  71510 303762255      752154        syn-C2H3C(O)NH2, v=0
  816738.7078  0.0030 -4.9981 3  492.5454115  71510 303572236      571939        syn-C2H3C(O)NH2, v=0
  816800.8785  0.0760 -4.4142 3 1173.9015185  71510 303922469      912368        syn-C2H3C(O)NH2, v=0
  816830.4967  0.0025 -5.5536 3  257.6973 77  71510 303382117      381820        syn-C2H3C(O)NH2, v=0
  816830.4969  0.0025 -5.5536 3  257.6973 77  71510 303382118      381821        syn-C2H3C(O)NH2, v=0
  816879.2236  0.1818 -5.4713 3 1807.8652183  71510 303915932      915833        syn-C2H3C(O)NH2, v=0
  816879.2236  0.1818 -5.4713 3 1807.8652183  71510 303915933      915834        syn-C2H3C(O)NH2, v=0
  816967.1166  0.0220 -5.2410 3  981.7405167  71510 303832559      832262        syn-C2H3C(O)NH2, v=0
  817165.7052  0.1815 -5.4369 3 1785.7619181  71510 303905931      905832        syn-C2H3C(O)NH2, v=0
  817165.7052  0.1815 -5.4369 3 1785.7619181  71510 303905932      905833        syn-C2H3C(O)NH2, v=0
  817325.4648  0.0028 -3.9537 3  297.7222101  71510 30350 743      49 644        syn-C2H3C(O)NH2, v=0
  817326.6463  0.0028 -3.9537 3  297.7221101  71510 30350 843      49 544        syn-C2H3C(O)NH2, v=0
  817397.4433  0.0022 -4.6189 3  198.2767 75  71510 303371523      361224        syn-C2H3C(O)NH2, v=0
  817444.8959  0.1812 -5.4034 3 1763.9040179  71510 303895930      895831        syn-C2H3C(O)NH2, v=0
  817444.8959  0.1812 -5.4034 3 1763.9040179  71510 303895931      895832        syn-C2H3C(O)NH2, v=0
  817475.4270  0.1030 -5.0042 3 1659.3906223  71510 303B12388      B02487        syn-C2H3C(O)NH2, v=0
  817577.2729  0.1028 -5.0041 3 1659.3885223  71510 303B12488      B02387        syn-C2H3C(O)NH2, v=0
  817691.3677  0.0084 -5.4367 3  459.1361117  71510 303581642      581147        syn-C2H3C(O)NH2, v=0
  817716.9391  0.1809 -5.3709 3 1742.2914177  71510 303885929      885830        syn-C2H3C(O)NH2, v=0
  817716.9391  0.1809 -5.3709 3 1742.2914177  71510 303885930      885831        syn-C2H3C(O)NH2, v=0
  817722.2255  0.0040 -3.2603 3  685.3629137  71510 303682445      672344        syn-C2H3C(O)NH2, v=0
  817725.5918  0.0040 -3.2603 3  685.3628137  71510 303682444      672345        syn-C2H3C(O)NH2, v=0
  817805.9541  0.1744 -4.9597 3 1814.8696253  71510 303C6 9B7      C510B6        syn-C2H3C(O)NH2, v=0
  817805.9541  0.1744 -4.9597 3 1814.8696253  71510 303C610B7      C5 9B6        syn-C2H3C(O)NH2, v=0
  817806.8959  0.1805 -4.9542 3 1819.6016255  71510 303C7 8B9      C6 9B8        syn-C2H3C(O)NH2, v=0
  817806.8959  0.1805 -4.9542 3 1819.6016255  71510 303C7 9B9      C6 8B8        syn-C2H3C(O)NH2, v=0
  817815.9346  0.1871 -4.9482 3 1823.7984257  71510 303C8 7C1      C7 8C0        syn-C2H3C(O)NH2, v=0
  817815.9346  0.1871 -4.9482 3 1823.7984257  71510 303C8 8C1      C7 7C0        syn-C2H3C(O)NH2, v=0
  817816.1363  0.1687 -4.9648 3 1809.5967251  71510 303C510B5      C411B4        syn-C2H3C(O)NH2, v=0
  817816.1363  0.1687 -4.9648 3 1809.5967251  71510 303C511B5      C410B4        syn-C2H3C(O)NH2, v=0
  817830.5257  0.1944 -4.9416 3 1827.4646259  71510 303C9 6C3      C8 7C2        syn-C2H3C(O)NH2, v=0
  817830.5257  0.1944 -4.9416 3 1827.4646259  71510 303C9 7C3      C8 6C2        syn-C2H3C(O)NH2, v=0
  817841.0746  0.1633 -4.9694 3 1803.7766249  71510 303C411B3      C312B2        syn-C2H3C(O)NH2, v=0
  817841.0746  0.1633 -4.9694 3 1803.7766249  71510 303C412B3      C311B2        syn-C2H3C(O)NH2, v=0
  817848.5132  0.2026 -4.9344 3 1830.6047261  71510 303D0 5C5      C9 6C4        syn-C2H3C(O)NH2, v=0
  817848.5132  0.2026 -4.9344 3 1830.6047261  71510 303D0 6C5      C9 5C4        syn-C2H3C(O)NH2, v=0
  817868.0569  0.2119 -4.9267 3 1833.2223263  71510 303D1 4C7      D0 5C6        syn-C2H3C(O)NH2, v=0
  817868.0569  0.2119 -4.9267 3 1833.2223263  71510 303D1 5C7      D0 4C6        syn-C2H3C(O)NH2, v=0
  817885.1665  0.1581 -4.9737 3 1797.4020247  71510 303C312B1      C213B0        syn-C2H3C(O)NH2, v=0
  817885.1665  0.1581 -4.9737 3 1797.4020247  71510 303C313B1      C212B0        syn-C2H3C(O)NH2, v=0
  817885.8983  0.0048 -4.9932 3  658.0811135  71510 303672345      672048        syn-C2H3C(O)NH2, v=0
  817887.5750  0.2227 -4.9182 3 1835.3207265  71510 303D2 3C9      D1 4C8        syn-C2H3C(O)NH2, v=0
  817887.5750  0.2227 -4.9182 3 1835.3207265  71510 303D2 4C9      D1 3C8        syn-C2H3C(O)NH2, v=0
  817904.4080  0.1060 -5.0757 3 1629.0951219  71510 303A92584      A82683        syn-C2H3C(O)NH2, v=0
  817905.6980  0.2352 -4.9091 3 1836.9028267  71510 303D3 2D1      D2 3D0        syn-C2H3C(O)NH2, v=0
  817905.6980  0.2352 -4.9091 3 1836.9028267  71510 303D3 3D1      D2 2D0        syn-C2H3C(O)NH2, v=0
  817921.2324  0.2497 -4.8993 3 1837.9711269  71510 303D4 1D3      D3 2D2        syn-C2H3C(O)NH2, v=0
  817921.2324  0.2497 -4.8993 3 1837.9711269  71510 303D4 2D3      D3 1D2        syn-C2H3C(O)NH2, v=0
  817933.1313  0.2667 -4.8888 3 1838.5278271  71510 303D5 0D5      D4 1D4        syn-C2H3C(O)NH2, v=0
  817933.1313  0.2667 -4.8888 3 1838.5278271  71510 303D5 1D5      D4 0D4        syn-C2H3C(O)NH2, v=0
  817953.7910  0.1530 -4.9777 3 1790.4644245  71510 303C213A9      C114A8        syn-C2H3C(O)NH2, v=0
  817953.7910  0.1530 -4.9777 3 1790.4644245  71510 303C214A9      C113A8        syn-C2H3C(O)NH2, v=0
  817981.9759  0.1807 -5.3393 3 1720.9240175  71510 303875928      875829        syn-C2H3C(O)NH2, v=0
  817981.9759  0.1807 -5.3393 3 1720.9240175  71510 303875929      875830        syn-C2H3C(O)NH2, v=0
  818012.4532  0.0054 -5.4799 3  428.9753111  71510 303551837      551342        syn-C2H3C(O)NH2, v=0
  818033.4082  0.0026 -3.8053 3  336.8200105  71510 30352 943      51 844        syn-C2H3C(O)NH2, v=0
  818034.0021  0.0025 -5.6161 3  248.3428 75  71510 303372116      371819        syn-C2H3C(O)NH2, v=0
  818034.0021  0.0025 -5.6161 3  248.3428 75  71510 303372117      371820        syn-C2H3C(O)NH2, v=0
  818053.6021  0.1481 -4.9815 3 1782.9542243  71510 303C114A7      C015A6        syn-C2H3C(O)NH2, v=0
  818053.6021  0.1481 -4.9815 3 1782.9542243  71510 303C115A7      C014A6        syn-C2H3C(O)NH2, v=0
  818080.6188  0.0021 -4.6184 3  198.2539 75  71510 303371522      361225        syn-C2H3C(O)NH2, v=0
  818093.3660  0.0026 -3.8052 3  336.8199105  71510 303521043      51 744        syn-C2H3C(O)NH2, v=0
  818192.9370  0.1432 -4.9852 3 1774.8599241  71510 303C015A5      B916A4        syn-C2H3C(O)NH2, v=0
  818192.9370  0.1432 -4.9852 3 1774.8599241  71510 303C016A5      B915A4        syn-C2H3C(O)NH2, v=0
  818240.1456  0.1806 -5.3087 3 1699.8017173  71510 303865927      865828        syn-C2H3C(O)NH2, v=0
  818240.1456  0.1806 -5.3087 3 1699.8017173  71510 303865928      865829        syn-C2H3C(O)NH2, v=0
  818361.4264  0.0026 -3.8708 3  317.1544103  71510 30351 843      50 744        syn-C2H3C(O)NH2, v=0
  818370.4966  0.0026 -3.8708 3  317.1544103  71510 30351 943      50 644        syn-C2H3C(O)NH2, v=0
  818382.3969  0.1385 -4.9889 3 1766.1680239  71510 303B916A3      B817A2        syn-C2H3C(O)NH2, v=0
  818382.3969  0.1385 -4.9889 3 1766.1680239  71510 303B917A3      B816A2        syn-C2H3C(O)NH2, v=0
  818491.5849  0.1805 -5.2791 3 1678.9245171  71510 303855926      855827        syn-C2H3C(O)NH2, v=0
  818491.5849  0.1805 -5.2791 3 1678.9245171  71510 303855927      855828        syn-C2H3C(O)NH2, v=0
  818635.6956  0.1338 -4.9929 3 1756.8626237  71510 303B817A1      B718A0        syn-C2H3C(O)NH2, v=0
  818635.6956  0.1338 -4.9929 3 1756.8626237  71510 303B818A1      B717A0        syn-C2H3C(O)NH2, v=0
  818636.7067  0.0041 -5.3345 3  415.7892117  71510 30358 949      58 652        syn-C2H3C(O)NH2, v=0
  818638.5592  0.0041 -5.3345 3  415.7892117  71510 303581049      58 752        syn-C2H3C(O)NH2, v=0
  818736.4291  0.1805 -5.2506 3 1658.2923169  71510 303845925      845826        syn-C2H3C(O)NH2, v=0
  818736.4291  0.1805 -5.2506 3 1658.2923169  71510 303845926      845827        syn-C2H3C(O)NH2, v=0
  818759.3167  0.0112 -5.0870 3  792.5725149  71510 303742450      742153        syn-C2H3C(O)NH2, v=0
  818928.9823  0.0046 -5.1325 3  529.2689129  71510 303641252      64 955        syn-C2H3C(O)NH2, v=0
  818970.9394  0.1292 -4.9974 3 1746.9245235  71510 303B71899      B61998        syn-C2H3C(O)NH2, v=0
  818970.9394  0.1292 -4.9974 3 1746.9245235  71510 303B71999      B61898        syn-C2H3C(O)NH2, v=0
  818974.8109  0.1805 -5.2232 3 1637.9050167  71510 303835924      835825        syn-C2H3C(O)NH2, v=0
  818974.8109  0.1805 -5.2232 3 1637.9050167  71510 303835925      835826        syn-C2H3C(O)NH2, v=0
  819013.8390  0.0046 -5.1324 3  529.2689129  71510 303641352      641055        syn-C2H3C(O)NH2, v=0
  819035.9056  0.0109 -5.0858 3  811.3811151  71510 303752452      752155        syn-C2H3C(O)NH2, v=0
  819150.0555  0.1001 -5.0295 3 1644.7747221  71510 303B02486      A92585        syn-C2H3C(O)NH2, v=0
  819158.6506  0.0106 -5.0901 3  715.3360147  71510 303731757      731460        syn-C2H3C(O)NH2, v=0
  819206.8614  0.1806 -5.1970 3 1617.7625165  71510 303825923      825824        syn-C2H3C(O)NH2, v=0
  819206.8614  0.1806 -5.1970 3 1617.7625165  71510 303825924      825825        syn-C2H3C(O)NH2, v=0
  819412.6333  0.1248 -5.0025 3 1736.3301233  71510 303B61997      B52096        syn-C2H3C(O)NH2, v=0
  819412.6339  0.1248 -5.0025 3 1736.3301233  71510 303B62097      B51996        syn-C2H3C(O)NH2, v=0
  819432.7096  0.1807 -5.1720 3 1597.8648163  71510 303815922      815823        syn-C2H3C(O)NH2, v=0
  819432.7096  0.1807 -5.1720 3 1597.8648163  71510 303815923      815824        syn-C2H3C(O)NH2, v=0
  819467.0953  0.0055 -3.3861 3  727.6115143  71510 303712349      702248        syn-C2H3C(O)NH2, v=0
  819532.9211  0.0261 -5.2180 3  919.6627161  71510 303802555      802258        syn-C2H3C(O)NH2, v=0
  819652.4827  0.1808 -5.1483 3 1578.2117161  71510 303805921      805822        syn-C2H3C(O)NH2, v=0
  819652.4827  0.1808 -5.1483 3 1578.2117161  71510 303805922      805823        syn-C2H3C(O)NH2, v=0
  819667.5830  0.0055 -3.3859 3  727.6059143  71510 303712348      702249        syn-C2H3C(O)NH2, v=0
  819727.9873  0.0031 -5.0595 3  180.1997 75  71510 303371226      36 729        syn-C2H3C(O)NH2, v=0
  819771.2544  0.0078 -3.5458 3  773.4852149  71510 303742252      732153        syn-C2H3C(O)NH2, v=0
  819866.3058  0.1810 -5.1260 3 1558.8033159  71510 303795920      795821        syn-C2H3C(O)NH2, v=0
  819866.3058  0.1810 -5.1260 3 1558.8033159  71510 303795921      795822        syn-C2H3C(O)NH2, v=0
  819994.9741  0.1204 -5.0089 3 1725.0503231  71510 303B52095      B42194        syn-C2H3C(O)NH2, v=0
  819994.9880  0.1204 -5.0089 3 1725.0503231  71510 303B52195      B42094        syn-C2H3C(O)NH2, v=0
  820036.4813  0.0035 -4.3228 3  269.6652 89  71510 303441530      431231        syn-C2H3C(O)NH2, v=0
  820074.3024  0.1812 -5.1051 3 1539.6393157  71510 303785919      785820        syn-C2H3C(O)NH2, v=0
  820074.3024  0.1812 -5.1051 3 1539.6393157  71510 303785920      785821        syn-C2H3C(O)NH2, v=0
  820075.1566  0.0043 -5.2490 3  452.3654121  71510 303601050      60 753        syn-C2H3C(O)NH2, v=0
  820082.3084  0.0043 -5.2490 3  452.3654121  71510 303601150      60 853        syn-C2H3C(O)NH2, v=0
  820223.1812  0.0045 -5.1827 3  490.1950125  71510 303621151      62 854        syn-C2H3C(O)NH2, v=0
  820248.7237  0.0044 -5.1827 3  490.1950125  71510 303621251      62 954        syn-C2H3C(O)NH2, v=0
  820258.7958  0.0033 -3.1830 3  662.6109133  71510 303662542      652441        syn-C2H3C(O)NH2, v=0
  820258.8665  0.0033 -3.1830 3  662.6109133  71510 303662541      652442        syn-C2H3C(O)NH2, v=0
  820276.5939  0.1815 -5.0857 3 1520.7198155  71510 303775918      775819        syn-C2H3C(O)NH2, v=0
  820276.5939  0.1815 -5.0857 3 1520.7198155  71510 303775919      775820        syn-C2H3C(O)NH2, v=0
  820316.1911  0.0984 -5.0282 3 1644.7509221  71510 303B02586      A92485        syn-C2H3C(O)NH2, v=0
  820353.6827  0.0063 -5.5646 3  148.3426 71  71510 30335 927      34 430        syn-C2H3C(O)NH2, v=0
  820473.3000  0.1818 -5.0681 3 1502.0447153  71510 303765917      765818        syn-C2H3C(O)NH2, v=0
  820473.3000  0.1818 -5.0681 3 1502.0447153  71510 303765918      765819        syn-C2H3C(O)NH2, v=0
  820474.5092  0.0068 -5.2664 3  533.3157125  71510 303621844      621349        syn-C2H3C(O)NH2, v=0
  820479.6807  0.0117 -3.6721 3  784.4410151  71510 303752154      742055        syn-C2H3C(O)NH2, v=0
  820574.5515  0.0033 -3.8452 3  428.9753113  71510 303561641      551342        syn-C2H3C(O)NH2, v=0
  820664.5386  0.1822 -5.0522 3 1483.6139151  71510 303755916      755817        syn-C2H3C(O)NH2, v=0
  820664.5386  0.1822 -5.0522 3 1483.6139151  71510 303755917      755818        syn-C2H3C(O)NH2, v=0
  820767.5034  0.1162 -5.0171 3 1713.0477229  71510 303B42193      B32292        syn-C2H3C(O)NH2, v=0
  820767.7687  0.1162 -5.0171 3 1713.0477229  71510 303B42293      B32192        syn-C2H3C(O)NH2, v=0
  820768.1074  0.0030 -5.0141 3  478.2755113  71510 303562234      561937        syn-C2H3C(O)NH2, v=0
  820794.6479  0.0030 -5.0141 3  478.2746113  71510 303562235      561938        syn-C2H3C(O)NH2, v=0
  820850.4259  0.1825 -5.0383 3 1465.4274149  71510 303745915      745816        syn-C2H3C(O)NH2, v=0
  820850.4259  0.1825 -5.0383 3 1465.4274149  71510 303745916      745817        syn-C2H3C(O)NH2, v=0
  820872.9511  0.0023 -4.5705 3  207.5842 77  71510 303381524      371225        syn-C2H3C(O)NH2, v=0
  820892.0103  0.0668 -5.4190 3 1127.0225181  71510 303902467      902170        syn-C2H3C(O)NH2, v=0
  820973.9950  0.0107 -2.6786 3  512.6934 81  71510 3034038 2      3937 3        syn-C2H3C(O)NH2, v=0
  820973.9950  0.0107 -2.6786 3  512.6934 81  71510 3034038 3      3937 2        syn-C2H3C(O)NH2, v=0
  821027.6752  0.0021 -5.2209 3  139.2579 59  71510 303291614      281315        syn-C2H3C(O)NH2, v=0
  821027.7725  0.0021 -5.2209 3  139.2579 59  71510 303291613      281316        syn-C2H3C(O)NH2, v=0
  821031.0762  0.1829 -5.0265 3 1447.4850147  71510 303735914      735815        syn-C2H3C(O)NH2, v=0
  821031.0762  0.1829 -5.0265 3 1447.4850147  71510 303735915      735816        syn-C2H3C(O)NH2, v=0
  821203.1140  0.1505 -5.2149 3 1667.5306221  71510 303B02684      A92783        syn-C2H3C(O)NH2, v=0
  821206.6022  0.1833 -5.0172 3 1429.7867145  71510 303725913      725814        syn-C2H3C(O)NH2, v=0
  821206.6022  0.1833 -5.0172 3 1429.7867145  71510 303725914      725815        syn-C2H3C(O)NH2, v=0
  821377.1147  0.1838 -5.0105 3 1412.3325143  71510 303715912      715813        syn-C2H3C(O)NH2, v=0
  821377.1147  0.1838 -5.0105 3 1412.3325143  71510 303715913      715814        syn-C2H3C(O)NH2, v=0
  821415.2601  0.0085 -2.6968 3  515.1948 85  71510 3034237 5      4136 6        syn-C2H3C(O)NH2, v=0
  821415.2601  0.0085 -2.6968 3  515.1948 85  71510 3034237 6      4136 5        syn-C2H3C(O)NH2, v=0
  821453.7884  0.1036 -4.6616 3 1329.1247197  71510 303982574      972473        syn-C2H3C(O)NH2, v=0
  821542.7230  0.1843 -5.0068 3 1395.1222141  71510 303705911      705812        syn-C2H3C(O)NH2, v=0
  821542.7230  0.1843 -5.0068 3 1395.1222141  71510 303705912      705813        syn-C2H3C(O)NH2, v=0
  821703.5346  0.1848 -5.0066 3 1378.1559139  71510 303695910      695811        syn-C2H3C(O)NH2, v=0
  821703.5346  0.1848 -5.0066 3 1378.1559139  71510 303695911      695812        syn-C2H3C(O)NH2, v=0
  821782.9623  0.0230 -5.1486 3  827.0137157  71510 303781960      781663        syn-C2H3C(O)NH2, v=0
  821799.4619  0.0054 -4.6530 3  232.2048 95  71510 30347 344      46 245        syn-C2H3C(O)NH2, v=0
  821799.4619  0.0054 -4.6530 3  232.2048 95  71510 30347 444      46 145        syn-C2H3C(O)NH2, v=0
  821804.3752  0.1121 -5.0280 3 1700.2732227  71510 303B32291      B22390        syn-C2H3C(O)NH2, v=0
  821806.8435  0.0030 -3.7968 3  443.4137115  71510 303571642      561343        syn-C2H3C(O)NH2, v=0
  821808.7510  0.1121 -5.0280 3 1700.2732227  71510 303B32391      B22290        syn-C2H3C(O)NH2, v=0
  821838.1380  0.0028 -3.1152 3  641.6318129  71510 303642639      632538        syn-C2H3C(O)NH2, v=0
  821838.1391  0.0028 -3.1152 3  641.6318129  71510 303642638      632539        syn-C2H3C(O)NH2, v=0
  821844.7619  0.0066 -2.7176 3  519.1627 89  71510 3034436 8      4335 9        syn-C2H3C(O)NH2, v=0
  821844.7619  0.0066 -2.7176 3  519.1627 89  71510 3034436 9      4335 8        syn-C2H3C(O)NH2, v=0
  821859.6553  0.1853 -5.0105 3 1361.4334137  71510 3036859 9      685810        syn-C2H3C(O)NH2, v=0
  821859.6553  0.1853 -5.0105 3 1361.4334137  71510 303685910      685811        syn-C2H3C(O)NH2, v=0
  821915.8463  0.0420 -5.2410 3  946.0756167  71510 303832163      831866        syn-C2H3C(O)NH2, v=0
  821956.8653  0.0033 -3.6899 3  451.9565117  71510 303581544      571245        syn-C2H3C(O)NH2, v=0
  822011.1893  0.1859 -5.0192 3 1344.9546135  71510 3036759 8      6758 9        syn-C2H3C(O)NH2, v=0
  822011.1893  0.1859 -5.0192 3 1344.9546135  71510 3036759 9      675810        syn-C2H3C(O)NH2, v=0
  822113.8511  0.0022 -4.5696 3  207.5429 77  71510 303381523      371226        syn-C2H3C(O)NH2, v=0
  822158.2393  0.1865 -5.0337 3 1328.7196133  71510 3036659 7      6658 8        syn-C2H3C(O)NH2, v=0
  822158.2393  0.1865 -5.0337 3 1328.7196133  71510 3036659 8      6658 9        syn-C2H3C(O)NH2, v=0
  822256.3665  0.0052 -2.7412 3  524.6025 93  71510 303463511      453412        syn-C2H3C(O)NH2, v=0
  822256.3665  0.0052 -2.7412 3  524.6025 93  71510 303463512      453411        syn-C2H3C(O)NH2, v=0
  822300.9060  0.1870 -5.0554 3 1312.7283131  71510 3036559 6      6558 7        syn-C2H3C(O)NH2, v=0
  822300.9060  0.1870 -5.0554 3 1312.7283131  71510 3036559 7      6558 8        syn-C2H3C(O)NH2, v=0
  822439.2889  0.1877 -5.0866 3 1296.9805129  71510 3036459 5      6458 6        syn-C2H3C(O)NH2, v=0
  822439.2889  0.1877 -5.0866 3 1296.9805129  71510 3036459 6      6458 7        syn-C2H3C(O)NH2, v=0
  822523.7071  0.0034 -3.6858 3  431.0984115  71510 303571444      561145        syn-C2H3C(O)NH2, v=0
  822573.4856  0.1883 -5.1304 3 1281.4763127  71510 3036359 4      6358 5        syn-C2H3C(O)NH2, v=0
  822573.4856  0.1883 -5.1304 3 1281.4763127  71510 3036359 5      6358 6        syn-C2H3C(O)NH2, v=0
  822641.6047  0.0040 -2.7677 3  531.5211 97  71510 303483414      473315        syn-C2H3C(O)NH2, v=0
  822641.6047  0.0040 -2.7677 3  531.5211 97  71510 303483415      473314        syn-C2H3C(O)NH2, v=0
  822703.5922  0.1889 -5.1924 3 1266.2156125  71510 3036259 3      6258 4        syn-C2H3C(O)NH2, v=0
  822703.5922  0.1889 -5.1924 3 1266.2156125  71510 3036259 4      6258 5        syn-C2H3C(O)NH2, v=0
  822778.1439  0.0037 -3.9056 3  414.6919111  71510 303551640      541341        syn-C2H3C(O)NH2, v=0
  822795.9023  0.0025 -3.0548 3  622.3474125  71510 303622735      612636        syn-C2H3C(O)NH2, v=0
  822795.9023  0.0025 -3.0548 3  622.3474125  71510 303622736      612635        syn-C2H3C(O)NH2, v=0
  822829.7033  0.1896 -5.2829 3 1251.1983123  71510 3036159 2      6158 3        syn-C2H3C(O)NH2, v=0
  822829.7033  0.1896 -5.2829 3 1251.1983123  71510 3036159 3      6158 4        syn-C2H3C(O)NH2, v=0
  822867.6834  0.0036 -3.7053 3  410.3074113  71510 303561244      551145        syn-C2H3C(O)NH2, v=0
  822951.9118  0.1903 -5.4249 3 1236.4243121  71510 3036059 1      6058 2        syn-C2H3C(O)NH2, v=0
  822951.9118  0.1903 -5.4249 3 1236.4243121  71510 3036059 2      6058 3        syn-C2H3C(O)NH2, v=0
  822988.8555  0.0032 -2.7973 3  539.9267101  71510 303503317      493218        syn-C2H3C(O)NH2, v=0
  822988.8555  0.0032 -2.7973 3  539.9267101  71510 303503318      493217        syn-C2H3C(O)NH2, v=0
  823206.0036  0.1083 -5.0432 3 1686.6599225  71510 303B22389      B12488        syn-C2H3C(O)NH2, v=0
  823267.7814  0.1082 -5.0431 3 1686.6586225  71510 303B22489      B12388        syn-C2H3C(O)NH2, v=0
  823282.2066  0.0027 -2.8303 3  549.8291105  71510 303523220      513121        syn-C2H3C(O)NH2, v=0
  823282.2066  0.0027 -2.8303 3  549.8291105  71510 303523221      513120        syn-C2H3C(O)NH2, v=0
  823302.6607  0.0044 -4.9969 3  641.1757133  71510 303662343      662046        syn-C2H3C(O)NH2, v=0
  823332.2984  0.0024 -3.0005 3  604.7024121  71510 303602832      592733        syn-C2H3C(O)NH2, v=0
  823332.2984  0.0024 -3.0005 3  604.7024121  71510 303602833      592732        syn-C2H3C(O)NH2, v=0
  823499.8286  0.0024 -2.8667 3  561.2406109  71510 303543123      533024        syn-C2H3C(O)NH2, v=0
  823499.8286  0.0024 -2.8667 3  561.2406109  71510 303543124      533023        syn-C2H3C(O)NH2, v=0
  823575.5593  0.0023 -2.9514 3  588.6557117  71510 303582929      572830        syn-C2H3C(O)NH2, v=0
  823575.5593  0.0023 -2.9514 3  588.6557117  71510 303582930      572829        syn-C2H3C(O)NH2, v=0
  823611.6041  0.0023 -2.9070 3  574.1765113  71510 303563026      552927        syn-C2H3C(O)NH2, v=0
  823611.6041  0.0023 -2.9070 3  574.1765113  71510 303563027      552926        syn-C2H3C(O)NH2, v=0
  823693.6708  0.0024 -4.5245 3  217.1739 79  71510 303391525      381226        syn-C2H3C(O)NH2, v=0
  823788.0217  0.1826 -5.0061 3 1842.1487255  71510 303C7 9B8      C610B7        syn-C2H3C(O)NH2, v=0
  823788.0217  0.1826 -5.0061 3 1842.1487255  71510 303C710B8      C6 9B7        syn-C2H3C(O)NH2, v=0
  823790.0728  0.1889 -5.0008 3 1846.8807257  71510 303C8 8C0      C7 9B9        syn-C2H3C(O)NH2, v=0
  823790.0728  0.1889 -5.0008 3 1846.8807257  71510 303C8 9C0      C7 8B9        syn-C2H3C(O)NH2, v=0
  823796.7435  0.1766 -5.0110 3 1836.8761253  71510 303C610B6      C511B5        syn-C2H3C(O)NH2, v=0
  823796.7435  0.1766 -5.0110 3 1836.8761253  71510 303C611B6      C510B5        syn-C2H3C(O)NH2, v=0
  823799.9454  0.1958 -4.9949 3 1851.0778259  71510 303C9 7C2      C8 8C1        syn-C2H3C(O)NH2, v=0
  823799.9454  0.1958 -4.9949 3 1851.0778259  71510 303C9 8C2      C8 7C1        syn-C2H3C(O)NH2, v=0
  823815.1533  0.2034 -4.9884 3 1854.7445261  71510 303D0 6C4      C9 7C3        syn-C2H3C(O)NH2, v=0
  823815.1533  0.2034 -4.9884 3 1854.7445261  71510 303D0 7C4      C9 6C3        syn-C2H3C(O)NH2, v=0
  823819.7718  0.1710 -5.0155 3 1831.0568251  71510 303C511B4      C412B3        syn-C2H3C(O)NH2, v=0
  823819.7718  0.1710 -5.0155 3 1831.0568251  71510 303C512B4      C411B3        syn-C2H3C(O)NH2, v=0
  823833.5863  0.2119 -4.9814 3 1857.8852263  71510 303D1 5C6      D0 6C5        syn-C2H3C(O)NH2, v=0
  823833.5863  0.2119 -4.9814 3 1857.8852263  71510 303D1 6C6      D0 5C5        syn-C2H3C(O)NH2, v=0
  823853.4396  0.2216 -4.9737 3 1860.5034265  71510 303D2 4C8      D1 5C7        syn-C2H3C(O)NH2, v=0
  823853.4396  0.2216 -4.9737 3 1860.5034265  71510 303D2 5C8      D1 4C7        syn-C2H3C(O)NH2, v=0
  823861.3749  0.1656 -5.0195 3 1824.6837249  71510 303C412B2      C313B1        syn-C2H3C(O)NH2, v=0
  823861.3749  0.1656 -5.0195 3 1824.6837249  71510 303C413B2      C312B1        syn-C2H3C(O)NH2, v=0
  823873.1589  0.2328 -4.9654 3 1862.6025267  71510 303D3 3D0      D2 4C9        syn-C2H3C(O)NH2, v=0
  823873.1589  0.2328 -4.9654 3 1862.6025267  71510 303D3 4D0      D2 3C9        syn-C2H3C(O)NH2, v=0
  823891.3966  0.2457 -4.9564 3 1864.1852269  71510 303D4 2D2      D3 3D1        syn-C2H3C(O)NH2, v=0
  823891.3966  0.2457 -4.9564 3 1864.1852269  71510 303D4 3D2      D3 2D1        syn-C2H3C(O)NH2, v=0
  823897.3504  0.0031 -4.2243 3  286.3565 93  71510 303461432      451135        syn-C2H3C(O)NH2, v=0
  823906.9761  0.2608 -4.9467 3 1865.2540271  71510 303D5 1D4      D4 2D3        syn-C2H3C(O)NH2, v=0
  823906.9761  0.2608 -4.9467 3 1865.2540271  71510 303D5 2D4      D4 1D3        syn-C2H3C(O)NH2, v=0
  823918.8636  0.2784 -4.9363 3 1865.8111273  71510 303D6 0D6      D5 1D5        syn-C2H3C(O)NH2, v=0
  823918.8636  0.2784 -4.9363 3 1865.8111273  71510 303D6 1D6      D5 0D5        syn-C2H3C(O)NH2, v=0
  823926.7603  0.1603 -5.0233 3 1817.7484247  71510 303C313B0      C214A9        syn-C2H3C(O)NH2, v=0
  823926.7603  0.1603 -5.0233 3 1817.7484247  71510 303C314B0      C213A9        syn-C2H3C(O)NH2, v=0
  823991.2647  0.0032 -4.3616 3  258.5281 87  71510 303431529      421230        syn-C2H3C(O)NH2, v=0
  824022.3520  0.1552 -5.0269 3 1810.2415245  71510 303C214A8      C115A7        syn-C2H3C(O)NH2, v=0
  824022.3520  0.1552 -5.0269 3 1810.2415245  71510 303C215A8      C114A7        syn-C2H3C(O)NH2, v=0
  824100.8217  0.0652 -5.4841 3 1182.7114185  71510 303922568      922271        syn-C2H3C(O)NH2, v=0
  824107.8567  0.0045 -3.2918 3  702.3550139  71510 303692446      682345        syn-C2H3C(O)NH2, v=0
  824114.3097  0.0045 -3.2917 3  702.3548139  71510 303692445      682346        syn-C2H3C(O)NH2, v=0
  824156.1740  0.1502 -5.0303 3 1802.1519243  71510 303C115A6      C016A5        syn-C2H3C(O)NH2, v=0
  824156.1740  0.1502 -5.0303 3 1802.1519243  71510 303C116A6      C015A5        syn-C2H3C(O)NH2, v=0
  824238.2423  0.2389 -5.4043 3 1734.3182225  71510 303B22785      B12884        syn-C2H3C(O)NH2, v=0
  824297.8129  0.0208 -5.2268 3  960.5523165  71510 303822558      822261        syn-C2H3C(O)NH2, v=0
  824325.2800  0.0057 -4.5629 3  253.6360 89  71510 303441232      43 935        syn-C2H3C(O)NH2, v=0
  824338.3930  0.1452 -5.0337 3 1793.4663241  71510 303C016A4      B917A3        syn-C2H3C(O)NH2, v=0
  824338.3930  0.1452 -5.0337 3 1793.4663241  71510 303C017A4      B916A3        syn-C2H3C(O)NH2, v=0
  824358.8848  0.0044 -4.9959 3  641.1404133  71510 303662344      662047        syn-C2H3C(O)NH2, v=0
  824429.5656  0.0634 -5.3662 3 1072.4483177  71510 303882366      882069        syn-C2H3C(O)NH2, v=0
  824564.9940  0.0029 -5.0317 3  464.2730111  71510 303552233      551936        syn-C2H3C(O)NH2, v=0
  824578.8744  0.0029 -5.0317 3  464.2726111  71510 303552234      551937        syn-C2H3C(O)NH2, v=0
  824582.1069  0.1404 -5.0374 3 1784.1694239  71510 303B917A2      B818A1        syn-C2H3C(O)NH2, v=0
  824582.1069  0.1404 -5.0374 3 1784.1694239  71510 303B918A2      B817A1        syn-C2H3C(O)NH2, v=0
  824729.0978  0.0066 -4.8142 3  227.4787 85  71510 303421131      41 834        syn-C2H3C(O)NH2, v=0
  824904.5260  0.1356 -5.0414 3 1774.2424237  71510 303B818A0      B71999        syn-C2H3C(O)NH2, v=0
  824904.5260  0.1356 -5.0414 3 1774.2424237  71510 303B819A0      B71899        syn-C2H3C(O)NH2, v=0
  824923.6347  0.1050 -5.0658 3 1672.1137223  71510 303B12487      B02586        syn-C2H3C(O)NH2, v=0
  824964.2844  0.1073 -5.1053 3 1656.5195221  71510 303B02585      A92684        syn-C2H3C(O)NH2, v=0
  825048.1592  0.0887 -4.9996 3 1574.3378215  71510 303A72682      A62581        syn-C2H3C(O)NH2, v=0
  825225.8750  0.0061 -3.4223 3  745.4926145  71510 303722350      712249        syn-C2H3C(O)NH2, v=0
  825252.2535  0.0066 -3.7392 3  518.0106125  71510 303621547      611448        syn-C2H3C(O)NH2, v=0
  825328.8084  0.1310 -5.0461 3 1763.6628235  71510 303B71998      B62097        syn-C2H3C(O)NH2, v=0
  825328.8087  0.1310 -5.0461 3 1763.6628235  71510 303B72098      B61997        syn-C2H3C(O)NH2, v=0
  825334.1202  0.0077 -5.0952 3  670.7651143  71510 303711556      711259        syn-C2H3C(O)NH2, v=0
  825516.3586  0.0370 -4.0936 3 1005.7671171  71510 303852363      842262        syn-C2H3C(O)NH2, v=0
  825578.2475  0.0062 -3.4220 3  745.4829145  71510 303722349      712250        syn-C2H3C(O)NH2, v=0
  825647.4247  0.0926 -4.9692 3 1547.2715213  71510 303A62681      A52580        syn-C2H3C(O)NH2, v=0
  825655.9780  0.1039 -5.0650 3 1672.0986223  71510 303B12587      B02486        syn-C2H3C(O)NH2, v=0
  825673.1442  0.0025 -4.4808 3  227.0533 81  71510 303401526      391227        syn-C2H3C(O)NH2, v=0
  825883.8880  0.0023 -4.5230 3  217.1010 79  71510 303391524      381227        syn-C2H3C(O)NH2, v=0
  825887.0426  0.1265 -5.0519 3 1752.4024233  71510 303B62096      B52195        syn-C2H3C(O)NH2, v=0
  825887.0504  0.1265 -5.0519 3 1752.4024233  71510 303B62196      B52095        syn-C2H3C(O)NH2, v=0
  826104.0446  0.0029 -4.3999 3  247.7196 85  71510 303421528      411229        syn-C2H3C(O)NH2, v=0
  826175.7770  0.0892 -5.0311 3 1601.5368217  71510 303A82683      A72582        syn-C2H3C(O)NH2, v=0
  826232.9155  0.0088 -3.5900 3  792.2940151  71510 303752253      742154        syn-C2H3C(O)NH2, v=0
  826432.1593  0.0046 -4.3904 3  250.9718 97  71510 30348 444      47 345        syn-C2H3C(O)NH2, v=0
  826432.1598  0.0046 -4.3904 3  250.9718 97  71510 30348 544      47 245        syn-C2H3C(O)NH2, v=0
  826443.6826  0.0184 -5.1400 3  779.4422153  71510 303761759      761462        syn-C2H3C(O)NH2, v=0
  826545.3879  0.0029 -3.7624 3  458.0004117  71510 303581643      571344        syn-C2H3C(O)NH2, v=0
  826570.8802  0.0027 -4.4394 3  237.2316 83  71510 303411527      401228        syn-C2H3C(O)NH2, v=0
  826625.3285  0.1221 -5.0593 3 1740.4255231  71510 303B52194      B42293        syn-C2H3C(O)NH2, v=0
  826625.4804  0.1221 -5.0593 3 1740.4255231  71510 303B52294      B42193        syn-C2H3C(O)NH2, v=0
  826635.6406  0.0075 -5.0941 3  670.7652143  71510 303711656      711359        syn-C2H3C(O)NH2, v=0
  826775.5548  0.0160 -3.7456 3  758.0880149  71510 303742054      731955        syn-C2H3C(O)NH2, v=0
  826905.7146  0.0037 -3.2119 3  679.0234135  71510 303672543      662442        syn-C2H3C(O)NH2, v=0
  826905.8600  0.0037 -3.2119 3  679.0234135  71510 303672542      662443        syn-C2H3C(O)NH2, v=0
  827085.9883  0.0098 -5.0799 3  792.2940149  71510 303742451      742154        syn-C2H3C(O)NH2, v=0
  827241.8440  0.0020 -5.1451 3  146.4136 61  71510 303301615      291316        syn-C2H3C(O)NH2, v=0
  827242.0932  0.0020 -5.1451 3  146.4136 61  71510 303301614      291317        syn-C2H3C(O)NH2, v=0
  827423.9952  0.0032 -3.7020 3  410.3035113  71510 303561344      551045        syn-C2H3C(O)NH2, v=0
  827612.3615  0.1179 -5.0692 3 1727.6857229  71510 303B42292      B32391        syn-C2H3C(O)NH2, v=0
  827614.9291  0.1179 -5.0692 3 1727.6857229  71510 303B42392      B32291        syn-C2H3C(O)NH2, v=0
  827771.8198  0.0132 -2.6756 3  520.8841 79  71510 3033939 0      3838 1        syn-C2H3C(O)NH2, v=0
  827771.8198  0.0132 -2.6756 3  520.8841 79  71510 3033939 1      3838 0        syn-C2H3C(O)NH2, v=0
  827925.9600  0.0367 -5.4648 3 1168.7605183  71510 303912666      912369        syn-C2H3C(O)NH2, v=0
  828031.4651  0.0041 -3.9735 3  400.5792109  71510 303541639      531340        syn-C2H3C(O)NH2, v=0
  828102.9180  0.0029 -5.0509 3  450.5382109  71510 303542232      541935        syn-C2H3C(O)NH2, v=0
  828110.0495  0.0029 -5.0509 3  450.5380109  71510 303542233      541936        syn-C2H3C(O)NH2, v=0
  828136.1657  0.0414 -5.4941 3 1192.1391185  71510 303922667      922370        syn-C2H3C(O)NH2, v=0
  828217.0341  0.0492 -5.3620 3 1034.4118171  71510 303852659      852362        syn-C2H3C(O)NH2, v=0
  828218.6667  0.0106 -2.6921 3  522.4155 83  71510 3034138 3      4037 4        syn-C2H3C(O)NH2, v=0
  828218.6667  0.0106 -2.6921 3  522.4155 83  71510 3034138 4      4037 3        syn-C2H3C(O)NH2, v=0
  828426.3999  0.1014 -4.9395 3 1520.3263211  71510 303A52680      A42579        syn-C2H3C(O)NH2, v=0
  828470.5705  0.0102 -3.7753 3  612.2622135  71510 303671750      661651        syn-C2H3C(O)NH2, v=0
  828611.7364  0.0925 -5.0637 3 1628.8800219  71510 303A92684      A82583        syn-C2H3C(O)NH2, v=0
  828656.1046  0.0031 -3.1421 3  657.4853131  71510 303652640      642539        syn-C2H3C(O)NH2, v=0
  828656.1070  0.0031 -3.1421 3  657.4853131  71510 303652639      642540        syn-C2H3C(O)NH2, v=0
  828656.8865  0.0084 -2.7111 3  525.4101 87  71510 3034337 6      4236 7        syn-C2H3C(O)NH2, v=0
  828656.8865  0.0084 -2.7111 3  525.4101 87  71510 3034337 7      4236 6        syn-C2H3C(O)NH2, v=0
  828946.0355  0.1138 -5.0830 3 1714.1199227  71510 303B32390      B22489        syn-C2H3C(O)NH2, v=0
  828983.3060  0.1138 -5.0830 3 1714.1191227  71510 303B32490      B22389        syn-C2H3C(O)NH2, v=0
  829081.6721  0.0066 -2.7327 3  529.8726 91  71510 3034536 9      443510        syn-C2H3C(O)NH2, v=0
  829081.6721  0.0066 -2.7327 3  529.8726 91  71510 303453610      4435 9        syn-C2H3C(O)NH2, v=0
  829426.7265  0.0023 -4.4785 3  226.9284 81  71510 303401525      391228        syn-C2H3C(O)NH2, v=0
  829486.3565  0.0051 -2.7571 3  535.8091 95  71510 303473512      463413        syn-C2H3C(O)NH2, v=0
  829486.3565  0.0051 -2.7571 3  535.8091 95  71510 303473513      463412        syn-C2H3C(O)NH2, v=0
  829640.9334  0.0095 -5.0797 3  773.6626147  71510 303732449      732152        syn-C2H3C(O)NH2, v=0
  829732.4420  0.0027 -3.0801 3  637.6565127  71510 303632737      622636        syn-C2H3C(O)NH2, v=0
  829732.4421  0.0027 -3.0801 3  637.6565127  71510 303632736      622637        syn-C2H3C(O)NH2, v=0
  829769.0342  0.1910 -5.0531 3 1869.6273257  71510 303C8 9B9      C710B8        syn-C2H3C(O)NH2, v=0
  829769.0342  0.1910 -5.0531 3 1869.6273257  71510 303C810B9      C7 9B8        syn-C2H3C(O)NH2, v=0
  829772.1713  0.1976 -5.0478 3 1874.3594259  71510 303C9 8C1      C8 9C0        syn-C2H3C(O)NH2, v=0
  829772.1713  0.1976 -5.0478 3 1874.3594259  71510 303C9 9C1      C8 8C0        syn-C2H3C(O)NH2, v=0
  829776.3295  0.1848 -5.0578 3 1864.3550255  71510 303C710B7      C611B6        syn-C2H3C(O)NH2, v=0
  829776.3295  0.1848 -5.0578 3 1864.3550255  71510 303C711B7      C610B6        syn-C2H3C(O)NH2, v=0
  829782.8619  0.2048 -5.0421 3 1878.5568261  71510 303D0 7C3      C9 8C2        syn-C2H3C(O)NH2, v=0
  829782.8619  0.2048 -5.0421 3 1878.5568261  71510 303D0 8C3      C9 7C2        syn-C2H3C(O)NH2, v=0
  829797.4961  0.1790 -5.0620 3 1858.5365253  71510 303C611B5      C512B4        syn-C2H3C(O)NH2, v=0
  829797.4961  0.1790 -5.0620 3 1858.5365253  71510 303C612B5      C511B4        syn-C2H3C(O)NH2, v=0
  829798.6763  0.2127 -5.0358 3 1882.2240263  71510 303D1 6C5      D0 7C4        syn-C2H3C(O)NH2, v=0
  829798.6763  0.2127 -5.0358 3 1882.2240263  71510 303D1 7C5      D0 6C4        syn-C2H3C(O)NH2, v=0
  829817.5481  0.2215 -5.0288 3 1885.3653265  71510 303D2 5C7      D1 6C6        syn-C2H3C(O)NH2, v=0
  829817.5481  0.2215 -5.0288 3 1885.3653265  71510 303D2 6C7      D1 5C6        syn-C2H3C(O)NH2, v=0
  829824.0797  0.0341 -5.4385 3 1145.5971181  71510 303902665      902368        syn-C2H3C(O)NH2, v=0
  829834.2807  0.0041 -5.0004 3  624.4992131  71510 303652342      652045        syn-C2H3C(O)NH2, v=0
  829836.6787  0.1734 -5.0659 3 1852.1647251  71510 303C512B3      C413B2        syn-C2H3C(O)NH2, v=0
  829836.6787  0.1734 -5.0659 3 1852.1647251  71510 303C513B3      C412B2        syn-C2H3C(O)NH2, v=0
  829837.7069  0.2316 -5.0213 3 1887.9842267  71510 303D3 4C9      D2 5C8        syn-C2H3C(O)NH2, v=0
  829837.7069  0.2316 -5.0213 3 1887.9842267  71510 303D3 5C9      D2 4C8        syn-C2H3C(O)NH2, v=0
  829857.6252  0.2432 -5.0131 3 1890.0839269  71510 303D4 3D1      D3 4D0        syn-C2H3C(O)NH2, v=0
  829857.6252  0.2432 -5.0131 3 1890.0839269  71510 303D4 4D1      D3 3D0        syn-C2H3C(O)NH2, v=0
  829861.7818  0.0040 -2.7846 3  543.2265 99  71510 303493415      483316        syn-C2H3C(O)NH2, v=0
  829861.7818  0.0040 -2.7846 3  543.2265 99  71510 303493416      483315        syn-C2H3C(O)NH2, v=0
  829875.9765  0.2567 -5.0042 3 1891.6672271  71510 303D5 2D3      D4 3D2        syn-C2H3C(O)NH2, v=0
  829875.9765  0.2567 -5.0042 3 1891.6672271  71510 303D5 3D3      D4 2D2        syn-C2H3C(O)NH2, v=0
  829891.6005  0.2722 -4.9946 3 1892.7366273  71510 303D6 1D5      D5 2D4        syn-C2H3C(O)NH2, v=0
  829891.6005  0.2722 -4.9946 3 1892.7366273  71510 303D6 2D5      D5 1D4        syn-C2H3C(O)NH2, v=0
  829898.9215  0.1679 -5.0695 3 1845.2317249  71510 303C413B1      C314B0        syn-C2H3C(O)NH2, v=0
  829898.9215  0.1679 -5.0695 3 1845.2317249  71510 303C414B1      C313B0        syn-C2H3C(O)NH2, v=0
  829903.4762  0.2904 -4.9843 3 1893.2941275  71510 303D7 0D7      D6 1D6        syn-C2H3C(O)NH2, v=0
  829903.4762  0.2904 -4.9843 3 1893.2941275  71510 303D7 1D7      D6 0D6        syn-C2H3C(O)NH2, v=0
  829970.7437  0.0073 -5.0839 3  202.5323 81  71510 303401030      39 733        syn-C2H3C(O)NH2, v=0
  829990.4300  0.1626 -5.0728 3 1837.7280247  71510 303C314A9      C215A8        syn-C2H3C(O)NH2, v=0
  829990.4300  0.1626 -5.0728 3 1837.7280247  71510 303C315A9      C214A8        syn-C2H3C(O)NH2, v=0
  830118.9314  0.1574 -5.0760 3 1829.6427245  71510 303C215A7      C116A6        syn-C2H3C(O)NH2, v=0
  830118.9314  0.1574 -5.0760 3 1829.6427245  71510 303C216A7      C115A6        syn-C2H3C(O)NH2, v=0
  830195.4292  0.0032 -2.8152 3  552.1334103  71510 303513318      503219        syn-C2H3C(O)NH2, v=0
  830195.4292  0.0032 -2.8152 3  552.1334103  71510 303513319      503218        syn-C2H3C(O)NH2, v=0
  830294.1830  0.1522 -5.0791 3 1820.9633243  71510 303C116A5      C017A4        syn-C2H3C(O)NH2, v=0
  830294.1830  0.1522 -5.0791 3 1820.9633243  71510 303C117A5      C016A4        syn-C2H3C(O)NH2, v=0
  830353.6844  0.0025 -3.0243 3  619.4779123  71510 303612833      602734        syn-C2H3C(O)NH2, v=0
  830353.6844  0.0025 -3.0243 3  619.4779123  71510 303612834      602733        syn-C2H3C(O)NH2, v=0
  830380.0438  0.0038 -4.2080 3  270.0237 99  71510 30349 544      48 445        syn-C2H3C(O)NH2, v=0
  830380.0500  0.0038 -4.2080 3  270.0237 99  71510 30349 644      48 345        syn-C2H3C(O)NH2, v=0
  830422.2107  0.0050 -3.3241 3  719.6155141  71510 303702447      692346        syn-C2H3C(O)NH2, v=0
  830428.5521  0.2009 -5.5954 3 1880.0366187  71510 303936033      935934        syn-C2H3C(O)NH2, v=0
  830428.5521  0.2009 -5.5954 3 1880.0366187  71510 303936034      935935        syn-C2H3C(O)NH2, v=0
  830434.4064  0.0050 -3.3241 3  719.6151141  71510 303702446      692347        syn-C2H3C(O)NH2, v=0
  830454.2104  0.0040 -4.9998 3  624.4785131  71510 303652343      652046        syn-C2H3C(O)NH2, v=0
  830470.2010  0.0028 -2.8491 3  562.5404107  71510 303533221      523122        syn-C2H3C(O)NH2, v=0
  830470.2010  0.0028 -2.8491 3  562.5404107  71510 303533222      523121        syn-C2H3C(O)NH2, v=0
  830528.7053  0.1472 -5.0824 3 1811.6745241  71510 303C017A3      B918A2        syn-C2H3C(O)NH2, v=0
  830528.7053  0.1472 -5.0824 3 1811.6745241  71510 303C018A3      B917A2        syn-C2H3C(O)NH2, v=0
  830536.4114  0.0042 -3.7079 3  445.0329117  71510 303581345      571246        syn-C2H3C(O)NH2, v=0
  830652.8443  0.1103 -5.1034 3 1699.6396225  71510 303B22488      B12587        syn-C2H3C(O)NH2, v=0
  830654.2267  0.0489 -5.5269 3 1215.7255187  71510 303932668      932371        syn-C2H3C(O)NH2, v=0
  830658.8479  0.0024 -2.9738 3  602.9063119  71510 303592930      582831        syn-C2H3C(O)NH2, v=0
  830658.8479  0.0024 -2.9738 3  602.9063119  71510 303592931      582830        syn-C2H3C(O)NH2, v=0
  830662.6787  0.0025 -2.8867 3  574.4602111  71510 303553124      543025        syn-C2H3C(O)NH2, v=0
  830662.6787  0.0025 -2.8867 3  574.4602111  71510 303553125      543024        syn-C2H3C(O)NH2, v=0
  830721.7366  0.2005 -5.5597 3 1857.4524185  71510 303926032      925933        syn-C2H3C(O)NH2, v=0
  830721.7366  0.2005 -5.5597 3 1857.4524185  71510 303926033      925934        syn-C2H3C(O)NH2, v=0
  830740.5700  0.0024 -2.9281 3  587.9088115  71510 303573027      562928        syn-C2H3C(O)NH2, v=0
  830740.5700  0.0024 -2.9281 3  587.9088115  71510 303573028      562927        syn-C2H3C(O)NH2, v=0
  830796.9947  0.0068 -3.4599 3  763.6537147  71510 303732351      722250        syn-C2H3C(O)NH2, v=0
  830797.4086  0.0045 -5.6105 3  358.4528111  71510 30355 748      55 451        syn-C2H3C(O)NH2, v=0
  830797.4589  0.0045 -5.6105 3  358.4528111  71510 30355 848      55 551        syn-C2H3C(O)NH2, v=0
  830838.8739  0.1423 -5.0860 3 1801.7583239  71510 303B918A1      B819A0        syn-C2H3C(O)NH2, v=0
  830838.8739  0.1423 -5.0860 3 1801.7583239  71510 303B919A1      B818A0        syn-C2H3C(O)NH2, v=0
  830896.0636  0.0158 -3.7780 3  713.8788145  71510 303721953      711854        syn-C2H3C(O)NH2, v=0
  831007.6530  0.2001 -5.5248 3 1835.1134183  71510 303916031      915932        syn-C2H3C(O)NH2, v=0
  831007.6530  0.2001 -5.5248 3 1835.1134183  71510 303916032      915933        syn-C2H3C(O)NH2, v=0
  831109.5557  0.1095 -5.1029 3 1699.6302225  71510 303B22588      B12487        syn-C2H3C(O)NH2, v=0
  831211.6848  0.0030 -3.7311 3  389.6415111  71510 303551144      541045        syn-C2H3C(O)NH2, v=0
  831246.6015  0.1375 -5.0903 3 1791.1928237  71510 303B81999      B72098        syn-C2H3C(O)NH2, v=0
  831246.6017  0.1375 -5.0903 3 1791.1928237  71510 303B82099      B71998        syn-C2H3C(O)NH2, v=0
  831286.4408  0.1998 -5.4908 3 1813.0196181  71510 303906030      905931        syn-C2H3C(O)NH2, v=0
  831286.4408  0.1998 -5.4908 3 1813.0196181  71510 303906031      905932        syn-C2H3C(O)NH2, v=0
  831401.9258  0.0029 -5.0719 3  437.0696107  71510 303532231      531934        syn-C2H3C(O)NH2, v=0
  831405.5240  0.0029 -5.0719 3  437.0695107  71510 303532232      531935        syn-C2H3C(O)NH2, v=0
  831407.3846  0.0069 -3.4593 3  763.6371147  71510 303732350      722251        syn-C2H3C(O)NH2, v=0
  831505.5674  0.1103 -5.1375 3 1684.1302223  71510 303B12586      B02685        syn-C2H3C(O)NH2, v=0
  831558.2373  0.1996 -5.4578 3 1791.1710179  71510 303896029      895930        syn-C2H3C(O)NH2, v=0
  831558.2373  0.1996 -5.4578 3 1791.1710179  71510 303896030      895931        syn-C2H3C(O)NH2, v=0
  831599.5161  0.1396 -5.2349 3 1695.4028223  71510 303B12685      B02784        syn-C2H3C(O)NH2, v=0
  831782.0453  0.1328 -5.0955 3 1779.9510235  71510 303B72097      B62196        syn-C2H3C(O)NH2, v=0
  831782.0496  0.1328 -5.0955 3 1779.9510235  71510 303B72197      B62096        syn-C2H3C(O)NH2, v=0
  831823.1779  0.1994 -5.4257 3 1769.5675177  71510 303886028      885929        syn-C2H3C(O)NH2, v=0
  831823.1779  0.1994 -5.4257 3 1769.5675177  71510 303886029      885930        syn-C2H3C(O)NH2, v=0
  831834.0136  0.0053 -3.7219 3  480.9380121  71510 303601446      591347        syn-C2H3C(O)NH2, v=0
  831865.3672  0.0167 -5.1355 3  779.4426153  71510 303761859      761562        syn-C2H3C(O)NH2, v=0
  831881.1654  0.0058 -5.1077 3  627.4003139  71510 303691455      691158        syn-C2H3C(O)NH2, v=0
  831916.5580  0.0713 -4.3659 3 1149.9015183  71510 303912468      902367        syn-C2H3C(O)NH2, v=0
  831916.6990  0.0878 -5.5260 3 1156.0708181  71510 303902763      902466        syn-C2H3C(O)NH2, v=0
  832007.2535  0.0976 -5.0975 3 1656.3774221  71510 303B02685      A92584        syn-C2H3C(O)NH2, v=0
  832081.3959  0.1993 -5.3946 3 1748.2089175  71510 303876027      875928        syn-C2H3C(O)NH2, v=0
  832081.3959  0.1993 -5.3946 3 1748.2089175  71510 303876028      875929        syn-C2H3C(O)NH2, v=0
  832248.5458  0.0030 -3.7303 3  389.6409111  71510 303551244      54 945        syn-C2H3C(O)NH2, v=0
  832249.0510  0.0194 -5.2140 3  939.6226163  71510 303812557      812260        syn-C2H3C(O)NH2, v=0
  832333.0227  0.1992 -5.3646 3 1727.0953173  71510 303866026      865927        syn-C2H3C(O)NH2, v=0
  832333.0227  0.1992 -5.3646 3 1727.0953173  71510 303866027      865928        syn-C2H3C(O)NH2, v=0
  832348.4811  0.0057 -5.1072 3  627.4003139  71510 303691555      691258        syn-C2H3C(O)NH2, v=0
  832488.1772  0.1282 -5.1022 3 1767.9988233  71510 303B62195      B52294        syn-C2H3C(O)NH2, v=0
  832488.2638  0.1282 -5.1022 3 1767.9988233  71510 303B62295      B52194        syn-C2H3C(O)NH2, v=0
  832578.1878  0.1992 -5.3356 3 1706.2265171  71510 303856025      855926        syn-C2H3C(O)NH2, v=0
  832578.1878  0.1992 -5.3356 3 1706.2265171  71510 303856026      855927        syn-C2H3C(O)NH2, v=0
  832654.5202  0.0560 -5.3229 3 1018.9982173  71510 303862265      861968        syn-C2H3C(O)NH2, v=0
  832667.6771  0.0057 -5.5834 3  414.6919109  71510 303541836      541341        syn-C2H3C(O)NH2, v=0
  832807.8304  0.0024 -4.4360 3  237.0241 83  71510 303411526      401229        syn-C2H3C(O)NH2, v=0
  832817.0189  0.1992 -5.3077 3 1685.6024169  71510 303846024      845925        syn-C2H3C(O)NH2, v=0
  832817.0189  0.1992 -5.3077 3 1685.6024169  71510 303846025      845926        syn-C2H3C(O)NH2, v=0
  832844.6528  0.0334 -5.2131 3  895.5439163  71510 303812062      811765        syn-C2H3C(O)NH2, v=0
  832929.3947  0.0076 -5.6047 3  156.3329 73  71510 30336 828      35 531        syn-C2H3C(O)NH2, v=0
  833049.6415  0.1993 -5.2811 3 1665.2231167  71510 303836023      835924        syn-C2H3C(O)NH2, v=0
  833049.6415  0.1993 -5.2811 3 1665.2231167  71510 303836024      835925        syn-C2H3C(O)NH2, v=0
  833276.1796  0.1994 -5.2556 3 1645.0883165  71510 303826022      825923        syn-C2H3C(O)NH2, v=0
  833276.1796  0.1994 -5.2556 3 1645.0883165  71510 303826023      825924        syn-C2H3C(O)NH2, v=0
  833317.4730  0.0102 -3.6367 3  811.3811153  71510 303762254      752155        syn-C2H3C(O)NH2, v=0
  833324.0797  0.0020 -5.0738 3  153.8253 63  71510 303311616      301317        syn-C2H3C(O)NH2, v=0
  833324.6935  0.0020 -5.0738 3  153.8253 63  71510 303311615      301318        syn-C2H3C(O)NH2, v=0
  833428.6196  0.1238 -5.1112 3 1755.2920231  71510 303B52293      B42392        syn-C2H3C(O)NH2, v=0
  833430.1198  0.1238 -5.1112 3 1755.2919231  71510 303B52393      B42292        syn-C2H3C(O)NH2, v=0
  833496.7554  0.1996 -5.2314 3 1625.1981163  71510 303816021      815922        syn-C2H3C(O)NH2, v=0
  833496.7554  0.1996 -5.2314 3 1625.1981163  71510 303816022      815923        syn-C2H3C(O)NH2, v=0
  833506.0284  0.0042 -3.2417 3  695.6993137  71510 303682544      672443        syn-C2H3C(O)NH2, v=0
  833506.3232  0.0042 -3.2417 3  695.6993137  71510 303682543      672444        syn-C2H3C(O)NH2, v=0
  833551.2354  0.0032 -4.0723 3  289.3501101  71510 30350 644      49 545        syn-C2H3C(O)NH2, v=0
  833551.3040  0.0032 -4.0723 3  289.3501101  71510 30350 744      49 445        syn-C2H3C(O)NH2, v=0
  833579.7238  0.0328 -5.4150 3 1122.6567179  71510 303892664      892367        syn-C2H3C(O)NH2, v=0
  833641.2564  0.0047 -4.3715 3  280.9913 93  71510 303461333      451036        syn-C2H3C(O)NH2, v=0
  833711.4890  0.1998 -5.2086 3 1605.5524161  71510 303806020      805921        syn-C2H3C(O)NH2, v=0
  833711.4890  0.1998 -5.2086 3 1605.5524161  71510 303806021      805922        syn-C2H3C(O)NH2, v=0
  833797.0670  0.1140 -4.9100 3 1493.4932209  71510 303A42679      A32578        syn-C2H3C(O)NH2, v=0
  833920.4991  0.2000 -5.1872 3 1586.1511159  71510 303796019      795920        syn-C2H3C(O)NH2, v=0
  833920.4991  0.2000 -5.1872 3 1586.1511159  71510 303796020      795921        syn-C2H3C(O)NH2, v=0
  833944.3983  0.0152 -3.7312 3  803.5688153  71510 303762155      752056        syn-C2H3C(O)NH2, v=0
  834123.9025  0.2003 -5.1674 3 1566.9940157  71510 303786018      785919        syn-C2H3C(O)NH2, v=0
  834123.9025  0.2003 -5.1674 3 1566.9940157  71510 303786019      785920        syn-C2H3C(O)NH2, v=0
  834260.1126  0.0076 -5.3451 3  178.8118 77  71510 30338 929      37 632        syn-C2H3C(O)NH2, v=0
  834282.3150  0.0034 -5.0255 3  189.2723 77  71510 303381227      37 730        syn-C2H3C(O)NH2, v=0
  834321.8142  0.2007 -5.1493 3 1548.0813155  71510 303776017      775918        syn-C2H3C(O)NH2, v=0
  834321.8142  0.2007 -5.1493 3 1548.0813155  71510 303776018      775919        syn-C2H3C(O)NH2, v=0
  834479.5035  0.0029 -5.0947 3  423.8659105  71510 303522230      521933        syn-C2H3C(O)NH2, v=0
  834481.2858  0.0029 -5.0947 3  423.8659105  71510 303522231      521934        syn-C2H3C(O)NH2, v=0
  834514.3475  0.2010 -5.1329 3 1529.4128153  71510 303766016      765917        syn-C2H3C(O)NH2, v=0
  834514.3475  0.2010 -5.1329 3 1529.4128153  71510 303766017      765918        syn-C2H3C(O)NH2, v=0
  834585.7270  0.0030 -3.7415 3  472.7366119  71510 303591644      581345        syn-C2H3C(O)NH2, v=0
  834616.8337  0.1074 -4.6261 3 1303.6930195  71510 303972573      962472        syn-C2H3C(O)NH2, v=0
  834648.2911  0.0042 -5.4719 3  393.1028115  71510 30357 849      57 552        syn-C2H3C(O)NH2, v=0
  834648.5282  0.0042 -5.4719 3  393.1028115  71510 30357 949      57 652        syn-C2H3C(O)NH2, v=0
  834696.6082  0.1196 -5.1237 3 1741.7710229  71510 303B42391      B32490        syn-C2H3C(O)NH2, v=0
  834701.6144  0.2014 -5.1185 3 1510.9883151  71510 303756015      755916        syn-C2H3C(O)NH2, v=0
  834701.6144  0.2014 -5.1185 3 1510.9883151  71510 303756016      755917        syn-C2H3C(O)NH2, v=0
  834701.7802  0.0066 -5.1032 3  223.1291 95  71510 30347 245      46 146        syn-C2H3C(O)NH2, v=0
  834701.7802  0.0066 -5.1032 3  223.1291 95  71510 30347 345      46 046        syn-C2H3C(O)NH2, v=0
  834718.9772  0.1196 -5.1237 3 1741.7705229  71510 303B42491      B32390        syn-C2H3C(O)NH2, v=0
  834883.7246  0.2018 -5.1063 3 1492.8080149  71510 303746014      745915        syn-C2H3C(O)NH2, v=0
  834883.7246  0.2018 -5.1063 3 1492.8080149  71510 303746015      745916        syn-C2H3C(O)NH2, v=0
  834892.0302  0.0213 -5.2028 3  899.0381159  71510 303792554      792257        syn-C2H3C(O)NH2, v=0
  834945.3279  0.0087 -5.0750 3  773.4852147  71510 303732450      732153        syn-C2H3C(O)NH2, v=0
  835016.8768  0.0131 -2.6889 3  530.3589 81  71510 3034039 1      3938 2        syn-C2H3C(O)NH2, v=0
  835016.8768  0.0131 -2.6889 3  530.3589 81  71510 3034039 2      3938 1        syn-C2H3C(O)NH2, v=0
  835060.7868  0.2023 -5.0965 3 1474.8716147  71510 303736013      735914        syn-C2H3C(O)NH2, v=0
  835060.7868  0.2023 -5.0965 3 1474.8716147  71510 303736014      735915        syn-C2H3C(O)NH2, v=0
  835232.9076  0.2028 -5.0893 3 1457.1792145  71510 303726012      725913        syn-C2H3C(O)NH2, v=0
  835232.9076  0.2028 -5.0893 3 1457.1792145  71510 303726013      725914        syn-C2H3C(O)NH2, v=0
  835294.4252  0.0290 -5.1985 3  846.1736159  71510 303791861      791564        syn-C2H3C(O)NH2, v=0
  835303.4773  0.0028 -3.7696 3  369.1493109  71510 303541044      53 945        syn-C2H3C(O)NH2, v=0
  835400.1922  0.2033 -5.0852 3 1439.7307143  71510 303716011      715912        syn-C2H3C(O)NH2, v=0
  835400.1922  0.2033 -5.0852 3 1439.7307143  71510 303716012      715913        syn-C2H3C(O)NH2, v=0
  835440.8781  0.0035 -3.1698 3  673.5984133  71510 303662641      652540        syn-C2H3C(O)NH2, v=0
  835440.8831  0.0035 -3.1698 3  673.5984133  71510 303662640      652541        syn-C2H3C(O)NH2, v=0
  835461.5608  0.0105 -2.7061 3  532.3824 85  71510 3034238 4      4137 5        syn-C2H3C(O)NH2, v=0
  835461.5608  0.0105 -2.7061 3  532.3824 85  71510 3034238 5      4137 4        syn-C2H3C(O)NH2, v=0
  835505.8138  0.0028 -3.7694 3  369.1492109  71510 303541144      53 845        syn-C2H3C(O)NH2, v=0
  835562.7442  0.2038 -5.0845 3 1422.5259141  71510 303706010      705911        syn-C2H3C(O)NH2, v=0
  835562.7442  0.2038 -5.0845 3 1422.5259141  71510 303706011      705912        syn-C2H3C(O)NH2, v=0
  835615.9821  0.0595 -5.5632 3 1239.5136189  71510 303942669      942372        syn-C2H3C(O)NH2, v=0
  835656.7014  0.0084 -5.3862 3  510.5967123  71510 303611744      611249        syn-C2H3C(O)NH2, v=0
  835673.2227  0.0043 -4.0435 3  386.6612107  71510 303531638      521339        syn-C2H3C(O)NH2, v=0
  835720.6657  0.2044 -5.0879 3 1405.5649139  71510 3036960 9      695910        syn-C2H3C(O)NH2, v=0
  835720.6657  0.2044 -5.0879 3 1405.5649139  71510 303696010      695911        syn-C2H3C(O)NH2, v=0
  835748.9810  0.1998 -5.1005 3 1897.3054259  71510 303C9 9C0      C810B9        syn-C2H3C(O)NH2, v=0
  835748.9810  0.1998 -5.1005 3 1897.3054259  71510 303C910C0      C8 9B9        syn-C2H3C(O)NH2, v=0
  835753.1816  0.2066 -5.0954 3 1902.0376261  71510 303D0 8C2      C9 9C1        syn-C2H3C(O)NH2, v=0
  835753.1816  0.2066 -5.0954 3 1902.0376261  71510 303D0 9C2      C9 8C1        syn-C2H3C(O)NH2, v=0
  835754.8821  0.1933 -5.1050 3 1892.0334257  71510 303C810B8      C711B7        syn-C2H3C(O)NH2, v=0
  835754.8821  0.1933 -5.1050 3 1892.0334257  71510 303C811B8      C710B7        syn-C2H3C(O)NH2, v=0
  835764.6750  0.2141 -5.0898 3 1906.2354263  71510 303D1 7C4      D0 8C3        syn-C2H3C(O)NH2, v=0
  835764.6750  0.2141 -5.0898 3 1906.2354263  71510 303D1 8C4      D0 7C3        syn-C2H3C(O)NH2, v=0
  835774.2332  0.1873 -5.1091 3 1886.2156255  71510 303C711B6      C612B5        syn-C2H3C(O)NH2, v=0
  835774.2332  0.1873 -5.1091 3 1886.2156255  71510 303C712B6      C611B5        syn-C2H3C(O)NH2, v=0
  835781.0858  0.2223 -5.0836 3 1909.9031265  71510 303D2 6C6      D1 7C5        syn-C2H3C(O)NH2, v=0
  835781.0858  0.2223 -5.0836 3 1909.9031265  71510 303D2 7C6      D1 6C5        syn-C2H3C(O)NH2, v=0
  835800.3900  0.2315 -5.0768 3 1913.0450267  71510 303D3 5C8      D2 6C7        syn-C2H3C(O)NH2, v=0
  835800.3900  0.2315 -5.0768 3 1913.0450267  71510 303D3 6C8      D2 5C7        syn-C2H3C(O)NH2, v=0
  835811.0607  0.1814 -5.1128 3 1879.8451253  71510 303C612B4      C513B3        syn-C2H3C(O)NH2, v=0
  835811.0607  0.1814 -5.1128 3 1879.8451253  71510 303C613B4      C512B3        syn-C2H3C(O)NH2, v=0
  835818.4473  0.0038 -5.0053 3  608.1061129  71510 303642341      642044        syn-C2H3C(O)NH2, v=0
  835820.8504  0.2420 -5.0693 3 1915.6646269  71510 303D4 4D0      D3 5C9        syn-C2H3C(O)NH2, v=0
  835820.8504  0.2420 -5.0693 3 1915.6646269  71510 303D4 5D0      D3 4C9        syn-C2H3C(O)NH2, v=0
  835827.7211  0.0028 -3.9677 3  308.9397103  71510 30351 744      50 645        syn-C2H3C(O)NH2, v=0
  835828.3563  0.0028 -3.9677 3  308.9397103  71510 30351 844      50 545        syn-C2H3C(O)NH2, v=0
  835840.9656  0.2540 -5.0612 3 1917.7650271  71510 303D5 3D2      D4 4D1        syn-C2H3C(O)NH2, v=0
  835840.9656  0.2540 -5.0612 3 1917.7650271  71510 303D5 4D2      D4 3D1        syn-C2H3C(O)NH2, v=0
  835859.4293  0.2679 -5.0524 3 1919.3489273  71510 303D6 2D4      D5 3D3        syn-C2H3C(O)NH2, v=0
  835859.4293  0.2679 -5.0524 3 1919.3489273  71510 303D6 3D4      D5 2D3        syn-C2H3C(O)NH2, v=0
  835870.2531  0.1758 -5.1162 3 1872.9141251  71510 303C513B2      C414B1        syn-C2H3C(O)NH2, v=0
  835870.2531  0.1758 -5.1162 3 1872.9141251  71510 303C514B2      C413B1        syn-C2H3C(O)NH2, v=0
  835874.0569  0.2050 -5.0961 3 1388.8476137  71510 3036860 8      6859 9        syn-C2H3C(O)NH2, v=0
  835874.0569  0.2050 -5.0961 3 1388.8476137  71510 3036860 9      685910        syn-C2H3C(O)NH2, v=0
  835875.0973  0.2841 -5.0429 3 1920.4188275  71510 303D7 1D6      D6 2D5        syn-C2H3C(O)NH2, v=0
  835875.0973  0.2841 -5.0429 3 1920.4188275  71510 303D7 2D6      D6 1D5        syn-C2H3C(O)NH2, v=0
  835886.9610  0.3028 -5.0327 3 1920.9767277  71510 303D8 0D8      D7 1D7        syn-C2H3C(O)NH2, v=0
  835886.9610  0.3028 -5.0327 3 1920.9767277  71510 303D8 1D8      D7 0D7        syn-C2H3C(O)NH2, v=0
  835896.2631  0.0083 -2.7258 3  535.8706 89  71510 3034437 7      4336 8        syn-C2H3C(O)NH2, v=0
  835896.2631  0.0083 -2.7258 3  535.8706 89  71510 3034437 8      4336 7        syn-C2H3C(O)NH2, v=0
  835957.8077  0.1702 -5.1192 3 1865.4135249  71510 303C414B0      C315A9        syn-C2H3C(O)NH2, v=0
  835957.8077  0.1702 -5.1192 3 1865.4135249  71510 303C415B0      C314A9        syn-C2H3C(O)NH2, v=0
  836023.0167  0.2056 -5.1102 3 1372.3740135  71510 3036760 7      6759 8        syn-C2H3C(O)NH2, v=0
  836023.0167  0.2056 -5.1102 3 1372.3740135  71510 3036760 8      6759 9        syn-C2H3C(O)NH2, v=0
  836081.1709  0.1648 -5.1222 3 1857.3325247  71510 303C315A8      C216A7        syn-C2H3C(O)NH2, v=0
  836081.1709  0.1648 -5.1222 3 1857.3325247  71510 303C316A8      C215A7        syn-C2H3C(O)NH2, v=0
  836090.5736  0.1033 -5.1325 3 1684.0373223  71510 303B12686      B02585        syn-C2H3C(O)NH2, v=0
  836114.1032  0.0076 -5.3064 3  548.9032127  71510 303631845      631350        syn-C2H3C(O)NH2, v=0
  836128.4074  0.0076 -3.4989 3  782.0981149  71510 303742352      732251        syn-C2H3C(O)NH2, v=0
  836129.1441  0.0025 -4.3956 3  247.3863 85  71510 303421527      411230        syn-C2H3C(O)NH2, v=0
  836167.6426  0.2062 -5.1315 3 1356.1439133  71510 3036660 6      6659 7        syn-C2H3C(O)NH2, v=0
  836167.6426  0.2062 -5.1315 3 1356.1439133  71510 3036660 7      6659 8        syn-C2H3C(O)NH2, v=0
  836169.5966  0.0050 -5.1309 3  585.2524135  71510 303671354      671057        syn-C2H3C(O)NH2, v=0
  836176.2888  0.0038 -5.0050 3  608.0941129  71510 303642342      642045        syn-C2H3C(O)NH2, v=0
  836220.7841  0.0783 -5.5279 3 1206.0605187  71510 303932569      932272        syn-C2H3C(O)NH2, v=0
  836249.7134  0.1595 -5.1250 3 1848.6589245  71510 303C216A6      C117A5        syn-C2H3C(O)NH2, v=0
  836249.7134  0.1595 -5.1250 3 1848.6589245  71510 303C217A6      C116A5        syn-C2H3C(O)NH2, v=0
  836308.0302  0.2069 -5.1622 3 1340.1573131  71510 3036560 5      6559 6        syn-C2H3C(O)NH2, v=0
  836308.0302  0.2069 -5.1622 3 1340.1573131  71510 3036560 6      6559 7        syn-C2H3C(O)NH2, v=0
  836315.7387  0.0065 -2.7483 3  540.8284 93  71510 303463610      453511        syn-C2H3C(O)NH2, v=0
  836315.7387  0.0065 -2.7483 3  540.8284 93  71510 303463611      453510        syn-C2H3C(O)NH2, v=0
  836326.9037  0.0050 -5.1308 3  585.2524135  71510 303671454      671157        syn-C2H3C(O)NH2, v=0
  836361.0540  0.1158 -5.1420 3 1727.3530227  71510 303B32489      B22588        syn-C2H3C(O)NH2, v=0
  836444.2739  0.2076 -5.2056 3 1324.4141129  71510 3036460 4      6459 5        syn-C2H3C(O)NH2, v=0
  836444.2739  0.2076 -5.2056 3 1324.4141129  71510 3036460 5      6459 6        syn-C2H3C(O)NH2, v=0
  836475.4142  0.1543 -5.1280 3 1839.3779243  71510 303C117A4      C018A3        syn-C2H3C(O)NH2, v=0
  836475.4142  0.1543 -5.1280 3 1839.3779243  71510 303C118A4      C017A3        syn-C2H3C(O)NH2, v=0
  836576.4664  0.2082 -5.2671 3 1308.9144127  71510 3036360 3      6359 4        syn-C2H3C(O)NH2, v=0
  836576.4664  0.2082 -5.2671 3 1308.9144127  71510 3036360 4      6359 5        syn-C2H3C(O)NH2, v=0
  836597.1194  0.0304 -4.0285 3  983.7030169  71510 303842362      832261        syn-C2H3C(O)NH2, v=0
  836644.0034  0.1153 -5.1417 3 1727.3472227  71510 303B32589      B22488        syn-C2H3C(O)NH2, v=0
  836644.3320  0.0030 -3.1060 3  653.2223129  71510 303642738      632637        syn-C2H3C(O)NH2, v=0
  836644.3321  0.0030 -3.1060 3  653.2223129  71510 303642737      632638        syn-C2H3C(O)NH2, v=0
  836658.0063  0.0056 -3.3575 3  737.1457143  71510 303712448      702347        syn-C2H3C(O)NH2, v=0
  836680.7344  0.0056 -3.3575 3  737.1451143  71510 303712447      702348        syn-C2H3C(O)NH2, v=0
  836704.6990  0.2089 -5.3571 3 1293.6580125  71510 3036260 2      6259 3        syn-C2H3C(O)NH2, v=0
  836704.6990  0.2089 -5.3571 3 1293.6580125  71510 3036260 3      6259 4        syn-C2H3C(O)NH2, v=0
  836712.7591  0.0051 -2.7736 3  547.2620 97  71510 303483513      473414        syn-C2H3C(O)NH2, v=0
  836712.7591  0.0051 -2.7736 3  547.2620 97  71510 303483514      473413        syn-C2H3C(O)NH2, v=0
  836773.8700  0.1492 -5.1312 3 1829.4721241  71510 303C018A2      B919A1        syn-C2H3C(O)NH2, v=0
  836773.8700  0.1492 -5.1312 3 1829.4721241  71510 303C019A2      B918A1        syn-C2H3C(O)NH2, v=0
  836829.0613  0.2096 -5.4987 3 1278.6449123  71510 3036160 1      6159 2        syn-C2H3C(O)NH2, v=0
  836829.0613  0.2096 -5.4987 3 1278.6449123  71510 3036160 2      6159 3        syn-C2H3C(O)NH2, v=0
  836999.9313  0.0026 -3.8205 3  348.8553107  71510 30353 944      52 845        syn-C2H3C(O)NH2, v=0
  837006.6523  0.0779 -5.4657 3 1149.7317183  71510 303912468      912171        syn-C2H3C(O)NH2, v=0
  837034.1479  0.0026 -3.8205 3  348.8552107  71510 303531044      52 745        syn-C2H3C(O)NH2, v=0
  837052.1413  0.0026 -3.8855 3  328.7797105  71510 30352 844      51 745        syn-C2H3C(O)NH2, v=0
  837057.1599  0.0026 -3.8855 3  328.7797105  71510 30352 944      51 645        syn-C2H3C(O)NH2, v=0
  837077.4406  0.0040 -2.8020 3  555.1789101  71510 303503416      493317        syn-C2H3C(O)NH2, v=0
  837077.4406  0.0040 -2.8020 3  555.1789101  71510 303503417      493316        syn-C2H3C(O)NH2, v=0
  837165.8401  0.1442 -5.1350 3 1818.9202239  71510 303B919A0      B82099        syn-C2H3C(O)NH2, v=0
  837165.8402  0.1442 -5.1350 3 1818.9202239  71510 303B920A0      B81999        syn-C2H3C(O)NH2, v=0
  837170.3113  0.0077 -3.4980 3  782.0699149  71510 303742351      732252        syn-C2H3C(O)NH2, v=0
  837351.1365  0.0029 -5.1193 3  410.9260103  71510 303512229      511932        syn-C2H3C(O)NH2, v=0
  837352.0027  0.0029 -5.1193 3  410.9260103  71510 303512230      511933        syn-C2H3C(O)NH2, v=0
  837356.2793  0.0027 -3.0487 3  634.5079125  71510 303622834      612735        syn-C2H3C(O)NH2, v=0
  837356.2793  0.0027 -3.0487 3  634.5079125  71510 303622835      612734        syn-C2H3C(O)NH2, v=0
  837396.3173  0.0033 -2.8336 3  564.5881105  71510 303523319      513220        syn-C2H3C(O)NH2, v=0
  837396.3173  0.0033 -2.8336 3  564.5881105  71510 303523320      513219        syn-C2H3C(O)NH2, v=0
  837451.2463  0.0042 -5.3640 3  429.0240119  71510 30359 950      59 653        syn-C2H3C(O)NH2, v=0
  837452.2637  0.0042 -5.3640 3  429.0240119  71510 303591050      59 753        syn-C2H3C(O)NH2, v=0
  837588.6471  0.0059 -5.3108 3  540.0739125  71510 303621943      621448        syn-C2H3C(O)NH2, v=0
  837651.0391  0.0028 -2.8686 3  575.5005109  71510 303543222      533123        syn-C2H3C(O)NH2, v=0
  837651.0391  0.0028 -2.8686 3  575.5005109  71510 303543223      533122        syn-C2H3C(O)NH2, v=0
  837679.7089  0.1393 -5.1397 3 1807.6962237  71510 303B82098      B72197        syn-C2H3C(O)NH2, v=0
  837679.7114  0.1393 -5.1397 3 1807.6962237  71510 303B82198      B72097        syn-C2H3C(O)NH2, v=0
  837702.2837  0.1143 -5.1719 3 1711.9263225  71510 303B22587      B12686        syn-C2H3C(O)NH2, v=0
  837727.5646  0.0025 -2.9969 3  617.4095121  71510 303602931      592832        syn-C2H3C(O)NH2, v=0
  837727.5646  0.0025 -2.9969 3  617.4095121  71510 303602932      592831        syn-C2H3C(O)NH2, v=0
  837810.4708  0.0035 -4.2341 3  297.8430 95  71510 303471433      461136        syn-C2H3C(O)NH2, v=0
  837816.5042  0.0026 -2.9073 3  587.9296113  71510 303563125      553026        syn-C2H3C(O)NH2, v=0
  837816.5042  0.0026 -2.9073 3  587.9296113  71510 303563126      553025        syn-C2H3C(O)NH2, v=0
  837858.1087  0.0025 -2.9499 3  601.8923117  71510 303583028      572929        syn-C2H3C(O)NH2, v=0
  837858.1087  0.0025 -2.9499 3  601.8923117  71510 303583029      572928        syn-C2H3C(O)NH2, v=0
  838012.1792  0.0062 -5.2883 3  555.9951127  71510 303631944      631449        syn-C2H3C(O)NH2, v=0
  838355.6026  0.1346 -5.1458 3 1795.7676235  71510 303B72196      B62295        syn-C2H3C(O)NH2, v=0
  838355.6519  0.1346 -5.1458 3 1795.7676235  71510 303B72296      B62195        syn-C2H3C(O)NH2, v=0
  838403.0943  0.0123 -5.1317 3  733.0566149  71510 303741658      741361        syn-C2H3C(O)NH2, v=0
  838640.3944  0.0048 -5.1661 3  544.3314131  71510 303651253      65 956        syn-C2H3C(O)NH2, v=0
  838689.9988  0.0048 -5.1661 3  544.3314131  71510 303651353      651056        syn-C2H3C(O)NH2, v=0
  838780.3325  0.0035 -3.6995 3  466.3369119  71510 303591545      581246        syn-C2H3C(O)NH2, v=0
  838906.2422  0.0319 -5.3938 3 1099.9483177  71510 303882663      882366        syn-C2H3C(O)NH2, v=0
  839124.1225  0.0044 -5.2799 3  466.2083123  71510 303611051      61 754        syn-C2H3C(O)NH2, v=0
  839128.1310  0.0044 -5.2799 3  466.2083123  71510 303611151      61 854        syn-C2H3C(O)NH2, v=0
  839172.9948  0.0046 -5.1247 3  184.2909 77  71510 303381128      37 631        syn-C2H3C(O)NH2, v=0
  839185.7628  0.2101 -5.4136 3 1762.8103227  71510 303B32786      B22885        syn-C2H3C(O)NH2, v=0
  839209.0445  0.0082 -5.0742 3  755.0673145  71510 303722448      722151        syn-C2H3C(O)NH2, v=0
  839252.4822  0.1300 -5.1539 3 1783.0922233  71510 303B62294      B52393        syn-C2H3C(O)NH2, v=0
  839253.3551  0.1300 -5.1539 3 1783.0921233  71510 303B62394      B52293        syn-C2H3C(O)NH2, v=0
  839261.3370  0.0020 -5.0067 3  161.4941 65  71510 303321617      311318        syn-C2H3C(O)NH2, v=0
  839262.7938  0.0020 -5.0067 3  161.4941 65  71510 303321616      311319        syn-C2H3C(O)NH2, v=0
  839534.5783  0.0025 -4.3575 3  258.0118 87  71510 303431528      421231        syn-C2H3C(O)NH2, v=0
  839564.6242  0.0046 -5.2150 3  504.6470127  71510 303631152      63 855        syn-C2H3C(O)NH2, v=0
  839579.2409  0.0046 -5.2150 3  504.6470127  71510 303631252      63 955        syn-C2H3C(O)NH2, v=0
  839967.0965  0.0056 -4.6644 3  242.0054 97  71510 30348 345      47 246        syn-C2H3C(O)NH2, v=0
  839967.0966  0.0056 -4.6644 3  242.0054 97  71510 30348 445      47 146        syn-C2H3C(O)NH2, v=0
  840030.7022  0.0028 -5.1460 3  398.2488101  71510 303502228      501931        syn-C2H3C(O)NH2, v=0
  840031.1150  0.0028 -5.1460 3  398.2488101  71510 303502229      501932        syn-C2H3C(O)NH2, v=0
  840056.3406  0.0046 -3.2723 3  712.6392139  71510 303692545      682444        syn-C2H3C(O)NH2, v=0
  840056.9295  0.0046 -3.2723 3  712.6392139  71510 303692544      682445        syn-C2H3C(O)NH2, v=0
  840457.9517  0.1256 -5.1652 3 1769.6138231  71510 303B52392      B42491        syn-C2H3C(O)NH2, v=0
  840471.3106  0.1256 -5.1652 3 1769.6135231  71510 303B52492      B42391        syn-C2H3C(O)NH2, v=0
  840499.0560  0.1338 -5.2601 3 1723.4677225  71510 303B22686      B12785        syn-C2H3C(O)NH2, v=0
  840562.2223  0.0179 -5.2023 3  918.9582161  71510 303802556      802259        syn-C2H3C(O)NH2, v=0
  840566.9922  0.0118 -5.1298 3  733.0567149  71510 303741758      741461        syn-C2H3C(O)NH2, v=0
  840659.3773  0.1095 -5.1687 3 1711.8662225  71510 303B22687      B12586        syn-C2H3C(O)NH2, v=0
  840969.5678  0.0056 -5.3336 3  170.2086 75  71510 303371028      36 531        syn-C2H3C(O)NH2, v=0
  841132.5482  0.0058 -5.3520 3  524.3061123  71510 303611942      611447        syn-C2H3C(O)NH2, v=0
  841144.8417  0.0083 -3.5396 3  800.8299151  71510 303752353      742252        syn-C2H3C(O)NH2, v=0
  841334.6904  0.0036 -5.0116 3  591.9926127  71510 303632340      632043        syn-C2H3C(O)NH2, v=0
  841366.6766  0.0120 -3.6861 3  830.7437155  71510 303772255      762156        syn-C2H3C(O)NH2, v=0
  841537.8857  0.0036 -5.0114 3  591.9859127  71510 303632341      632044        syn-C2H3C(O)NH2, v=0
  841727.8513  0.2088 -5.1484 3 1925.1830261  71510 303D0 9C1      C910C0        syn-C2H3C(O)NH2, v=0
  841727.8513  0.2088 -5.1484 3 1925.1830261  71510 303D010C1      C9 9C0        syn-C2H3C(O)NH2, v=0
  841732.3893  0.2022 -5.1528 3 1919.9111259  71510 303C910B9      C811B8        syn-C2H3C(O)NH2, v=0
  841732.3893  0.2022 -5.1528 3 1919.9111259  71510 303C911B9      C810B8        syn-C2H3C(O)NH2, v=0
  841733.0939  0.2160 -5.1435 3 1929.9154263  71510 303D1 8C3      D0 9C2        syn-C2H3C(O)NH2, v=0
  841733.0939  0.2160 -5.1435 3 1929.9154263  71510 303D1 9C3      D0 8C2        syn-C2H3C(O)NH2, v=0
  841745.3755  0.2237 -5.1380 3 1934.1135265  71510 303D2 7C5      D1 8C4        syn-C2H3C(O)NH2, v=0
  841745.3755  0.2237 -5.1380 3 1934.1135265  71510 303D2 8C5      D1 7C4        syn-C2H3C(O)NH2, v=0
  841749.9692  0.1958 -5.1567 3 1914.0940257  71510 303C811B7      C712B6        syn-C2H3C(O)NH2, v=0
  841749.9692  0.1958 -5.1567 3 1914.0940257  71510 303C812B7      C711B6        syn-C2H3C(O)NH2, v=0
  841762.3618  0.0034 -3.7013 3  445.0205117  71510 303581445      571146        syn-C2H3C(O)NH2, v=0
  841762.3731  0.2323 -5.1319 3 1937.7818267  71510 303D3 6C7      D2 7C6        syn-C2H3C(O)NH2, v=0
  841762.3731  0.2323 -5.1319 3 1937.7818267  71510 303D3 7C7      D2 6C6        syn-C2H3C(O)NH2, v=0
  841782.1035  0.2419 -5.1252 3 1940.9243269  71510 303D4 5C9      D3 6C8        syn-C2H3C(O)NH2, v=0
  841782.1035  0.2419 -5.1252 3 1940.9243269  71510 303D4 6C9      D3 5C8        syn-C2H3C(O)NH2, v=0
  841784.5043  0.1898 -5.1602 3 1907.7248255  71510 303C712B5      C613B4        syn-C2H3C(O)NH2, v=0
  841784.5043  0.1898 -5.1602 3 1907.7248255  71510 303C713B5      C612B4        syn-C2H3C(O)NH2, v=0
  841802.8618  0.2528 -5.1179 3 1943.5446271  71510 303D5 4D1      D4 5D0        syn-C2H3C(O)NH2, v=0
  841802.8618  0.2528 -5.1179 3 1943.5446271  71510 303D5 5D1      D4 4D0        syn-C2H3C(O)NH2, v=0
  841823.1717  0.2652 -5.1099 3 1945.6457273  71510 303D6 3D3      D5 4D2        syn-C2H3C(O)NH2, v=0
  841823.1717  0.2652 -5.1099 3 1945.6457273  71510 303D6 4D3      D5 3D2        syn-C2H3C(O)NH2, v=0
  841840.7339  0.1839 -5.1633 3 1900.7958253  71510 303C613B3      C514B2        syn-C2H3C(O)NH2, v=0
  841840.7339  0.1839 -5.1633 3 1900.7958253  71510 303C614B3      C513B2        syn-C2H3C(O)NH2, v=0
  841841.7467  0.2796 -5.1012 3 1947.2302275  71510 303D7 2D5      D6 3D4        syn-C2H3C(O)NH2, v=0
  841841.7467  0.2796 -5.1012 3 1947.2302275  71510 303D7 3D5      D6 2D4        syn-C2H3C(O)NH2, v=0
  841857.4582  0.2963 -5.0917 3 1948.3006277  71510 303D8 1D7      D7 2D6        syn-C2H3C(O)NH2, v=0
  841857.4582  0.2963 -5.0917 3 1948.3006277  71510 303D8 2D7      D7 1D6        syn-C2H3C(O)NH2, v=0
  841869.3098  0.3156 -5.0816 3 1948.8589279  71510 303D9 0D9      D8 1D8        syn-C2H3C(O)NH2, v=0
  841869.3098  0.3156 -5.0816 3 1948.8589279  71510 303D9 1D9      D8 0D8        syn-C2H3C(O)NH2, v=0
  841924.4578  0.1781 -5.1662 3 1893.2980251  71510 303C514B1      C415B0        syn-C2H3C(O)NH2, v=0
  841924.4578  0.1781 -5.1662 3 1893.2980251  71510 303C515B1      C414B0        syn-C2H3C(O)NH2, v=0
  842018.2319  0.0443 -5.2678 3  915.5238165  71510 303821963      821666        syn-C2H3C(O)NH2, v=0
  842019.7981  0.1276 -4.8795 3 1466.7696207  71510 303A32678      A22577        syn-C2H3C(O)NH2, v=0
  842042.8558  0.1725 -5.1689 3 1885.2212249  71510 303C415A9      C316A8        syn-C2H3C(O)NH2, v=0
  842042.8558  0.1725 -5.1689 3 1885.2212249  71510 303C416A9      C315A8        syn-C2H3C(O)NH2, v=0
  842062.7927  0.1215 -5.1817 3 1755.2546229  71510 303B42490      B32589        syn-C2H3C(O)NH2, v=0
  842190.3546  0.0039 -3.1983 3  689.9718135  71510 303672642      662541        syn-C2H3C(O)NH2, v=0
  842190.3655  0.0039 -3.1983 3  689.9718135  71510 303672641      662542        syn-C2H3C(O)NH2, v=0
  842204.9338  0.1670 -5.1715 3 1876.5532247  71510 303C316A7      C217A6        syn-C2H3C(O)NH2, v=0
  842204.9338  0.1670 -5.1715 3 1876.5532247  71510 303C317A7      C216A6        syn-C2H3C(O)NH2, v=0
  842237.0025  0.1212 -5.1815 3 1755.2510229  71510 303B42590      B32489        syn-C2H3C(O)NH2, v=0
  842260.4058  0.0129 -2.7026 3  540.0781 83  71510 3034139 2      4038 3        syn-C2H3C(O)NH2, v=0
  842260.4058  0.0129 -2.7026 3  540.0781 83  71510 3034139 3      4038 2        syn-C2H3C(O)NH2, v=0
  842320.6001  0.0067 -5.2832 3  572.0779129  71510 303641945      641450        syn-C2H3C(O)NH2, v=0
  842422.1618  0.1616 -5.1741 3 1867.2797245  71510 303C217A5      C118A4        syn-C2H3C(O)NH2, v=0
  842422.1618  0.1616 -5.1741 3 1867.2797245  71510 303C218A5      C117A4        syn-C2H3C(O)NH2, v=0
  842522.5270  0.0078 -5.0712 3  754.9566145  71510 303722449      722152        syn-C2H3C(O)NH2, v=0
  842530.7533  0.0028 -5.1746 3  385.8333 99  71510 303492227      491930        syn-C2H3C(O)NH2, v=0
  842530.9462  0.0028 -5.1746 3  385.8333 99  71510 303492228      491931        syn-C2H3C(O)NH2, v=0
  842702.5304  0.0103 -2.7206 3  542.5943 87  71510 3034338 5      4237 6        syn-C2H3C(O)NH2, v=0
  842702.5304  0.0103 -2.7206 3  542.5943 87  71510 3034338 6      4237 5        syn-C2H3C(O)NH2, v=0
  842709.4087  0.1563 -5.1770 3 1857.3838243  71510 303C118A3      C019A2        syn-C2H3C(O)NH2, v=0
  842709.4087  0.1563 -5.1770 3 1857.3838243  71510 303C119A3      C018A2        syn-C2H3C(O)NH2, v=0
  842806.3065  0.0063 -3.3918 3  754.9471145  71510 303722449      712348        syn-C2H3C(O)NH2, v=0
  842848.0789  0.0063 -3.3918 3  754.9459145  71510 303722448      712349        syn-C2H3C(O)NH2, v=0
  842896.8684  0.0085 -3.5380 3  800.7827151  71510 303752352      742253        syn-C2H3C(O)NH2, v=0
  843086.3644  0.1511 -5.1804 3 1846.8450241  71510 303C019A1      B920A0        syn-C2H3C(O)NH2, v=0
  843086.3644  0.1511 -5.1804 3 1846.8450241  71510 303C020A1      B919A0        syn-C2H3C(O)NH2, v=0
  843133.2157  0.0082 -2.7411 3  546.5764 91  71510 3034537 8      4436 9        syn-C2H3C(O)NH2, v=0
  843133.2157  0.0082 -2.7411 3  546.5764 91  71510 3034537 9      4436 8        syn-C2H3C(O)NH2, v=0
  843212.9941  0.0026 -4.3220 3  268.8962 89  71510 303441529      431232        syn-C2H3C(O)NH2, v=0
  843428.7529  0.0465 -5.2873 3  966.6857169  71510 303842164      841867        syn-C2H3C(O)NH2, v=0
  843530.1302  0.0033 -3.1326 3  669.0454131  71510 303652739      642638        syn-C2H3C(O)NH2, v=0
  843530.1303  0.0033 -3.1326 3  669.0454131  71510 303652738      642639        syn-C2H3C(O)NH2, v=0
  843546.7555  0.0064 -2.7644 3  552.0300 95  71510 303473611      463512        syn-C2H3C(O)NH2, v=0
  843546.7555  0.0064 -2.7644 3  552.0300 95  71510 303473612      463511        syn-C2H3C(O)NH2, v=0
  843561.8705  0.0719 -5.4141 3 1094.5185179  71510 303892367      892070        syn-C2H3C(O)NH2, v=0
  843579.7826  0.1461 -5.1845 3 1835.6382239  71510 303B92099      B82198        syn-C2H3C(O)NH2, v=0
  843579.7840  0.1461 -5.1845 3 1835.6382239  71510 303B92199      B82098        syn-C2H3C(O)NH2, v=0
  843676.8051  0.1190 -5.2079 3 1739.9076227  71510 303B32588      B22687        syn-C2H3C(O)NH2, v=0
  843754.4826  0.0253 -5.1917 3  846.1743159  71510 303791961      791664        syn-C2H3C(O)NH2, v=0
  843935.3298  0.0050 -2.7907 3  558.9615 99  71510 303493514      483415        syn-C2H3C(O)NH2, v=0
  843935.3298  0.0050 -2.7907 3  558.9615 99  71510 303493515      483414        syn-C2H3C(O)NH2, v=0
  844192.2572  0.0140 -3.8099 3  670.8896141  71510 303701852      691753        syn-C2H3C(O)NH2, v=0
  844227.1964  0.1412 -5.1899 3 1823.7321237  71510 303B82197      B72296        syn-C2H3C(O)NH2, v=0
  844227.2244  0.1412 -5.1899 3 1823.7321237  71510 303B82297      B72196        syn-C2H3C(O)NH2, v=0
  844286.3416  0.0082 -3.7782 3  572.2407131  71510 303651649      641550        syn-C2H3C(O)NH2, v=0
  844288.2903  0.0040 -2.8200 3  567.3786103  71510 303513417      503318        syn-C2H3C(O)NH2, v=0
  844288.2903  0.0040 -2.8200 3  567.3786103  71510 303513418      503317        syn-C2H3C(O)NH2, v=0
  844297.2145  0.0034 -3.7209 3  423.7938115  71510 303571245      561146        syn-C2H3C(O)NH2, v=0
  844339.0305  0.0029 -3.0738 3  649.7930127  71510 303632835      622736        syn-C2H3C(O)NH2, v=0
  844339.0305  0.0029 -3.0738 3  649.7930127  71510 303632836      622735        syn-C2H3C(O)NH2, v=0
  844591.1723  0.0033 -2.8526 3  577.2908107  71510 303533320      523221        syn-C2H3C(O)NH2, v=0
  844591.1723  0.0033 -2.8526 3  577.2908107  71510 303533321      523220        syn-C2H3C(O)NH2, v=0
  844638.1471  0.0046 -4.4027 3  261.1760 99  71510 30349 445      48 346        syn-C2H3C(O)NH2, v=0
  844638.1474  0.0046 -4.4027 3  261.1760 99  71510 30349 545      48 246        syn-C2H3C(O)NH2, v=0
  844780.9058  0.0027 -3.0205 3  632.1658123  71510 303612932      602833        syn-C2H3C(O)NH2, v=0
  844780.9058  0.0027 -3.0205 3  632.1658123  71510 303612933      602832        syn-C2H3C(O)NH2, v=0
  844824.3022  0.0029 -2.8887 3  588.7096111  71510 303553223      543124        syn-C2H3C(O)NH2, v=0
  844824.3022  0.0029 -2.8887 3  588.7096111  71510 303553224      543123        syn-C2H3C(O)NH2, v=0
  844862.7293  0.0028 -5.2054 3  373.6784 97  71510 303482226      481929        syn-C2H3C(O)NH2, v=0
  844862.8176  0.0028 -5.2054 3  373.6784 97  71510 303482227      481930        syn-C2H3C(O)NH2, v=0
  844864.0589  0.0045 -4.1101 3  372.9666105  71510 303521637      511338        syn-C2H3C(O)NH2, v=0
  844960.7946  0.0027 -2.9284 3  601.6493115  71510 303573126      563027        syn-C2H3C(O)NH2, v=0
  844960.7946  0.0027 -2.9284 3  601.6493115  71510 303573127      563026        syn-C2H3C(O)NH2, v=0
  844963.5872  0.0026 -2.9723 3  616.1273119  71510 303593029      582930        syn-C2H3C(O)NH2, v=0
  844963.5872  0.0026 -2.9723 3  616.1273119  71510 303593030      582929        syn-C2H3C(O)NH2, v=0
  845039.0761  0.0020 -4.9433 3  169.4211 67  71510 303331618      321319        syn-C2H3C(O)NH2, v=0
  845042.4153  0.0020 -4.9433 3  169.4210 67  71510 303331617      321320        syn-C2H3C(O)NH2, v=0
  845083.3110  0.1364 -5.1972 3 1811.0866235  71510 303B72295      B62394        syn-C2H3C(O)NH2, v=0
  845083.8168  0.1364 -5.1972 3 1811.0866235  71510 303B72395      B62294        syn-C2H3C(O)NH2, v=0
  845115.7304  0.2199 -5.5800 3 1862.8328183  71510 303916130      916031        syn-C2H3C(O)NH2, v=0
  845115.7304  0.2199 -5.5800 3 1862.8328183  71510 303916131      916032        syn-C2H3C(O)NH2, v=0
  845242.4919  0.0243 -3.9623 3  961.9915167  71510 303832361      822260        syn-C2H3C(O)NH2, v=0
  845387.4616  0.2197 -5.5464 3 1840.7484181  71510 303906129      906030        syn-C2H3C(O)NH2, v=0
  845387.4616  0.2197 -5.5464 3 1840.7484181  71510 303906130      906031        syn-C2H3C(O)NH2, v=0
  845498.1965  0.0309 -5.3746 3 1077.4808175  71510 303872662      872365        syn-C2H3C(O)NH2, v=0
  845544.5656  0.0032 -3.7325 3  487.6286121  71510 303601645      591346        syn-C2H3C(O)NH2, v=0
  845567.7396  0.1157 -5.2059 3 1739.8691227  71510 303B32688      B22587        syn-C2H3C(O)NH2, v=0
  845652.4787  0.2195 -5.5139 3 1818.9088179  71510 303896128      896029        syn-C2H3C(O)NH2, v=0
  845652.4787  0.2195 -5.5139 3 1818.9088179  71510 303896129      896030        syn-C2H3C(O)NH2, v=0
  845737.7605  0.0092 -3.5822 3  819.8541153  71510 303762354      752253        syn-C2H3C(O)NH2, v=0
  845910.9096  0.2194 -5.4823 3 1797.3141177  71510 303886127      886028        syn-C2H3C(O)NH2, v=0
  845910.9096  0.2194 -5.4823 3 1797.3141177  71510 303886128      886029        syn-C2H3C(O)NH2, v=0
  846094.2779  0.1346 -5.5350 3 1139.2230183  71510 303912269      911972        syn-C2H3C(O)NH2, v=0
  846162.8804  0.2193 -5.4518 3 1775.9642175  71510 303876126      876027        syn-C2H3C(O)NH2, v=0
  846162.8804  0.2193 -5.4518 3 1775.9642175  71510 303876127      876028        syn-C2H3C(O)NH2, v=0
  846229.8059  0.1319 -5.2074 3 1797.6486233  71510 303B62393      B52492        syn-C2H3C(O)NH2, v=0
  846237.7460  0.1319 -5.2074 3 1797.6484233  71510 303B62493      B52392        syn-C2H3C(O)NH2, v=0
  846275.9631  0.0658 -5.3474 3  987.4865171  71510 303852065      851768        syn-C2H3C(O)NH2, v=0
  846408.5155  0.2193 -5.4223 3 1754.8589173  71510 303866125      866026        syn-C2H3C(O)NH2, v=0
  846408.5155  0.2193 -5.4223 3 1754.8589173  71510 303866126      866027        syn-C2H3C(O)NH2, v=0
  846443.0451  0.0034 -5.0194 3  576.1560125  71510 303622339      622042        syn-C2H3C(O)NH2, v=0
  846552.8872  0.0052 -3.3037 3  729.8443141  71510 303702546      692445        syn-C2H3C(O)NH2, v=0
  846554.0471  0.0052 -3.3037 3  729.8442141  71510 303702545      692446        syn-C2H3C(O)NH2, v=0
  846556.5644  0.0034 -5.0193 3  576.1522125  71510 303622340      622043        syn-C2H3C(O)NH2, v=0
  846647.9375  0.2194 -5.3940 3 1733.9983171  71510 303856124      856025        syn-C2H3C(O)NH2, v=0
  846647.9375  0.2194 -5.3940 3 1733.9983171  71510 303856125      856026        syn-C2H3C(O)NH2, v=0
  846743.2371  0.0085 -5.1331 3  687.8680145  71510 303721557      721260        syn-C2H3C(O)NH2, v=0
  846852.5860  0.0638 -4.3095 3 1126.1566181  71510 303902467      892366        syn-C2H3C(O)NH2, v=0
  846881.2671  0.2195 -5.3668 3 1713.3822169  71510 303846123      846024        syn-C2H3C(O)NH2, v=0
  846881.2671  0.2195 -5.3668 3 1713.3822169  71510 303846124      846025        syn-C2H3C(O)NH2, v=0
  846928.9557  0.0402 -5.3418 3 1012.3780169  71510 303842658      842361        syn-C2H3C(O)NH2, v=0
  847037.1171  0.0028 -5.2385 3  361.7833 95  71510 303472225      471928        syn-C2H3C(O)NH2, v=0
  847037.1567  0.0028 -5.2385 3  361.7833 95  71510 303472226      471929        syn-C2H3C(O)NH2, v=0
  847108.6233  0.2196 -5.3409 3 1693.0106167  71510 303836122      836023        syn-C2H3C(O)NH2, v=0
  847108.6233  0.2196 -5.3409 3 1693.0106167  71510 303836123      836024        syn-C2H3C(O)NH2, v=0
  847188.5671  0.0032 -3.7188 3  423.7915115  71510 303571345      561046        syn-C2H3C(O)NH2, v=0
  847330.1235  0.2198 -5.3162 3 1672.8834165  71510 303826121      826022        syn-C2H3C(O)NH2, v=0
  847330.1235  0.2198 -5.3162 3 1672.8834165  71510 303826122      826023        syn-C2H3C(O)NH2, v=0
  847398.2570  0.0027 -4.2897 3  280.0339 91  71510 303451530      441233        syn-C2H3C(O)NH2, v=0
  847545.8834  0.2200 -5.2929 3 1653.0006163  71510 303816120      816021        syn-C2H3C(O)NH2, v=0
  847545.8834  0.2200 -5.2929 3 1653.0006163  71510 303816121      816022        syn-C2H3C(O)NH2, v=0
  847551.3742  0.0083 -5.1324 3  687.8681145  71510 303721657      721360        syn-C2H3C(O)NH2, v=0
  847705.6347  0.2182 -5.1968 3 1953.2600263  71510 303D1 9C2      D010C1        syn-C2H3C(O)NH2, v=0
  847705.6347  0.2182 -5.1968 3 1953.2600263  71510 303D110C2      D0 9C1        syn-C2H3C(O)NH2, v=0
  847708.8394  0.2113 -5.2010 3 1947.9883261  71510 303D010C0      C911B9        syn-C2H3C(O)NH2, v=0
  847708.8394  0.2113 -5.2010 3 1947.9883261  71510 303D011C0      C910B9        syn-C2H3C(O)NH2, v=0
  847711.8986  0.2256 -5.1920 3 1957.9926265  71510 303D2 8C4      D1 9C3        syn-C2H3C(O)NH2, v=0
  847711.8986  0.2256 -5.1920 3 1957.9926265  71510 303D2 9C4      D1 8C3        syn-C2H3C(O)NH2, v=0
  847724.6906  0.2047 -5.2048 3 1942.1717259  71510 303C911B8      C812B7        syn-C2H3C(O)NH2, v=0
  847724.6906  0.2047 -5.2048 3 1942.1717259  71510 303C912B8      C811B7        syn-C2H3C(O)NH2, v=0
  847724.9543  0.2337 -5.1867 3 1962.1911267  71510 303D3 7C6      D2 8C5        syn-C2H3C(O)NH2, v=0
  847724.9543  0.2337 -5.1867 3 1962.1911267  71510 303D3 8C6      D2 7C5        syn-C2H3C(O)NH2, v=0
  847726.6381  0.0953 -5.4368 3 1062.0551177  71510 303882167      881870        syn-C2H3C(O)NH2, v=0
  847726.7428  0.0071 -5.0703 3  736.7766143  71510 303712447      712150        syn-C2H3C(O)NH2, v=0
  847742.5293  0.2426 -5.1807 3 1965.8600269  71510 303D4 6C8      D3 7C7        syn-C2H3C(O)NH2, v=0
  847742.5293  0.2426 -5.1807 3 1965.8600269  71510 303D4 7C8      D3 6C7        syn-C2H3C(O)NH2, v=0
  847756.0170  0.2203 -5.2711 3 1633.3620161  71510 303806119      806020        syn-C2H3C(O)NH2, v=0
  847756.0170  0.2203 -5.2711 3 1633.3620161  71510 303806120      806021        syn-C2H3C(O)NH2, v=0
  847756.9929  0.1984 -5.2081 3 1935.8037257  71510 303C812B6      C713B5        syn-C2H3C(O)NH2, v=0
  847756.9929  0.1984 -5.2081 3 1935.8037257  71510 303C813B6      C712B5        syn-C2H3C(O)NH2, v=0
  847762.6801  0.2526 -5.1741 3 1969.0032271  71510 303D5 5D0      D4 6C9        syn-C2H3C(O)NH2, v=0
  847762.6801  0.2526 -5.1741 3 1969.0032271  71510 303D5 6D0      D4 5C9        syn-C2H3C(O)NH2, v=0
  847766.7752  0.1276 -5.2223 3 1783.3450231  71510 303B52491      B42590        syn-C2H3C(O)NH2, v=0
  847783.7326  0.2639 -5.1669 3 1971.6241273  71510 303D6 4D2      D5 5D1        syn-C2H3C(O)NH2, v=0
  847783.7326  0.2639 -5.1669 3 1971.6241273  71510 303D6 5D2      D5 4D1        syn-C2H3C(O)NH2, v=0
  847804.2352  0.2768 -5.1590 3 1973.7259275  71510 303D7 3D4      D6 4D3        syn-C2H3C(O)NH2, v=0
  847804.2352  0.2768 -5.1590 3 1973.7259275  71510 303D7 4D4      D6 3D3        syn-C2H3C(O)NH2, v=0
  847810.3437  0.1923 -5.2111 3 1928.8765255  71510 303C713B4      C614B3        syn-C2H3C(O)NH2, v=0
  847810.3437  0.1923 -5.2111 3 1928.8765255  71510 303C714B4      C613B3        syn-C2H3C(O)NH2, v=0
  847822.9205  0.2917 -5.1504 3 1975.3110277  71510 303D8 2D6      D7 3D5        syn-C2H3C(O)NH2, v=0
  847822.9205  0.2917 -5.1504 3 1975.3110277  71510 303D8 3D6      D7 2D5        syn-C2H3C(O)NH2, v=0
  847838.6751  0.3089 -5.1411 3 1976.3819279  71510 303D9 1D8      D8 2D7        syn-C2H3C(O)NH2, v=0
  847838.6751  0.3089 -5.1411 3 1976.3819279  71510 303D9 2D8      D8 1D7        syn-C2H3C(O)NH2, v=0
  847850.5142  0.3288 -5.1310 3 1976.9406281  71510 303E0 0E0      D9 1D9        syn-C2H3C(O)NH2, v=0
  847850.5142  0.3288 -5.1310 3 1976.9406281  71510 303E0 1E0      D9 0D9        syn-C2H3C(O)NH2, v=0
  847873.4035  0.1274 -5.2222 3 1783.3428231  71510 303B52591      B42490        syn-C2H3C(O)NH2, v=0
  847890.3541  0.1864 -5.2137 3 1921.3816253  71510 303C614B2      C515B1        syn-C2H3C(O)NH2, v=0
  847890.3541  0.1864 -5.2137 3 1921.3816253  71510 303C615B2      C514B1        syn-C2H3C(O)NH2, v=0
  847960.6367  0.2206 -5.2508 3 1613.9676159  71510 303796118      796019        syn-C2H3C(O)NH2, v=0
  847960.6367  0.2206 -5.2508 3 1613.9676159  71510 303796119      796020        syn-C2H3C(O)NH2, v=0
  848003.9512  0.1805 -5.2161 3 1913.3087251  71510 303C515B0      C416A9        syn-C2H3C(O)NH2, v=0
  848003.9512  0.1805 -5.2161 3 1913.3087251  71510 303C516B0      C415A9        syn-C2H3C(O)NH2, v=0
  848159.7962  0.1748 -5.2184 3 1904.6461249  71510 303C416A8      C317A7        syn-C2H3C(O)NH2, v=0
  848159.7962  0.1748 -5.2184 3 1904.6461249  71510 303C417A8      C316A7        syn-C2H3C(O)NH2, v=0
  848159.8530  0.2210 -5.2322 3 1594.8174157  71510 303786117      786018        syn-C2H3C(O)NH2, v=0
  848159.8530  0.2210 -5.2322 3 1594.8174157  71510 303786118      786019        syn-C2H3C(O)NH2, v=0
  848167.8275  0.0177 -5.1895 3  878.7579157  71510 303782553      782256        syn-C2H3C(O)NH2, v=0
  848312.8668  0.1321 -5.2892 3 1751.7220227  71510 303B32687      B22786        syn-C2H3C(O)NH2, v=0
  848353.7753  0.2214 -5.2153 3 1575.9113155  71510 303776116      776017        syn-C2H3C(O)NH2, v=0
  848353.7753  0.2214 -5.2153 3 1575.9113155  71510 303776117      776018        syn-C2H3C(O)NH2, v=0
  848368.8800  0.1692 -5.2208 3 1895.3799247  71510 303C317A6      C218A5        syn-C2H3C(O)NH2, v=0
  848368.8800  0.1692 -5.2208 3 1895.3799247  71510 303C318A6      C217A5        syn-C2H3C(O)NH2, v=0
  848542.5110  0.2218 -5.2005 3 1557.2492153  71510 303766115      766016        syn-C2H3C(O)NH2, v=0
  848542.5110  0.2218 -5.2005 3 1557.2492153  71510 303766116      766017        syn-C2H3C(O)NH2, v=0
  848638.8691  0.0095 -3.5796 3  819.7767153  71510 303762353      752254        syn-C2H3C(O)NH2, v=0
  848645.3914  0.1637 -5.2233 3 1885.4936245  71510 303C218A4      C119A3        syn-C2H3C(O)NH2, v=0
  848645.3914  0.1637 -5.2233 3 1885.4936245  71510 303C219A4      C118A3        syn-C2H3C(O)NH2, v=0
  848645.8353  0.0039 -4.2211 3  280.6320101  71510 30350 545      49 446        syn-C2H3C(O)NH2, v=0
  848645.8385  0.0039 -4.2211 3  280.6320101  71510 30350 645      49 346        syn-C2H3C(O)NH2, v=0
  848714.3187  0.0059 -5.4126 3  508.6850121  71510 303601941      601446        syn-C2H3C(O)NH2, v=0
  848726.1661  0.2222 -5.1878 3 1538.8310151  71510 303756114      756015        syn-C2H3C(O)NH2, v=0
  848726.1661  0.2222 -5.1878 3 1538.8310151  71510 303756115      756016        syn-C2H3C(O)NH2, v=0
  848855.7888  0.0070 -3.4272 3  773.0212147  71510 303732450      722349        syn-C2H3C(O)NH2, v=0
  848902.2661  0.0043 -3.2275 3  706.6060137  71510 303682643      672542        syn-C2H3C(O)NH2, v=0
  848902.2891  0.0043 -3.2275 3  706.6060137  71510 303682642      672543        syn-C2H3C(O)NH2, v=0
  848904.8451  0.2227 -5.1775 3 1520.6567149  71510 303746113      746014        syn-C2H3C(O)NH2, v=0
  848904.8451  0.2227 -5.1775 3 1520.6567149  71510 303746114      746015        syn-C2H3C(O)NH2, v=0
  848931.5110  0.0070 -3.4272 3  773.0191147  71510 303732449      722350        syn-C2H3C(O)NH2, v=0
  849008.0259  0.1584 -5.2263 3 1874.9674243  71510 303C119A2      C020A1        syn-C2H3C(O)NH2, v=0
  849008.0260  0.1584 -5.2263 3 1874.9674243  71510 303C120A2      C019A1        syn-C2H3C(O)NH2, v=0
  849015.9000  0.0163 -5.1916 3  898.5652159  71510 303792555      792258        syn-C2H3C(O)NH2, v=0
  849054.6270  0.0158 -2.7006 3  548.4956 81  71510 3034040 0      3939 1        syn-C2H3C(O)NH2, v=0
  849054.6270  0.0158 -2.7006 3  548.4956 81  71510 3034040 1      3939 0        syn-C2H3C(O)NH2, v=0
  849063.5787  0.0028 -5.2740 3  350.1471 93  71510 303462224      461927        syn-C2H3C(O)NH2, v=0
  849063.5961  0.0028 -5.2740 3  350.1471 93  71510 303462225      461928        syn-C2H3C(O)NH2, v=0
  849078.6507  0.2232 -5.1699 3 1502.7263147  71510 303736112      736013        syn-C2H3C(O)NH2, v=0
  849078.6507  0.2232 -5.1699 3 1502.7263147  71510 303736113      736014        syn-C2H3C(O)NH2, v=0
  849219.2395  0.0094 -5.5389 3  473.4464119  71510 303591643      591148        syn-C2H3C(O)NH2, v=0
  849247.6843  0.2238 -5.1653 3 1485.0396145  71510 303726111      726012        syn-C2H3C(O)NH2, v=0
  849247.6843  0.2238 -5.1653 3 1485.0396145  71510 303726112      726013        syn-C2H3C(O)NH2, v=0
  849412.0459  0.2244 -5.1641 3 1467.5966143  71510 303716110      716011        syn-C2H3C(O)NH2, v=0
  849412.0459  0.2244 -5.1641 3 1467.5966143  71510 303716111      716012        syn-C2H3C(O)NH2, v=0
  849482.0354  0.1531 -5.2299 3 1863.7770241  71510 303C020A0      B92199        syn-C2H3C(O)NH2, v=0
  849482.0362  0.1531 -5.2299 3 1863.7770241  71510 303C021A0      B92099        syn-C2H3C(O)NH2, v=0
  849502.2779  0.0128 -2.7168 3  550.0419 85  71510 3034239 3      4138 4        syn-C2H3C(O)NH2, v=0
  849502.2779  0.0128 -2.7168 3  550.0419 85  71510 3034239 4      4138 3        syn-C2H3C(O)NH2, v=0
  849513.0998  0.1243 -5.2455 3 1768.0742229  71510 303B42589      B32688        syn-C2H3C(O)NH2, v=0
  849525.2169  0.1064 -4.5839 3 1278.4331193  71510 303962572      952471        syn-C2H3C(O)NH2, v=0
  849571.8336  0.2250 -5.1671 3 1450.3973141  71510 3037061 9      706010        syn-C2H3C(O)NH2, v=0
  849571.8336  0.2250 -5.1671 3 1450.3973141  71510 303706110      706011        syn-C2H3C(O)NH2, v=0
  849727.1444  0.2256 -5.1748 3 1433.4416139  71510 3036961 8      6960 9        syn-C2H3C(O)NH2, v=0
  849727.1444  0.2256 -5.1748 3 1433.4416139  71510 3036961 9      696010        syn-C2H3C(O)NH2, v=0
  849752.6213  0.0100 -3.6269 3  839.1776155  71510 303772355      762254        syn-C2H3C(O)NH2, v=0
  849759.2600  0.0069 -5.0685 3  736.7087143  71510 303712448      712151        syn-C2H3C(O)NH2, v=0
  849759.8357  0.0207 -3.8170 3  776.9164151  71510 303752055      741956        syn-C2H3C(O)NH2, v=0
  849878.0737  0.2262 -5.1884 3 1416.7294137  71510 3036861 7      6860 8        syn-C2H3C(O)NH2, v=0
  849878.0737  0.2262 -5.1884 3 1416.7294137  71510 3036861 8      6860 9        syn-C2H3C(O)NH2, v=0
  849941.4227  0.0102 -2.7355 3  553.0511 89  71510 3034438 6      4337 7        syn-C2H3C(O)NH2, v=0
  849941.4227  0.0102 -2.7355 3  553.0511 89  71510 3034438 7      4337 6        syn-C2H3C(O)NH2, v=0
  850024.7153  0.2269 -5.2092 3 1400.2607135  71510 3036761 6      6760 7        syn-C2H3C(O)NH2, v=0
  850024.7153  0.2269 -5.2092 3 1400.2607135  71510 3036761 7      6760 8        syn-C2H3C(O)NH2, v=0
  850086.1510  0.0197 -5.1800 3  797.9803155  71510 303771760      771463        syn-C2H3C(O)NH2, v=0
  850102.5859  0.1480 -5.2347 3 1851.8925239  71510 303B92198      B82297        syn-C2H3C(O)NH2, v=0
  850102.6016  0.1480 -5.2347 3 1851.8925239  71510 303B92298      B82197        syn-C2H3C(O)NH2, v=0
  850167.1616  0.2276 -5.2395 3 1384.0354133  71510 3036661 5      6660 6        syn-C2H3C(O)NH2, v=0
  850167.1616  0.2276 -5.2395 3 1384.0354133  71510 3036661 6      6660 7        syn-C2H3C(O)NH2, v=0
  850305.5038  0.2283 -5.2824 3 1368.0535131  71510 3036561 4      6560 5        syn-C2H3C(O)NH2, v=0
  850305.5038  0.2283 -5.2824 3 1368.0535131  71510 3036561 5      6560 6        syn-C2H3C(O)NH2, v=0
  850367.5635  0.0081 -2.7569 3  557.5278 93  71510 3034637 9      453610        syn-C2H3C(O)NH2, v=0
  850367.5635  0.0081 -2.7569 3  557.5278 93  71510 303463710      4536 9        syn-C2H3C(O)NH2, v=0
  850388.3031  0.0037 -3.1600 3  685.1263133  71510 303662740      652639        syn-C2H3C(O)NH2, v=0
  850388.3035  0.0037 -3.1600 3  685.1263133  71510 303662739      652640        syn-C2H3C(O)NH2, v=0
  850439.8314  0.2290 -5.3435 3 1352.3149129  71510 3036461 3      6460 4        syn-C2H3C(O)NH2, v=0
  850439.8314  0.2290 -5.3435 3 1352.3149129  71510 3036461 4      6460 5        syn-C2H3C(O)NH2, v=0
  850448.9212  0.0199 -3.7958 3  822.9481155  71510 303772156      762057        syn-C2H3C(O)NH2, v=0
  850490.4341  0.0074 -5.2948 3  588.3302131  71510 303651946      651451        syn-C2H3C(O)NH2, v=0
  850570.2325  0.2298 -5.4330 3 1336.8196127  71510 3036361 2      6360 3        syn-C2H3C(O)NH2, v=0
  850570.2325  0.2298 -5.4330 3 1336.8196127  71510 3036361 3      6360 4        syn-C2H3C(O)NH2, v=0
  850580.7961  0.0925 -5.5746 3 1229.5995189  71510 303942570      942273        syn-C2H3C(O)NH2, v=0
  850640.8768  0.0020 -4.8833 3  177.6076 69  71510 303341619      331320        syn-C2H3C(O)NH2, v=0
  850648.2829  0.0020 -4.8833 3  177.6074 69  71510 303341618      331321        syn-C2H3C(O)NH2, v=0
  850696.7939  0.2305 -5.5742 3 1321.5675125  71510 3036261 1      6260 2        syn-C2H3C(O)NH2, v=0
  850696.7939  0.2305 -5.5742 3 1321.5675125  71510 3036261 2      6260 3        syn-C2H3C(O)NH2, v=0
  850712.7555  0.1221 -5.2443 3 1768.0496229  71510 303B42689      B32588        syn-C2H3C(O)NH2, v=0
  850774.5085  0.0064 -2.7811 3  563.4778 97  71510 303483612      473513        syn-C2H3C(O)NH2, v=0
  850774.5085  0.0064 -2.7811 3  563.4778 97  71510 303483613      473512        syn-C2H3C(O)NH2, v=0
  850825.4318  0.0146 -3.7390 3  850.3775157  71510 303782256      772157        syn-C2H3C(O)NH2, v=0
  850920.5085  0.1431 -5.2412 3 1839.2756237  71510 303B82296      B72395        syn-C2H3C(O)NH2, v=0
  850920.8005  0.1431 -5.2412 3 1839.2756237  71510 303B82396      B72295        syn-C2H3C(O)NH2, v=0
  850951.0539  0.0027 -5.3120 3  338.7690 91  71510 303452223      451926        syn-C2H3C(O)NH2, v=0
  850951.0613  0.0027 -5.3120 3  338.7690 91  71510 303452224      451927        syn-C2H3C(O)NH2, v=0
  851153.8152  0.0050 -2.8083 3  570.9077101  71510 303503515      493416        syn-C2H3C(O)NH2, v=0
  851153.8152  0.0050 -2.8083 3  570.9077101  71510 303503516      493415        syn-C2H3C(O)NH2, v=0
  851173.9532  0.0030 -3.7475 3  402.7063113  71510 303561145      551046        syn-C2H3C(O)NH2, v=0
  851189.7702  0.0033 -5.0285 3  560.5937123  71510 303612338      612041        syn-C2H3C(O)NH2, v=0
  851235.4091  0.0194 -3.8975 3  940.6445165  71510 303822360      812259        syn-C2H3C(O)NH2, v=0
  851252.1688  0.0033 -5.0285 3  560.5917123  71510 303612339      612042        syn-C2H3C(O)NH2, v=0
  851282.2276  0.0037 -5.0093 3  198.5326 79  71510 303391228      38 731        syn-C2H3C(O)NH2, v=0
  851300.8292  0.0032 -3.0995 3  665.3334129  71510 303642836      632737        syn-C2H3C(O)NH2, v=0
  851300.8292  0.0032 -3.0995 3  665.3334129  71510 303642837      632736        syn-C2H3C(O)NH2, v=0
  851494.0301  0.0040 -2.8385 3  579.8258105  71510 303523418      513319        syn-C2H3C(O)NH2, v=0
  851494.0301  0.0040 -2.8385 3  579.8258105  71510 303523419      513318        syn-C2H3C(O)NH2, v=0
  851588.3210  0.1881 -5.4304 3 1791.5048229  71510 303B42787      B32886        syn-C2H3C(O)NH2, v=0
  851679.4329  0.0023 -5.5064 3  132.0054 55  71510 303271711      261412        syn-C2H3C(O)NH2, v=0
  851679.4333  0.0023 -5.5064 3  132.0054 55  71510 303271710      261413        syn-C2H3C(O)NH2, v=0
  851779.6346  0.0033 -2.8722 3  590.2419109  71510 303543321      533222        syn-C2H3C(O)NH2, v=0
  851779.6346  0.0033 -2.8722 3  590.2419109  71510 303543322      533221        syn-C2H3C(O)NH2, v=0
  851803.2443  0.0030 -3.7470 3  402.7059113  71510 303561245      55 946        syn-C2H3C(O)NH2, v=0
  851818.0312  0.0029 -3.0449 3  647.1755125  71510 303622933      612834        syn-C2H3C(O)NH2, v=0
  851818.0312  0.0029 -3.0449 3  647.1755125  71510 303622934      612833        syn-C2H3C(O)NH2, v=0
  851904.2800  0.0033 -4.0862 3  300.3632103  71510 30351 645      50 546        syn-C2H3C(O)NH2, v=0
  851904.3158  0.0033 -4.0862 3  300.3632103  71510 30351 745      50 446        syn-C2H3C(O)NH2, v=0
  851989.5566  0.0029 -2.9093 3  602.1681113  71510 303563224      553125        syn-C2H3C(O)NH2, v=0
  851989.5566  0.0029 -2.9093 3  602.1681113  71510 303563225      553124        syn-C2H3C(O)NH2, v=0
  852011.6478  0.1383 -5.2504 3 1825.8759235  71510 303B72394      B62493        syn-C2H3C(O)NH2, v=0
  852016.3456  0.1383 -5.2504 3 1825.8758235  71510 303B72494      B62393        syn-C2H3C(O)NH2, v=0
  852056.3463  0.0028 -2.9953 3  630.6141121  71510 303603030      592931        syn-C2H3C(O)NH2, v=0
  852056.3463  0.0028 -2.9953 3  630.6141121  71510 303603031      592930        syn-C2H3C(O)NH2, v=0
  852095.0200  0.0028 -2.9502 3  615.6193117  71510 303583127      573028        syn-C2H3C(O)NH2, v=0
  852095.0200  0.0028 -2.9502 3  615.6193117  71510 303583128      573027        syn-C2H3C(O)NH2, v=0
  852366.7182  0.0028 -4.2614 3  291.4185 93  71510 303461531      451234        syn-C2H3C(O)NH2, v=0
  852480.0166  0.0063 -5.1443 3  643.8879141  71510 303701456      701159        syn-C2H3C(O)NH2, v=0
  852707.8448  0.0027 -5.3527 3  327.6482 89  71510 303442222      441925        syn-C2H3C(O)NH2, v=0
  852707.8479  0.0027 -5.3527 3  327.6482 89  71510 303442223      441926        syn-C2H3C(O)NH2, v=0
  852763.3093  0.0063 -5.1441 3  643.8879141  71510 303701556      701259        syn-C2H3C(O)NH2, v=0
  852846.1529  0.0068 -5.1144 3  232.7281 97  71510 30348 246      47 147        syn-C2H3C(O)NH2, v=0
  852846.1529  0.0068 -5.1144 3  232.7281 97  71510 30348 346      47 047        syn-C2H3C(O)NH2, v=0
  852974.5794  0.0110 -3.6742 3  858.8087157  71510 303782356      772255        syn-C2H3C(O)NH2, v=0
  852991.4585  0.0058 -3.3360 3  747.3154143  71510 303712547      702446        syn-C2H3C(O)NH2, v=0
  852993.7115  0.0058 -3.3360 3  747.3154143  71510 303712546      702447        syn-C2H3C(O)NH2, v=0
  853048.5406  0.0296 -5.3569 3 1055.2631173  71510 303862661      862364        syn-C2H3C(O)NH2, v=0
  853089.5428  0.1390 -4.8465 3 1440.1628205  71510 303A22677      A12576        syn-C2H3C(O)NH2, v=0
  853242.4509  0.0043 -5.5003 3  405.9318117  71510 30358 850      58 553        syn-C2H3C(O)NH2, v=0
  853242.5779  0.0043 -5.5003 3  405.9318117  71510 30358 950      58 653        syn-C2H3C(O)NH2, v=0
  853477.9647  0.1338 -5.2638 3 1811.6248233  71510 303B62492      B52591        syn-C2H3C(O)NH2, v=0
  853542.8628  0.1337 -5.2637 3 1811.6235233  71510 303B62592      B52491        syn-C2H3C(O)NH2, v=0
  853600.5706  0.0185 -5.1771 3  797.9805155  71510 303771860      771563        syn-C2H3C(O)NH2, v=0
  853682.3207  0.2279 -5.2457 3 1981.5364265  71510 303D2 9C3      D110C2        syn-C2H3C(O)NH2, v=0
  853682.3207  0.2279 -5.2457 3 1981.5364265  71510 303D210C3      D1 9C2        syn-C2H3C(O)NH2, v=0
  853684.2207  0.2207 -5.2498 3 1976.2648263  71510 303D110C1      D011C0        syn-C2H3C(O)NH2, v=0
  853684.2207  0.2207 -5.2498 3 1976.2648263  71510 303D111C1      D010C0        syn-C2H3C(O)NH2, v=0
  853689.5860  0.2356 -5.2411 3 1986.2692267  71510 303D3 8C5      D2 9C4        syn-C2H3C(O)NH2, v=0
  853689.5860  0.2356 -5.2411 3 1986.2692267  71510 303D3 9C5      D2 8C4        syn-C2H3C(O)NH2, v=0
  853698.3838  0.2139 -5.2534 3 1970.4488261  71510 303D011B9      C912B8        syn-C2H3C(O)NH2, v=0
  853698.3838  0.2139 -5.2534 3 1970.4488261  71510 303D012B9      C911B8        syn-C2H3C(O)NH2, v=0
  853703.4023  0.2440 -5.2358 3 1990.4681269  71510 303D4 7C7      D3 8C6        syn-C2H3C(O)NH2, v=0
  853703.4023  0.2440 -5.2358 3 1990.4681269  71510 303D4 8C7      D3 7C6        syn-C2H3C(O)NH2, v=0
  853720.1797  0.0623 -5.3707 3 1040.4329175  71510 303872266      871969        syn-C2H3C(O)NH2, v=0
  853721.5458  0.2533 -5.2300 3 1994.1376271  71510 303D5 6C9      D4 7C8        syn-C2H3C(O)NH2, v=0
  853721.5458  0.2533 -5.2300 3 1994.1376271  71510 303D5 7C9      D4 6C8        syn-C2H3C(O)NH2, v=0
  853728.5107  0.2073 -5.2565 3 1964.0818259  71510 303C912B7      C813B6        syn-C2H3C(O)NH2, v=0
  853728.5107  0.2073 -5.2565 3 1964.0818259  71510 303C913B7      C812B6        syn-C2H3C(O)NH2, v=0
  853742.1112  0.2636 -5.2235 3 1997.2815273  71510 303D6 5D1      D5 6D0        syn-C2H3C(O)NH2, v=0
  853742.1112  0.2636 -5.2235 3 1997.2815273  71510 303D6 6D1      D5 5D0        syn-C2H3C(O)NH2, v=0
  853763.4545  0.2753 -5.2164 3 1999.9032275  71510 303D7 4D3      D6 5D2        syn-C2H3C(O)NH2, v=0
  853763.4545  0.2753 -5.2164 3 1999.9032275  71510 303D7 5D3      D6 4D2        syn-C2H3C(O)NH2, v=0
  853779.0626  0.2010 -5.2593 3 1957.1564257  71510 303C813B5      C714B4        syn-C2H3C(O)NH2, v=0
  853779.0626  0.2010 -5.2593 3 1957.1564257  71510 303C814B5      C713B4        syn-C2H3C(O)NH2, v=0
  853784.1478  0.2887 -5.2086 3 2002.0056277  71510 303D8 3D5      D7 4D4        syn-C2H3C(O)NH2, v=0
  853784.1478  0.2887 -5.2086 3 2002.0056277  71510 303D8 4D5      D7 3D4        syn-C2H3C(O)NH2, v=0
  853802.9425  0.3041 -5.2001 3 2003.5913279  71510 303D9 2D7      D8 3D6        syn-C2H3C(O)NH2, v=0
  853802.9425  0.3041 -5.2001 3 2003.5913279  71510 303D9 3D7      D8 2D6        syn-C2H3C(O)NH2, v=0
  853818.7397  0.3219 -5.1909 3 2004.6628281  71510 303E0 1D9      D9 2D8        syn-C2H3C(O)NH2, v=0
  853818.7397  0.3219 -5.1909 3 2004.6628281  71510 303E0 2D9      D9 1D8        syn-C2H3C(O)NH2, v=0
  853830.5662  0.3425 -5.1809 3 2005.2219283  71510 303E1 0E1      E0 1E0        syn-C2H3C(O)NH2, v=0
  853830.5662  0.3425 -5.1809 3 2005.2219283  71510 303E1 1E1      E0 0E0        syn-C2H3C(O)NH2, v=0
  853855.4713  0.1948 -5.2617 3 1949.6642255  71510 303C714B3      C615B2        syn-C2H3C(O)NH2, v=0
  853855.4713  0.1948 -5.2617 3 1949.6642255  71510 303C715B3      C614B2        syn-C2H3C(O)NH2, v=0
  853963.2691  0.0040 -3.7231 3  459.1435119  71510 303591346      581247        syn-C2H3C(O)NH2, v=0
  853964.4237  0.1888 -5.2639 3 1941.5951253  71510 303C615B1      C516B0        syn-C2H3C(O)NH2, v=0
  853964.4237  0.1888 -5.2639 3 1941.5951253  71510 303C616B1      C515B0        syn-C2H3C(O)NH2, v=0
  854114.2549  0.1829 -5.2660 3 1932.9377251  71510 303C516A9      C417A8        syn-C2H3C(O)NH2, v=0
  854114.2549  0.1829 -5.2660 3 1932.9377251  71510 303C517A9      C416A8        syn-C2H3C(O)NH2, v=0
  854283.7182  0.0728 -5.5022 3 1132.6132179  71510 303892762      892465        syn-C2H3C(O)NH2, v=0
  854304.1911  0.0029 -3.9824 3  320.3587105  71510 30352 745      51 646        syn-C2H3C(O)NH2, v=0
  854304.5307  0.0029 -3.9824 3  320.3587105  71510 30352 845      51 546        syn-C2H3C(O)NH2, v=0
  854315.5049  0.1771 -5.2680 3 1923.6785249  71510 303C417A7      C318A6        syn-C2H3C(O)NH2, v=0
  854315.5049  0.1771 -5.2680 3 1923.6785249  71510 303C418A7      C317A6        syn-C2H3C(O)NH2, v=0
  854341.6875  0.0027 -5.3962 3  316.7839 87  71510 303432221      431924        syn-C2H3C(O)NH2, v=0
  854341.6888  0.0027 -5.3962 3  316.7839 87  71510 303432222      431925        syn-C2H3C(O)NH2, v=0
  854480.1411  0.0105 -3.6228 3  839.0524155  71510 303772354      762255        syn-C2H3C(O)NH2, v=0
  854581.7252  0.1714 -5.2702 3 1913.8014247  71510 303C318A5      C219A4        syn-C2H3C(O)NH2, v=0
  854581.7252  0.1714 -5.2702 3 1913.8014247  71510 303C319A5      C218A4        syn-C2H3C(O)NH2, v=0
  854583.1460  0.0028 -3.7860 3  381.7977111  71510 303551045      54 946        syn-C2H3C(O)NH2, v=0
  854658.7621  0.0159 -3.8359 3  919.6627163  71510 303812359      802258        syn-C2H3C(O)NH2, v=0
  854693.1443  0.0045 -4.1694 3  359.5256103  71510 303511636      501337        syn-C2H3C(O)NH2, v=0
  854701.5250  0.0028 -3.7859 3  381.7976111  71510 303551145      54 846        syn-C2H3C(O)NH2, v=0
  854727.1242  0.0040 -4.2598 3  309.5377 97  71510 303481434      471137        syn-C2H3C(O)NH2, v=0
  854791.6245  0.0078 -3.4638 3  791.3698149  71510 303742451      732350        syn-C2H3C(O)NH2, v=0
  854908.4995  0.0893 -5.5143 3 1172.6304185  71510 303922469      922172        syn-C2H3C(O)NH2, v=0
  854909.3443  0.0367 -5.2580 3  915.5252165  71510 303822063      821766        syn-C2H3C(O)NH2, v=0
  854927.0132  0.0078 -3.4636 3  791.3661149  71510 303742450      732351        syn-C2H3C(O)NH2, v=0
  854930.6867  0.1659 -5.2727 3 1903.2872245  71510 303C219A3      C120A2        syn-C2H3C(O)NH2, v=0
  854930.6867  0.1659 -5.2727 3 1903.2872245  71510 303C220A3      C119A2        syn-C2H3C(O)NH2, v=0
  855116.3207  0.0121 -3.7244 3  878.7579159  71510 303792357      782256        syn-C2H3C(O)NH2, v=0
  855223.1327  0.0063 -3.7600 3  533.3784127  71510 303631548      621449        syn-C2H3C(O)NH2, v=0
  855267.5011  0.1301 -5.2844 3 1796.4264231  71510 303B52590      B42689        syn-C2H3C(O)NH2, v=0
  855363.2972  0.1333 -5.3216 3 1780.1631229  71510 303B42688      B32787        syn-C2H3C(O)NH2, v=0
  855386.2545  0.1604 -5.2759 3 1892.1127243  71510 303C120A1      C021A0        syn-C2H3C(O)NH2, v=0
  855386.2549  0.1604 -5.2759 3 1892.1127243  71510 303C121A1      C020A0        syn-C2H3C(O)NH2, v=0
  855398.2256  0.0063 -5.0679 3  718.7824141  71510 303702446      702149        syn-C2H3C(O)NH2, v=0
  855574.1592  0.0048 -3.2574 3  723.5020139  71510 303692644      682543        syn-C2H3C(O)NH2, v=0
  855574.2069  0.0048 -3.2574 3  723.5020139  71510 303692643      682544        syn-C2H3C(O)NH2, v=0
  855611.4096  0.0032 -5.0391 3  545.3038121  71510 303602337      602040        syn-C2H3C(O)NH2, v=0
  855645.1545  0.0032 -5.0391 3  545.3027121  71510 303602338      602041        syn-C2H3C(O)NH2, v=0
  855701.9021  0.0027 -3.9008 3  340.6061107  71510 30353 845      52 746        syn-C2H3C(O)NH2, v=0
  855704.6615  0.0027 -3.9008 3  340.6061107  71510 30353 945      52 646        syn-C2H3C(O)NH2, v=0
  855750.9694  0.1116 -5.2081 3 1694.9230223  71510 303B12785      B02684        syn-C2H3C(O)NH2, v=0
  855816.0411  0.0136 -3.7782 3  899.0381161  71510 303802358      792257        syn-C2H3C(O)NH2, v=0
  855859.8117  0.0027 -5.4429 3  306.1755 85  71510 303422220      421923        syn-C2H3C(O)NH2, v=0
  855859.8122  0.0027 -5.4429 3  306.1755 85  71510 303422221      421924        syn-C2H3C(O)NH2, v=0
  855897.9261  0.0027 -3.8365 3  361.0912109  71510 30354 945      53 846        syn-C2H3C(O)NH2, v=0
  855917.3066  0.0027 -3.8365 3  361.0912109  71510 303541045      53 746        syn-C2H3C(O)NH2, v=0
  855959.0134  0.0087 -5.3636 3  564.6773129  71510 303641846      641351        syn-C2H3C(O)NH2, v=0
  855981.4298  0.1551 -5.2801 3 1880.2489241  71510 303C02199      B92298        syn-C2H3C(O)NH2, v=0
  855981.4387  0.1551 -5.2801 3 1880.2489241  71510 303C02299      B92198        syn-C2H3C(O)NH2, v=0
  856023.0135  0.1286 -5.2836 3 1796.4109231  71510 303B52690      B42589        syn-C2H3C(O)NH2, v=0
  856047.8640  0.0020 -4.8264 3  186.0549 71  71510 303351620      341321        syn-C2H3C(O)NH2, v=0
  856063.7864  0.0020 -4.8264 3  186.0544 71  71510 303351619      341322        syn-C2H3C(O)NH2, v=0
  856195.6300  0.0054 -5.1663 3  601.1267137  71510 303681355      681058        syn-C2H3C(O)NH2, v=0
  856221.4122  0.0043 -5.3938 3  442.4600121  71510 30360 951      60 654        syn-C2H3C(O)NH2, v=0
  856221.9679  0.0043 -5.3938 3  442.4600121  71510 303601051      60 754        syn-C2H3C(O)NH2, v=0
  856288.8861  0.0054 -5.1662 3  601.1267137  71510 303681455      681158        syn-C2H3C(O)NH2, v=0
  856296.8574  0.0156 -2.7146 3  558.2120 83  71510 3034140 1      4039 2        syn-C2H3C(O)NH2, v=0
  856296.8574  0.0156 -2.7146 3  558.2120 83  71510 3034140 2      4039 1        syn-C2H3C(O)NH2, v=0
  856435.6140  0.1176 -5.1750 3 1666.8351221  71510 303B02784      A92683        syn-C2H3C(O)NH2, v=0
  856623.7471  0.0062 -5.0668 3  718.7415141  71510 303702447      702150        syn-C2H3C(O)NH2, v=0
  856742.3588  0.0127 -2.7315 3  560.2504 87  71510 3034339 4      4238 5        syn-C2H3C(O)NH2, v=0
  856742.3588  0.0127 -2.7315 3  560.2504 87  71510 3034339 5      4238 4        syn-C2H3C(O)NH2, v=0
  856761.1065  0.0035 -3.7128 3  480.9015121  71510 303601546      591247        syn-C2H3C(O)NH2, v=0
  856763.5220  0.1500 -5.2859 3 1867.6592239  71510 303B92297      B82396        syn-C2H3C(O)NH2, v=0
  856763.6899  0.1500 -5.2859 3 1867.6592239  71510 303B92397      B82296        syn-C2H3C(O)NH2, v=0
  856808.4237  0.1114 -5.2423 3 1723.1419225  71510 303B22786      B12685        syn-C2H3C(O)NH2, v=0
  857178.0789  0.0101 -2.7510 3  563.7531 91  71510 3034538 7      4437 8        syn-C2H3C(O)NH2, v=0
  857178.0789  0.0101 -2.7510 3  563.7531 91  71510 3034538 8      4437 7        syn-C2H3C(O)NH2, v=0
  857217.2173  0.0041 -3.1881 3  701.4657135  71510 303672741      662640        syn-C2H3C(O)NH2, v=0
  857217.2180  0.0041 -3.1881 3  701.4657135  71510 303672740      662641        syn-C2H3C(O)NH2, v=0
  857268.9927  0.0027 -5.4928 3  295.8222 83  71510 303412219      411922        syn-C2H3C(O)NH2, v=0
  857268.9929  0.0027 -5.4928 3  295.8222 83  71510 303412220      411923        syn-C2H3C(O)NH2, v=0
  857430.4210  0.0148 -5.1819 3  878.4480157  71510 303782554      782257        syn-C2H3C(O)NH2, v=0
  857599.1188  0.0080 -2.7732 3  568.7249 95  71510 303473710      463611        syn-C2H3C(O)NH2, v=0
  857599.1188  0.0080 -2.7732 3  568.7249 95  71510 303473711      463610        syn-C2H3C(O)NH2, v=0
  857802.8296  0.1451 -5.2941 3 1854.2960237  71510 303B82395      B72494        syn-C2H3C(O)NH2, v=0
  857805.5969  0.1451 -5.2941 3 1854.2959237  71510 303B82495      B72394        syn-C2H3C(O)NH2, v=0
  857998.7762  0.0063 -2.7983 3  575.1718 99  71510 303493613      483514        syn-C2H3C(O)NH2, v=0
  857998.7762  0.0063 -2.7983 3  575.1718 99  71510 303493614      483513        syn-C2H3C(O)NH2, v=0
  858112.4148  0.0046 -5.3111 3  480.2521125  71510 303621052      62 755        syn-C2H3C(O)NH2, v=0
  858114.6484  0.0046 -5.3111 3  480.2521125  71510 303621152      62 855        syn-C2H3C(O)NH2, v=0
  858131.2635  0.0057 -4.6766 3  252.0078 99  71510 30349 346      48 247        syn-C2H3C(O)NH2, v=0
  858131.2636  0.0057 -4.6766 3  252.0078 99  71510 30349 446      48 147        syn-C2H3C(O)NH2, v=0
  858235.8966  0.0050 -5.2001 3  559.5942133  71510 303661254      66 957        syn-C2H3C(O)NH2, v=0
  858240.5057  0.0035 -3.1260 3  681.1297131  71510 303652837      642738        syn-C2H3C(O)NH2, v=0
  858240.5057  0.0035 -3.1260 3  681.1297131  71510 303652838      642737        syn-C2H3C(O)NH2, v=0
  858264.6847  0.0050 -5.2001 3  559.5942133  71510 303661354      661057        syn-C2H3C(O)NH2, v=0
  858292.0199  0.0022 -5.4157 3  138.6379 57  71510 303281712      271413        syn-C2H3C(O)NH2, v=0
  858292.0212  0.0022 -5.4157 3  138.6379 57  71510 303281711      271414        syn-C2H3C(O)NH2, v=0
  858305.2189  0.0049 -3.7374 3  495.6762123  71510 303611447      601348        syn-C2H3C(O)NH2, v=0
  858339.2964  0.0063 -4.6656 3  264.2919 91  71510 303451233      44 936        syn-C2H3C(O)NH2, v=0
  858367.9535  0.0050 -2.8264 3  583.1008103  71510 303513516      503417        syn-C2H3C(O)NH2, v=0
  858367.9535  0.0050 -2.8264 3  583.1008103  71510 303513517      503416        syn-C2H3C(O)NH2, v=0
  858433.2567  0.0029 -4.2384 3  303.0426 95  71510 303471532      461235        syn-C2H3C(O)NH2, v=0
  858575.5959  0.0027 -5.5463 3  285.7234 81  71510 303402218      401921        syn-C2H3C(O)NH2, v=0
  858575.5960  0.0027 -5.5463 3  285.7234 81  71510 303402219      401922        syn-C2H3C(O)NH2, v=0
  858694.3488  0.0041 -2.8577 3  592.5206107  71510 303533419      523320        syn-C2H3C(O)NH2, v=0
  858694.3488  0.0041 -2.8577 3  592.5206107  71510 303533420      523319        syn-C2H3C(O)NH2, v=0
  858822.9464  0.0048 -5.2476 3  519.2997129  71510 303641153      64 856        syn-C2H3C(O)NH2, v=0
  858831.2565  0.0048 -5.2476 3  519.2997129  71510 303641253      64 956        syn-C2H3C(O)NH2, v=0
  858838.0605  0.0031 -3.0699 3  662.4391127  71510 303632934      622835        syn-C2H3C(O)NH2, v=0
  858838.0605  0.0031 -3.0699 3  662.4391127  71510 303632935      622834        syn-C2H3C(O)NH2, v=0
  858959.9561  0.0034 -3.7329 3  502.6842123  71510 303611646      601347        syn-C2H3C(O)NH2, v=0
  858961.3321  0.0034 -2.8923 3  603.4415111  71510 303553322      543223        syn-C2H3C(O)NH2, v=0
  858961.3321  0.0034 -2.8923 3  603.4415111  71510 303553323      543222        syn-C2H3C(O)NH2, v=0
  859135.6992  0.0029 -3.0190 3  645.3531123  71510 303613031      602932        syn-C2H3C(O)NH2, v=0
  859135.6992  0.0029 -3.0190 3  645.3531123  71510 303613032      602931        syn-C2H3C(O)NH2, v=0
  859146.3530  0.0030 -2.9306 3  615.8762115  71510 303573225      563126        syn-C2H3C(O)NH2, v=0
  859146.3530  0.0030 -2.9306 3  615.8762115  71510 303573226      563125        syn-C2H3C(O)NH2, v=0
  859184.7192  0.1151 -5.2775 3 1751.5038227  71510 303B32787      B22686        syn-C2H3C(O)NH2, v=0
  859198.9525  0.1403 -5.3061 3 1840.0946235  71510 303B72493      B62592        syn-C2H3C(O)NH2, v=0
  859218.6303  0.0029 -2.9727 3  629.8402119  71510 303593128      583029        syn-C2H3C(O)NH2, v=0
  859218.6303  0.0029 -2.9727 3  629.8402119  71510 303593129      583028        syn-C2H3C(O)NH2, v=0
  859238.2409  0.1403 -5.3061 3 1840.0938235  71510 303B72593      B62492        syn-C2H3C(O)NH2, v=0
  859323.8908  0.1300 -5.1427 3 1638.8666219  71510 303A92783      A82682        syn-C2H3C(O)NH2, v=0
  859367.2905  0.0065 -3.3692 3  765.0537145  71510 303722548      712447        syn-C2H3C(O)NH2, v=0
  859371.6071  0.0065 -3.3692 3  765.0536145  71510 303722547      712448        syn-C2H3C(O)NH2, v=0
  859657.8989  0.2379 -5.2951 3 2010.0122267  71510 303D3 9C4      D210C3        syn-C2H3C(O)NH2, v=0
  859657.8989  0.2379 -5.2951 3 2010.0122267  71510 303D310C4      D2 9C3        syn-C2H3C(O)NH2, v=0
  859658.5218  0.2304 -5.2991 3 2004.7407265  71510 303D210C2      D111C1        syn-C2H3C(O)NH2, v=0
  859658.5218  0.2304 -5.2991 3 2004.7407265  71510 303D211C2      D110C1        syn-C2H3C(O)NH2, v=0
  859666.1466  0.2460 -5.2906 3 2014.7452269  71510 303D4 8C6      D3 9C5        syn-C2H3C(O)NH2, v=0
  859666.1466  0.2460 -5.2906 3 2014.7452269  71510 303D4 9C6      D3 8C5        syn-C2H3C(O)NH2, v=0
  859671.0358  0.2234 -5.3025 3 1998.9251263  71510 303D111C0      D012B9        syn-C2H3C(O)NH2, v=0
  859671.0358  0.2234 -5.3025 3 1998.9251263  71510 303D112C0      D011B9        syn-C2H3C(O)NH2, v=0
  859680.7104  0.2547 -5.2855 3 2018.9446271  71510 303D5 7C8      D4 8C7        syn-C2H3C(O)NH2, v=0
  859680.7104  0.2547 -5.2855 3 2018.9446271  71510 303D5 8C8      D4 7C7        syn-C2H3C(O)NH2, v=0
  859699.0420  0.2166 -5.3055 3 1992.5591261  71510 303D012B8      C913B7        syn-C2H3C(O)NH2, v=0
  859699.0420  0.2166 -5.3055 3 1992.5591261  71510 303D013B8      C912B7        syn-C2H3C(O)NH2, v=0
  859699.4137  0.2643 -5.2798 3 2022.6147273  71510 303D6 6D0      D5 7C9        syn-C2H3C(O)NH2, v=0
  859699.4137  0.2643 -5.2798 3 2022.6147273  71510 303D6 7D0      D5 6C9        syn-C2H3C(O)NH2, v=0
  859720.3882  0.2750 -5.2734 3 2025.7593275  71510 303D7 5D2      D6 6D1        syn-C2H3C(O)NH2, v=0
  859720.3882  0.2750 -5.2734 3 2025.7593275  71510 303D7 6D2      D6 5D1        syn-C2H3C(O)NH2, v=0
  859721.6174  0.0149 -5.1781 3  858.8087155  71510 303772552      772255        syn-C2H3C(O)NH2, v=0
  859728.6258  0.2411 -5.5717 3 1847.1168179  71510 303896227      896128        syn-C2H3C(O)NH2, v=0
  859728.6258  0.2411 -5.5717 3 1847.1168179  71510 303896228      896129        syn-C2H3C(O)NH2, v=0
  859737.6068  0.0031 -5.0512 3  530.2844119  71510 303592336      592039        syn-C2H3C(O)NH2, v=0
  859742.0191  0.2872 -5.2664 3 2028.3816277  71510 303D8 4D4      D7 5D3        syn-C2H3C(O)NH2, v=0
  859742.0191  0.2872 -5.2664 3 2028.3816277  71510 303D8 5D4      D7 4D3        syn-C2H3C(O)NH2, v=0
  859746.8715  0.2100 -5.3080 3 1985.6355259  71510 303C913B6      C814B5        syn-C2H3C(O)NH2, v=0
  859746.8715  0.2100 -5.3080 3 1985.6355259  71510 303C914B6      C813B5        syn-C2H3C(O)NH2, v=0
  859755.5590  0.0031 -5.0512 3  530.2838119  71510 303592337      592040        syn-C2H3C(O)NH2, v=0
  859762.9013  0.3011 -5.2587 3 2030.4847279  71510 303D9 3D6      D8 4D5        syn-C2H3C(O)NH2, v=0
  859762.9013  0.3011 -5.2587 3 2030.4847279  71510 303D9 4D6      D8 3D5        syn-C2H3C(O)NH2, v=0
  859781.8044  0.3170 -5.2503 3 2032.0711281  71510 303E0 2D8      D9 3D7        syn-C2H3C(O)NH2, v=0
  859781.8044  0.3170 -5.2503 3 2032.0711281  71510 303E0 3D8      D9 2D7        syn-C2H3C(O)NH2, v=0
  859797.6438  0.3354 -5.2411 3 2033.1431283  71510 303E1 1E0      E0 2D9        syn-C2H3C(O)NH2, v=0
  859797.6438  0.3354 -5.2411 3 2033.1431283  71510 303E1 2E0      E0 1D9        syn-C2H3C(O)NH2, v=0
  859809.4574  0.3566 -5.2313 3 2033.7026285  71510 303E2 0E2      E1 1E1        syn-C2H3C(O)NH2, v=0
  859809.4574  0.3566 -5.2313 3 2033.7026285  71510 303E2 1E2      E1 0E1        syn-C2H3C(O)NH2, v=0
  859819.7851  0.2036 -5.3102 3 1978.1457257  71510 303C814B4      C715B3        syn-C2H3C(O)NH2, v=0
  859819.7851  0.2036 -5.3102 3 1978.1457257  71510 303C815B4      C714B3        syn-C2H3C(O)NH2, v=0
  859924.2413  0.1974 -5.3122 3 1970.0803255  71510 303C715B2      C616B1        syn-C2H3C(O)NH2, v=0
  859924.2413  0.1974 -5.3122 3 1970.0803255  71510 303C716B2      C615B1        syn-C2H3C(O)NH2, v=0
  859937.4197  0.0195 -3.8475 3  732.1262147  71510 303731954      721855        syn-C2H3C(O)NH2, v=0
  859981.0903  0.2410 -5.5407 3 1825.5307177  71510 303886226      886127        syn-C2H3C(O)NH2, v=0
  859981.0903  0.2410 -5.5407 3 1825.5307177  71510 303886227      886128        syn-C2H3C(O)NH2, v=0
  860068.2666  0.1913 -5.3140 3 1961.4279253  71510 303C616B0      C517A9        syn-C2H3C(O)NH2, v=0
  860068.2666  0.1913 -5.3140 3 1961.4279253  71510 303C617B0      C516A9        syn-C2H3C(O)NH2, v=0
  860190.6029  0.0305 -5.2396 3  865.5303161  71510 303801862      801565        syn-C2H3C(O)NH2, v=0
  860227.3381  0.2410 -5.5108 3 1804.1891175  71510 303876225      876126        syn-C2H3C(O)NH2, v=0
  860227.3381  0.2410 -5.5108 3 1804.1891175  71510 303876226      876127        syn-C2H3C(O)NH2, v=0
  860261.9759  0.1853 -5.3157 3 1952.1754251  71510 303C517A8      C418A7        syn-C2H3C(O)NH2, v=0
  860261.9759  0.1853 -5.3157 3 1952.1754251  71510 303C518A8      C417A7        syn-C2H3C(O)NH2, v=0
  860290.4961  0.0061 -5.4917 3  493.2085119  71510 303591940      591445        syn-C2H3C(O)NH2, v=0
  860467.4868  0.2411 -5.4820 3 1783.0921173  71510 303866224      866125        syn-C2H3C(O)NH2, v=0
  860467.4868  0.2411 -5.4820 3 1783.0921173  71510 303866225      866126        syn-C2H3C(O)NH2, v=0
  860481.7320  0.0135 -5.1710 3  750.9750151  71510 303751659      751362        syn-C2H3C(O)NH2, v=0
  860518.3233  0.1794 -5.3176 3 1942.3071249  71510 303C418A6      C319A5        syn-C2H3C(O)NH2, v=0
  860518.3233  0.1794 -5.3176 3 1942.3071249  71510 303C419A6      C318A5        syn-C2H3C(O)NH2, v=0
  860549.4411  0.0118 -3.6678 3  858.6098157  71510 303782355      772256        syn-C2H3C(O)NH2, v=0
  860593.7688  0.0086 -3.5014 3  809.9949151  71510 303752452      742351        syn-C2H3C(O)NH2, v=0
  860687.3932  0.0548 -4.2466 3 1102.7059179  71510 303892466      882365        syn-C2H3C(O)NH2, v=0
  860701.6527  0.2412 -5.4543 3 1762.2394171  71510 303856223      856124        syn-C2H3C(O)NH2, v=0
  860701.6527  0.2412 -5.4543 3 1762.2394171  71510 303856224      856125        syn-C2H3C(O)NH2, v=0
  860832.5307  0.0086 -3.5012 3  809.9883151  71510 303752451      742352        syn-C2H3C(O)NH2, v=0
  860854.2181  0.1736 -5.3198 3 1931.8046247  71510 303C319A4      C220A3        syn-C2H3C(O)NH2, v=0
  860854.2181  0.1736 -5.3198 3 1931.8046247  71510 303C320A4      C219A3        syn-C2H3C(O)NH2, v=0
  860929.9501  0.2414 -5.4279 3 1741.6311169  71510 303846222      846123        syn-C2H3C(O)NH2, v=0
  860929.9501  0.2414 -5.4279 3 1741.6311169  71510 303846223      846124        syn-C2H3C(O)NH2, v=0
  860976.9718  0.1362 -5.3245 3 1824.9647233  71510 303B62591      B52690        syn-C2H3C(O)NH2, v=0
  861026.2976  0.0054 -4.4492 3  292.2697 95  71510 303471334      461037        syn-C2H3C(O)NH2, v=0
  861152.4920  0.2416 -5.4027 3 1721.2671167  71510 303836221      836122        syn-C2H3C(O)NH2, v=0
  861152.4920  0.2416 -5.4027 3 1721.2671167  71510 303836222      836123        syn-C2H3C(O)NH2, v=0
  861237.8351  0.0020 -4.7724 3  194.7647 73  71510 303361621      351322        syn-C2H3C(O)NH2, v=0
  861264.4052  0.0280 -5.3405 3 1033.3034171  71510 303852660      852363        syn-C2H3C(O)NH2, v=0
  861271.0640  0.0020 -4.7724 3  194.7635 73  71510 303361620      351323        syn-C2H3C(O)NH2, v=0
  861292.2431  0.1680 -5.3225 3 1920.6453245  71510 303C220A2      C121A1        syn-C2H3C(O)NH2, v=0
  861292.2433  0.1680 -5.3225 3 1920.6453245  71510 303C221A2      C120A1        syn-C2H3C(O)NH2, v=0
  861304.3285  0.0112 -3.8208 3  629.0820137  71510 303681751      671652        syn-C2H3C(O)NH2, v=0
  861369.3897  0.2418 -5.3790 3 1701.1473165  71510 303826220      826121        syn-C2H3C(O)NH2, v=0
  861369.3897  0.2418 -5.3790 3 1701.1473165  71510 303826221      826122        syn-C2H3C(O)NH2, v=0
  861371.7000  0.0034 -3.7183 3  459.1361119  71510 303591446      581147        syn-C2H3C(O)NH2, v=0
  861449.5053  0.1352 -5.3240 3 1824.9550233  71510 303B62691      B52590        syn-C2H3C(O)NH2, v=0
  861576.0246  0.0439 -5.5678 3 1224.8829187  71510 303932767      932470        syn-C2H3C(O)NH2, v=0
  861580.7529  0.2421 -5.3566 3 1681.2717163  71510 303816219      816120        syn-C2H3C(O)NH2, v=0
  861580.7529  0.2421 -5.3566 3 1681.2717163  71510 303816220      816121        syn-C2H3C(O)NH2, v=0
  861786.6897  0.2425 -5.3359 3 1661.6401161  71510 303806218      806119        syn-C2H3C(O)NH2, v=0
  861786.6897  0.2425 -5.3359 3 1661.6401161  71510 303806219      806120        syn-C2H3C(O)NH2, v=0
  861845.4790  0.0131 -5.1699 3  750.9751151  71510 303751759      751462        syn-C2H3C(O)NH2, v=0
  861863.4161  0.1625 -5.3262 3 1908.8014243  71510 303C121A0      C02299        syn-C2H3C(O)NH2, v=0
  861863.4211  0.1625 -5.3262 3 1908.8014243  71510 303C122A0      C02199        syn-C2H3C(O)NH2, v=0
  861891.8384  0.1365 -5.3565 3 1808.7895231  71510 303B52689      B42788        syn-C2H3C(O)NH2, v=0
  861987.3068  0.2428 -5.3168 3 1642.2526159  71510 303796217      796118        syn-C2H3C(O)NH2, v=0
  861987.3068  0.2428 -5.3168 3 1642.2526159  71510 303796218      796119        syn-C2H3C(O)NH2, v=0
  861990.2309  0.1736 -5.4535 3 1820.3957231  71510 303B52788      B42887        syn-C2H3C(O)NH2, v=0
  862182.7092  0.2433 -5.2995 3 1623.1090157  71510 303786216      786117        syn-C2H3C(O)NH2, v=0
  862182.7092  0.2433 -5.2995 3 1623.1090157  71510 303786217      786118        syn-C2H3C(O)NH2, v=0
  862203.3704  0.0054 -3.2882 3  740.6605141  71510 303702645      692544        syn-C2H3C(O)NH2, v=0
  862203.4682  0.0054 -3.2882 3  740.6605141  71510 303702644      692545        syn-C2H3C(O)NH2, v=0
  862239.1734  0.0184 -3.7961 3  870.2768159  71510 303792257      782158        syn-C2H3C(O)NH2, v=0
  862373.0006  0.2437 -5.2842 3 1604.2093155  71510 303776215      776116        syn-C2H3C(O)NH2, v=0
  862373.0006  0.2437 -5.2842 3 1604.2093155  71510 303776216      776117        syn-C2H3C(O)NH2, v=0
  862377.3264  0.0056 -5.0670 3  701.0785139  71510 303692445      692148        syn-C2H3C(O)NH2, v=0
  862528.5028  0.1209 -5.3139 3 1780.0187229  71510 303B42788      B32687        syn-C2H3C(O)NH2, v=0
  862558.2832  0.2442 -5.2710 3 1585.5535153  71510 303766214      766115        syn-C2H3C(O)NH2, v=0
  862558.2832  0.2442 -5.2710 3 1585.5535153  71510 303766215      766116        syn-C2H3C(O)NH2, v=0
  862594.4110  0.0084 -5.3227 3  604.7589133  71510 303661947      661452        syn-C2H3C(O)NH2, v=0
  862611.8437  0.1572 -5.3313 3 1896.2378241  71510 303C02298      B92397        syn-C2H3C(O)NH2, v=0
  862611.9400  0.1572 -5.3313 3 1896.2378241  71510 303C02398      B92297        syn-C2H3C(O)NH2, v=0
  862738.6574  0.2447 -5.2602 3 1567.1415151  71510 303756213      756114        syn-C2H3C(O)NH2, v=0
  862738.6574  0.2447 -5.2602 3 1567.1415151  71510 303756214      756115        syn-C2H3C(O)NH2, v=0
  862838.2985  0.0047 -4.4157 3  271.5820101  71510 30350 446      49 347        syn-C2H3C(O)NH2, v=0
  862838.2986  0.0047 -4.4157 3  271.5820101  71510 30350 546      49 247        syn-C2H3C(O)NH2, v=0
  862914.2226  0.2453 -5.2521 3 1548.9731149  71510 303746212      746113        syn-C2H3C(O)NH2, v=0
  862914.2226  0.2453 -5.2521 3 1548.9731149  71510 303746213      746114        syn-C2H3C(O)NH2, v=0
  863085.0764  0.2458 -5.2471 3 1531.0485147  71510 303736211      736112        syn-C2H3C(O)NH2, v=0
  863085.0764  0.2458 -5.2471 3 1531.0485147  71510 303736212      736113        syn-C2H3C(O)NH2, v=0
  863104.1819  0.0056 -5.0663 3  701.0542139  71510 303692446      692149        syn-C2H3C(O)NH2, v=0
  863146.6546  0.0329 -5.3228 3  990.7054167  71510 303832657      832360        syn-C2H3C(O)NH2, v=0
  863251.3151  0.2465 -5.2455 3 1513.3674145  71510 303726210      726111        syn-C2H3C(O)NH2, v=0
  863251.3151  0.2465 -5.2455 3 1513.3674145  71510 303726211      726112        syn-C2H3C(O)NH2, v=0
  863294.7466  0.0069 -4.9178 3  237.5139 87  71510 303431132      42 835        syn-C2H3C(O)NH2, v=0
  863413.0337  0.2471 -5.2479 3 1495.9300143  71510 3037162 9      716110        syn-C2H3C(O)NH2, v=0
  863413.0337  0.2471 -5.2479 3 1495.9300143  71510 303716210      716111        syn-C2H3C(O)NH2, v=0
  863537.5323  0.0155 -2.7290 3  568.1729 85  71510 3034240 2      4139 3        syn-C2H3C(O)NH2, v=0
  863537.5323  0.0155 -2.7290 3  568.1729 85  71510 3034240 3      4139 2        syn-C2H3C(O)NH2, v=0
  863570.3255  0.2478 -5.2552 3 1478.7360141  71510 3037062 8      7061 9        syn-C2H3C(O)NH2, v=0
  863570.3255  0.2478 -5.2552 3 1478.7360141  71510 3037062 9      706110        syn-C2H3C(O)NH2, v=0
  863593.0313  0.0031 -5.0648 3  515.5339117  71510 303582335      582038        syn-C2H3C(O)NH2, v=0
  863602.4247  0.0031 -5.0648 3  515.5336117  71510 303582336      582039        syn-C2H3C(O)NH2, v=0
  863602.6607  0.1520 -5.3386 3 1882.9093239  71510 303B92396      B82495        syn-C2H3C(O)NH2, v=0
  863604.2839  0.1520 -5.3386 3 1882.9092239  71510 303B92496      B82395        syn-C2H3C(O)NH2, v=0
  863683.2731  0.0094 -5.4752 3  525.7320125  71510 303621745      621250        syn-C2H3C(O)NH2, v=0
  863723.2828  0.2484 -5.2683 3 1461.7854139  71510 3036962 7      6961 8        syn-C2H3C(O)NH2, v=0
  863723.2828  0.2484 -5.2683 3 1461.7854139  71510 3036962 8      6961 9        syn-C2H3C(O)NH2, v=0
  863871.9960  0.2492 -5.2887 3 1445.0783137  71510 3036862 6      6861 7        syn-C2H3C(O)NH2, v=0
  863871.9960  0.2492 -5.2887 3 1445.0783137  71510 3036862 7      6861 8        syn-C2H3C(O)NH2, v=0
  863937.5794  0.0806 -5.4631 3 1116.7792181  71510 303902368      902071        syn-C2H3C(O)NH2, v=0
  863980.5088  0.0125 -2.7467 3  570.7038 89  71510 3034439 5      4338 6        syn-C2H3C(O)NH2, v=0
  863980.5088  0.0125 -2.7467 3  570.7038 89  71510 3034439 6      4338 5        syn-C2H3C(O)NH2, v=0
  864015.1283  0.0045 -3.2169 3  718.0642137  71510 303682742      672641        syn-C2H3C(O)NH2, v=0
  864015.1299  0.0045 -3.2169 3  718.0642137  71510 303682741      672642        syn-C2H3C(O)NH2, v=0
  864016.5546  0.2499 -5.3185 3 1428.6145135  71510 3036762 5      6761 6        syn-C2H3C(O)NH2, v=0
  864016.5546  0.2499 -5.3185 3 1428.6145135  71510 3036762 6      6761 7        syn-C2H3C(O)NH2, v=0
  864157.0464  0.2506 -5.3610 3 1412.3939133  71510 3036662 4      6661 5        syn-C2H3C(O)NH2, v=0
  864157.0464  0.2506 -5.3610 3 1412.3939133  71510 3036662 5      6661 6        syn-C2H3C(O)NH2, v=0
  864232.1715  0.0049 -5.1513 3  193.3111 79  71510 303391129      38 632        syn-C2H3C(O)NH2, v=0
  864271.9767  0.0043 -4.2196 3  346.3672101  71510 303501635      491336        syn-C2H3C(O)NH2, v=0
  864293.5580  0.2514 -5.4216 3 1396.4166131  71510 3036562 3      6561 4        syn-C2H3C(O)NH2, v=0
  864293.5580  0.2514 -5.4216 3 1396.4166131  71510 3036562 4      6561 5        syn-C2H3C(O)NH2, v=0
  864412.3340  0.0100 -2.7670 3  574.7003 93  71510 3034638 8      4537 9        syn-C2H3C(O)NH2, v=0
  864412.3340  0.0100 -2.7670 3  574.7003 93  71510 3034638 9      4537 8        syn-C2H3C(O)NH2, v=0
  864426.1747  0.2522 -5.5107 3 1380.6825129  71510 3036462 2      6461 3        syn-C2H3C(O)NH2, v=0
  864426.1747  0.2522 -5.5107 3 1380.6825129  71510 3036462 3      6461 4        syn-C2H3C(O)NH2, v=0
  864818.8201  0.0021 -5.3314 3  145.5226 59  71510 303291713      281414        syn-C2H3C(O)NH2, v=0
  864818.8240  0.0021 -5.3314 3  145.5226 59  71510 303291712      281415        syn-C2H3C(O)NH2, v=0
  864827.6875  0.0080 -2.7901 3  580.1677 97  71510 303483711      473612        syn-C2H3C(O)NH2, v=0
  864827.6875  0.0080 -2.7901 3  580.1677 97  71510 303483712      473611        syn-C2H3C(O)NH2, v=0
  864842.5280  0.1475 -5.1106 3 1611.0078217  71510 303A82782      A72681        syn-C2H3C(O)NH2, v=0
  864930.8653  0.1471 -5.3493 3 1868.7549237  71510 303B82494      B72593        syn-C2H3C(O)NH2, v=0
  864954.5284  0.1471 -5.3493 3 1868.7544237  71510 303B82594      B72493        syn-C2H3C(O)NH2, v=0
  865124.6224  0.0033 -5.3061 3  184.1164 75  71510 303371325      36 828        syn-C2H3C(O)NH2, v=0
  865140.4293  0.0037 -5.4512 3  174.8782 73  71510 303361324      35 827        syn-C2H3C(O)NH2, v=0
  865156.8248  0.0039 -3.1531 3  697.1825133  71510 303662839      652738        syn-C2H3C(O)NH2, v=0
  865156.8249  0.0039 -3.1531 3  697.1825133  71510 303662838      652739        syn-C2H3C(O)NH2, v=0
  865168.8273  0.0033 -3.7378 3  437.4780117  71510 303581246      571147        syn-C2H3C(O)NH2, v=0
  865219.3297  0.0063 -2.8160 3  587.1122101  71510 303503614      493515        syn-C2H3C(O)NH2, v=0
  865219.3297  0.0063 -2.8160 3  587.1122101  71510 303503615      493514        syn-C2H3C(O)NH2, v=0
  865311.6130  0.1007 -4.5338 3 1253.3832191  71510 303952571      942470        syn-C2H3C(O)NH2, v=0
  865444.2181  0.0511 -5.3339 3  987.4890171  71510 303852165      851868        syn-C2H3C(O)NH2, v=0
  865577.4738  0.0050 -2.8451 3  595.5410105  71510 303523517      513418        syn-C2H3C(O)NH2, v=0
  865577.4738  0.0050 -2.8451 3  595.5410105  71510 303523518      513417        syn-C2H3C(O)NH2, v=0
  865631.7314  0.2405 -5.3488 3 2033.4158267  71510 303D310C3      D211C2        syn-C2H3C(O)NH2, v=0
  865631.7314  0.2405 -5.3488 3 2033.4158267  71510 303D311C3      D210C2        syn-C2H3C(O)NH2, v=0
  865632.3592  0.2483 -5.3450 3 2038.6873269  71510 303D4 9C5      D310C4        syn-C2H3C(O)NH2, v=0
  865632.3592  0.2483 -5.3450 3 2038.6873269  71510 303D410C5      D3 9C4        syn-C2H3C(O)NH2, v=0
  865641.5708  0.2567 -5.3406 3 2043.4206271  71510 303D5 8C7      D4 9C6        syn-C2H3C(O)NH2, v=0
  865641.5708  0.2567 -5.3406 3 2043.4206271  71510 303D5 9C7      D4 8C6        syn-C2H3C(O)NH2, v=0
  865642.6337  0.2332 -5.3521 3 2027.6006265  71510 303D211C1      D112C0        syn-C2H3C(O)NH2, v=0
  865642.6337  0.2332 -5.3521 3 2027.6006265  71510 303D212C1      D111C0        syn-C2H3C(O)NH2, v=0
  865656.8696  0.2657 -5.3357 3 2047.6205273  71510 303D6 7C9      D5 8C8        syn-C2H3C(O)NH2, v=0
  865656.8696  0.2657 -5.3357 3 2047.6205273  71510 303D6 8C9      D5 7C8        syn-C2H3C(O)NH2, v=0
  865668.3868  0.0133 -5.1731 3  858.6098155  71510 303772553      772256        syn-C2H3C(O)NH2, v=0
  865668.5715  0.2261 -5.3549 3 2021.2356263  71510 303D112B9      D013B8        syn-C2H3C(O)NH2, v=0
  865668.5715  0.2261 -5.3549 3 2021.2356263  71510 303D113B9      D012B8        syn-C2H3C(O)NH2, v=0
  865674.9081  0.0072 -3.4033 3  783.0603147  71510 303732549      722448        syn-C2H3C(O)NH2, v=0
  865676.1245  0.2757 -5.3301 3 2051.2912275  71510 303D7 6D1      D6 7D0        syn-C2H3C(O)NH2, v=0
  865676.1245  0.2757 -5.3301 3 2051.2912275  71510 303D7 7D1      D6 6D0        syn-C2H3C(O)NH2, v=0
  865683.0669  0.0072 -3.4033 3  783.0601147  71510 303732548      722449        syn-C2H3C(O)NH2, v=0
  865697.5028  0.2868 -5.3238 3 2054.4365277  71510 303D8 5D3      D7 6D2        syn-C2H3C(O)NH2, v=0
  865697.5028  0.2868 -5.3238 3 2054.4365277  71510 303D8 6D3      D7 5D2        syn-C2H3C(O)NH2, v=0
  865713.7519  0.2193 -5.3573 3 2014.3135261  71510 303D013B7      C914B6        syn-C2H3C(O)NH2, v=0
  865713.7519  0.2193 -5.3573 3 2014.3135261  71510 303D014B7      C913B6        syn-C2H3C(O)NH2, v=0
  865719.4180  0.2994 -5.3169 3 2057.0595279  71510 303D9 4D5      D8 5D4        syn-C2H3C(O)NH2, v=0
  865719.4180  0.2994 -5.3169 3 2057.0595279  71510 303D9 5D5      D8 4D4        syn-C2H3C(O)NH2, v=0
  865740.4872  0.3138 -5.3093 3 2059.1633281  71510 303E0 3D7      D9 4D6        syn-C2H3C(O)NH2, v=0
  865740.4872  0.3138 -5.3093 3 2059.1633281  71510 303E0 4D7      D9 3D6        syn-C2H3C(O)NH2, v=0
  865759.4978  0.3303 -5.3010 3 2060.7504283  71510 303E1 2D9      E0 3D8        syn-C2H3C(O)NH2, v=0
  865759.4978  0.3303 -5.3010 3 2060.7504283  71510 303E1 3D9      E0 2D8        syn-C2H3C(O)NH2, v=0
  865770.3997  0.0278 -5.2351 3  865.5307161  71510 303801962      801665        syn-C2H3C(O)NH2, v=0
  865775.3790  0.3493 -5.2919 3 2061.8229285  71510 303E2 1E1      E1 2E0        syn-C2H3C(O)NH2, v=0
  865775.3790  0.3493 -5.2919 3 2061.8229285  71510 303E2 2E1      E1 1E0        syn-C2H3C(O)NH2, v=0
  865783.2720  0.2127 -5.3593 3 2006.8262259  71510 303C914B5      C815B4        syn-C2H3C(O)NH2, v=0
  865783.2720  0.2127 -5.3593 3 2006.8262259  71510 303C915B5      C814B4        syn-C2H3C(O)NH2, v=0
  865787.1796  0.3711 -5.2821 3 2062.3828287  71510 303E3 0E3      E2 1E2        syn-C2H3C(O)NH2, v=0
  865787.1796  0.3711 -5.2821 3 2062.3828287  71510 303E3 1E3      E2 0E2        syn-C2H3C(O)NH2, v=0
  865840.0710  0.0034 -3.0955 3  677.9571129  71510 303642935      632836        syn-C2H3C(O)NH2, v=0
  865840.0710  0.0034 -3.0955 3  677.9571129  71510 303642936      632835        syn-C2H3C(O)NH2, v=0
  865883.3733  0.2063 -5.3610 3 1998.7643257  71510 303C815B3      C716B2        syn-C2H3C(O)NH2, v=0
  865883.3733  0.2063 -5.3610 3 1998.7643257  71510 303C816B3      C715B2        syn-C2H3C(O)NH2, v=0
  865888.9247  0.0041 -2.8774 3  605.4634109  71510 303543420      533321        syn-C2H3C(O)NH2, v=0
  865888.9247  0.0041 -2.8774 3  605.4634109  71510 303543421      533320        syn-C2H3C(O)NH2, v=0
  865947.5111  0.0030 -4.2221 3  314.8990 97  71510 303481533      471236        syn-C2H3C(O)NH2, v=0
  866021.7898  0.1999 -5.3626 3 1990.1167255  71510 303C716B1      C617B0        syn-C2H3C(O)NH2, v=0
  866021.7898  0.1999 -5.3626 3 1990.1167255  71510 303C717B1      C616B0        syn-C2H3C(O)NH2, v=0
  866135.8799  0.0035 -2.9131 3  616.8900113  71510 303563323      553224        syn-C2H3C(O)NH2, v=0
  866135.8799  0.0035 -2.9131 3  616.8900113  71510 303563324      553223        syn-C2H3C(O)NH2, v=0
  866183.9158  0.0021 -4.7211 3  203.7384 75  71510 303371622      361323        syn-C2H3C(O)NH2, v=0
  866200.9298  0.0032 -3.0432 3  660.3446125  71510 303623032      612933        syn-C2H3C(O)NH2, v=0
  866200.9298  0.0032 -3.0432 3  660.3446125  71510 303623033      612932        syn-C2H3C(O)NH2, v=0
  866208.2356  0.1937 -5.3640 3 1980.8706253  71510 303C617A9      C518A8        syn-C2H3C(O)NH2, v=0
  866208.2356  0.1937 -5.3640 3 1980.8706253  71510 303C618A9      C517A8        syn-C2H3C(O)NH2, v=0
  866234.3790  0.0095 -3.5404 3  828.8988153  71510 303762453      752352        syn-C2H3C(O)NH2, v=0
  866251.3121  0.0021 -4.7211 3  203.7362 75  71510 303371621      361324        syn-C2H3C(O)NH2, v=0
  866294.2258  0.0032 -2.9524 3  629.8341117  71510 303583226      573127        syn-C2H3C(O)NH2, v=0
  866294.2258  0.0032 -2.9524 3  629.8341117  71510 303583227      573126        syn-C2H3C(O)NH2, v=0
  866331.0540  0.0031 -2.9957 3  644.3122121  71510 303603129      593030        syn-C2H3C(O)NH2, v=0
  866331.0540  0.0031 -2.9957 3  644.3122121  71510 303603130      593029        syn-C2H3C(O)NH2, v=0
  866455.1039  0.1876 -5.3656 3 1971.0109251  71510 303C518A7      C419A6        syn-C2H3C(O)NH2, v=0
  866455.1039  0.1876 -5.3656 3 1971.0109251  71510 303C519A7      C418A6        syn-C2H3C(O)NH2, v=0
  866566.4538  0.1277 -5.3515 3 1808.6949231  71510 303B52789      B42688        syn-C2H3C(O)NH2, v=0
  866649.6620  0.0095 -3.5400 3  828.8874153  71510 303762452      752353        syn-C2H3C(O)NH2, v=0
  866665.1961  0.1426 -5.3657 3 1853.6899235  71510 303B72592      B62691        syn-C2H3C(O)NH2, v=0
  866671.0968  0.1454 -4.8089 3 1413.6922203  71510 303A12676      A02575        syn-C2H3C(O)NH2, v=0
  866778.5000  0.1816 -5.3674 3 1960.5197249  71510 303C419A5      C320A4        syn-C2H3C(O)NH2, v=0
  866778.5000  0.1816 -5.3674 3 1960.5197249  71510 303C420A5      C319A4        syn-C2H3C(O)NH2, v=0
  866902.0950  0.0039 -4.2349 3  291.4420103  71510 30351 546      50 447        syn-C2H3C(O)NH2, v=0
  866902.0966  0.0039 -4.2349 3  291.4420103  71510 30351 646      50 347        syn-C2H3C(O)NH2, v=0
  866958.8284  0.1420 -5.3654 3 1853.6838235  71510 303B72692      B62591        syn-C2H3C(O)NH2, v=0
  866977.3727  0.0032 -3.7365 3  437.4767117  71510 303581346      571047        syn-C2H3C(O)NH2, v=0
  867005.4794  0.0433 -5.5433 3 1201.1470185  71510 303922766      922469        syn-C2H3C(O)NH2, v=0
  867036.1008  0.0133 -3.7149 3  878.4480159  71510 303792356      782257        syn-C2H3C(O)NH2, v=0
  867198.6893  0.0031 -5.0799 3  501.0510115  71510 303572334      572037        syn-C2H3C(O)NH2, v=0
  867199.8192  0.1758 -5.3697 3 1949.3749247  71510 303C320A3      C221A2        syn-C2H3C(O)NH2, v=0
  867199.8193  0.1758 -5.3697 3 1949.3749247  71510 303C321A3      C220A2        syn-C2H3C(O)NH2, v=0
  867203.5224  0.0031 -5.0799 3  501.0508115  71510 303572335      572038        syn-C2H3C(O)NH2, v=0
  867748.2583  0.1701 -5.3728 3 1937.5500245  71510 303C221A1      C122A0        syn-C2H3C(O)NH2, v=0
  867748.2611  0.1701 -5.3728 3 1937.5500245  71510 303C222A1      C121A0        syn-C2H3C(O)NH2, v=0
  867817.0105  0.0094 -5.1714 3  705.1696147  71510 303731558      731261        syn-C2H3C(O)NH2, v=0
  868050.3112  0.0030 -5.1861 3  193.5230 77  71510 303381326      37 829        syn-C2H3C(O)NH2, v=0
  868073.2667  0.1411 -5.3934 3 1837.6005233  71510 303B62690      B52789        syn-C2H3C(O)NH2, v=0
  868313.8797  0.0093 -5.1710 3  705.1696147  71510 303731658      731361        syn-C2H3C(O)NH2, v=0
  868465.0088  0.1646 -5.3772 3 1925.0114243  71510 303C12299      C02398        syn-C2H3C(O)NH2, v=0
  868465.0638  0.1646 -5.3772 3 1925.0114243  71510 303C12399      C02298        syn-C2H3C(O)NH2, v=0
  868469.4063  0.0459 -5.3099 3  935.7004167  71510 303831964      831667        syn-C2H3C(O)NH2, v=0
  868778.5662  0.0050 -5.0674 3  683.6599137  71510 303682444      682147        syn-C2H3C(O)NH2, v=0
  868786.9961  0.0060 -3.3198 3  758.0823143  71510 303712646      702545        syn-C2H3C(O)NH2, v=0
  868787.1939  0.0060 -3.3198 3  758.0822143  71510 303712645      702546        syn-C2H3C(O)NH2, v=0
  869202.8164  0.0050 -5.0670 3  683.6457137  71510 303682445      682148        syn-C2H3C(O)NH2, v=0
  869410.4539  0.1593 -5.3837 3 1911.7160241  71510 303C02397      B92496        syn-C2H3C(O)NH2, v=0
  869411.4021  0.1593 -5.3837 3 1911.7159241  71510 303C02497      B92396        syn-C2H3C(O)NH2, v=0
  869880.1471  0.0261 -5.3252 3 1011.6089169  71510 303842659      842362        syn-C2H3C(O)NH2, v=0
  869886.6190  0.0127 -5.1685 3  839.1776153  71510 303762551      762254        syn-C2H3C(O)NH2, v=0
  869927.0982  0.0057 -5.3736 3  178.8114 77  71510 303381029      37 532        syn-C2H3C(O)NH2, v=0
  870140.9291  0.0072 -5.1679 3  211.9498 83  71510 303411031      40 734        syn-C2H3C(O)NH2, v=0
  870242.1940  0.0033 -4.1008 3  311.5779105  71510 30352 646      51 547        syn-C2H3C(O)NH2, v=0
  870242.2125  0.0033 -4.1008 3  311.5779105  71510 30352 746      51 447        syn-C2H3C(O)NH2, v=0
  870328.0721  0.0188 -2.7280 3  576.8170 83  71510 3034141 0      4040 1        syn-C2H3C(O)NH2, v=0
  870328.0721  0.0188 -2.7280 3  576.8170 83  71510 3034141 1      4040 0        syn-C2H3C(O)NH2, v=0
  870500.4111  0.0260 -3.8657 3  842.5706157  71510 303782157      772058        syn-C2H3C(O)NH2, v=0
  870572.8185  0.0031 -5.0967 3  486.8343113  71510 303562333      562036        syn-C2H3C(O)NH2, v=0
  870575.2630  0.0031 -5.0967 3  486.8342113  71510 303562334      562037        syn-C2H3C(O)NH2, v=0
  870593.6365  0.0040 -5.0079 3  207.9842 81  71510 303401229      39 732        syn-C2H3C(O)NH2, v=0
  870673.9518  0.1542 -5.3932 3 1897.6062239  71510 303B92495      B82594        syn-C2H3C(O)NH2, v=0
  870688.1341  0.1541 -5.3932 3 1897.6059239  71510 303B92595      B82494        syn-C2H3C(O)NH2, v=0
  870776.5286  0.0153 -2.7439 3  578.3783 87  71510 3034340 3      4239 4        syn-C2H3C(O)NH2, v=0
  870776.5286  0.0153 -2.7439 3  578.3783 87  71510 3034340 4      4239 3        syn-C2H3C(O)NH2, v=0
  870780.1690  0.0050 -3.2465 3  734.9224139  71510 303692743      682642        syn-C2H3C(O)NH2, v=0
  870780.1725  0.0050 -3.2465 3  734.9224139  71510 303692742      682643        syn-C2H3C(O)NH2, v=0
  870852.4897  0.0021 -4.6724 3  212.9783 77  71510 303381623      371324        syn-C2H3C(O)NH2, v=0
  870887.9891  0.1657 -5.4815 3 1849.4783233  71510 303B62789      B52888        syn-C2H3C(O)NH2, v=0
  870908.5561  0.0030 -3.7649 3  415.9702115  71510 303571146      561047        syn-C2H3C(O)NH2, v=0
  870985.4728  0.0021 -4.6723 3  212.9739 77  71510 303381622      371325        syn-C2H3C(O)NH2, v=0
  870988.5027  0.0070 -5.1263 3  242.5290 99  71510 30349 247      48 148        syn-C2H3C(O)NH2, v=0
  870988.5027  0.0070 -5.1263 3  242.5290 99  71510 30349 347      48 048        syn-C2H3C(O)NH2, v=0
  871095.1276  0.1350 -5.3902 3 1837.5391233  71510 303B62790      B52689        syn-C2H3C(O)NH2, v=0
  871216.5827  0.0124 -2.7623 3  581.4021 91  71510 3034539 6      4438 7        syn-C2H3C(O)NH2, v=0
  871216.5827  0.0124 -2.7623 3  581.4021 91  71510 3034539 7      4438 6        syn-C2H3C(O)NH2, v=0
  871251.8137  0.0021 -5.2528 3  152.6604 61  71510 303301714      291415        syn-C2H3C(O)NH2, v=0
  871251.8247  0.0021 -5.2528 3  152.6604 61  71510 303301713      291416        syn-C2H3C(O)NH2, v=0
  871286.4495  0.0030 -3.7646 3  415.9699115  71510 303571246      56 947        syn-C2H3C(O)NH2, v=0
  871603.8381  0.2510 -5.3991 3 2062.2902269  71510 303D410C4      D311C3        syn-C2H3C(O)NH2, v=0
  871603.8381  0.2510 -5.3991 3 2062.2902269  71510 303D411C4      D310C3        syn-C2H3C(O)NH2, v=0
  871605.6912  0.2590 -5.3954 3 2067.5617271  71510 303D5 9C6      D410C5        syn-C2H3C(O)NH2, v=0
  871605.6912  0.2590 -5.3954 3 2067.5617271  71510 303D510C6      D4 9C5        syn-C2H3C(O)NH2, v=0
  871613.1646  0.2433 -5.4022 3 2056.4754267  71510 303D311C2      D212C1        syn-C2H3C(O)NH2, v=0
  871613.1646  0.2433 -5.4022 3 2056.4754267  71510 303D312C2      D211C1        syn-C2H3C(O)NH2, v=0
  871615.8491  0.2677 -5.3912 3 2072.2953273  71510 303D6 8C8      D5 9C7        syn-C2H3C(O)NH2, v=0
  871615.8491  0.2677 -5.3912 3 2072.2953273  71510 303D6 9C8      D5 8C7        syn-C2H3C(O)NH2, v=0
  871631.8710  0.2771 -5.3863 3 2076.4957275  71510 303D7 7D0      D6 8C9        syn-C2H3C(O)NH2, v=0
  871631.8710  0.2771 -5.3863 3 2076.4957275  71510 303D7 8D0      D6 7C9        syn-C2H3C(O)NH2, v=0
  871637.0845  0.2360 -5.4048 3 2050.1112265  71510 303D212C0      D113B9        syn-C2H3C(O)NH2, v=0
  871637.0845  0.2360 -5.4048 3 2050.1112265  71510 303D213C0      D112B9        syn-C2H3C(O)NH2, v=0
  871644.0172  0.0099 -2.7835 3  585.8930 95  71510 3034738 9      463710        syn-C2H3C(O)NH2, v=0
  871644.0172  0.0099 -2.7835 3  585.8930 95  71510 303473810      4637 9        syn-C2H3C(O)NH2, v=0
  871651.6694  0.2875 -5.3808 3 2080.1670277  71510 303D8 6D2      D7 7D1        syn-C2H3C(O)NH2, v=0
  871651.6694  0.2875 -5.3808 3 2080.1670277  71510 303D8 7D2      D7 6D1        syn-C2H3C(O)NH2, v=0
  871673.4464  0.2990 -5.3747 3 2083.3130279  71510 303D9 5D4      D8 6D3        syn-C2H3C(O)NH2, v=0
  871673.4464  0.2990 -5.3747 3 2083.3130279  71510 303D9 6D4      D8 5D3        syn-C2H3C(O)NH2, v=0
  871673.9769  0.0104 -3.5807 3  848.0842155  71510 303772454      762353        syn-C2H3C(O)NH2, v=0
  871679.6856  0.2290 -5.4070 3 2043.1906263  71510 303D113B8      D014B7        syn-C2H3C(O)NH2, v=0
  871679.6856  0.2290 -5.4070 3 2043.1906263  71510 303D114B8      D013B7        syn-C2H3C(O)NH2, v=0
  871695.6427  0.3121 -5.3679 3 2085.9368281  71510 303E0 4D6      D9 5D5        syn-C2H3C(O)NH2, v=0
  871695.6427  0.3121 -5.3679 3 2085.9368281  71510 303E0 5D6      D9 4D5        syn-C2H3C(O)NH2, v=0
  871716.8974  0.3270 -5.3604 3 2088.0413283  71510 303E1 3D8      E0 4D7        syn-C2H3C(O)NH2, v=0
  871716.8974  0.3270 -5.3604 3 2088.0413283  71510 303E1 4D8      E0 3D7        syn-C2H3C(O)NH2, v=0
  871736.0146  0.3440 -5.3521 3 2089.6290285  71510 303E2 2E0      E1 3D9        syn-C2H3C(O)NH2, v=0
  871736.0146  0.3440 -5.3521 3 2089.6290285  71510 303E2 3E0      E1 2D9        syn-C2H3C(O)NH2, v=0
  871745.9091  0.2221 -5.4088 3 2035.7056261  71510 303D014B6      C915B5        syn-C2H3C(O)NH2, v=0
  871745.9091  0.2221 -5.4088 3 2035.7056261  71510 303D015B6      C914B5        syn-C2H3C(O)NH2, v=0
  871751.9372  0.3636 -5.3432 3 2090.7020287  71510 303E3 1E2      E2 2E1        syn-C2H3C(O)NH2, v=0
  871751.9372  0.3636 -5.3432 3 2090.7020287  71510 303E3 2E2      E2 1E1        syn-C2H3C(O)NH2, v=0
  871763.7246  0.3861 -5.3334 3 2091.2623289  71510 303E4 0E4      E3 1E3        syn-C2H3C(O)NH2, v=0
  871763.7246  0.3861 -5.3334 3 2091.2623289  71510 303E4 1E4      E3 0E3        syn-C2H3C(O)NH2, v=0
  871806.8844  0.0044 -5.5291 3  418.9623119  71510 30359 851      59 554        syn-C2H3C(O)NH2, v=0
  871806.9521  0.0044 -5.5291 3  418.9623119  71510 30359 951      59 654        syn-C2H3C(O)NH2, v=0
  871841.7901  0.2154 -5.4104 3 2027.6470259  71510 303C915B4      C816B3        syn-C2H3C(O)NH2, v=0
  871841.7901  0.2154 -5.4104 3 2027.6470259  71510 303C916B4      C815B3        syn-C2H3C(O)NH2, v=0
  871907.8946  0.0080 -3.4383 3  801.3364149  71510 303742550      732449        syn-C2H3C(O)NH2, v=0
  871923.1098  0.0080 -3.4383 3  801.3360149  71510 303742549      732450        syn-C2H3C(O)NH2, v=0
  871974.7852  0.2089 -5.4117 3 2019.0040257  71510 303C816B2      C717B1        syn-C2H3C(O)NH2, v=0
  871974.7852  0.2089 -5.4117 3 2019.0040257  71510 303C817B2      C716B1        syn-C2H3C(O)NH2, v=0
  872048.4794  0.0043 -3.1809 3  713.4922135  71510 303672839      662740        syn-C2H3C(O)NH2, v=0
  872048.4794  0.0043 -3.1809 3  713.4922135  71510 303672840      662739        syn-C2H3C(O)NH2, v=0
  872053.0684  0.0079 -2.8074 3  591.8566 99  71510 303493712      483613        syn-C2H3C(O)NH2, v=0
  872053.0684  0.0079 -2.8074 3  591.8566 99  71510 303493713      483612        syn-C2H3C(O)NH2, v=0
  872154.2297  0.2024 -5.4128 3 2009.7642255  71510 303C717B0      C618A9        syn-C2H3C(O)NH2, v=0
  872154.2297  0.2024 -5.4128 3 2009.7642255  71510 303C718B0      C617A9        syn-C2H3C(O)NH2, v=0
  872346.9363  0.1494 -5.4079 3 1882.6025237  71510 303B82593      B72692        syn-C2H3C(O)NH2, v=0
  872386.2791  0.0105 -3.5800 3  848.0649155  71510 303772453      762354        syn-C2H3C(O)NH2, v=0
  872391.9900  0.1961 -5.4141 3 1999.9128253  71510 303C618A8      C519A7        syn-C2H3C(O)NH2, v=0
  872391.9900  0.1961 -5.4141 3 1999.9128253  71510 303C619A8      C518A7        syn-C2H3C(O)NH2, v=0
  872435.9320  0.0063 -2.8343 3  599.2991103  71510 303513615      503516        syn-C2H3C(O)NH2, v=0
  872435.9320  0.0063 -2.8343 3  599.2991103  71510 303513616      503515        syn-C2H3C(O)NH2, v=0
  872528.2825  0.1490 -5.4077 3 1882.5987237  71510 303B82693      B72592        syn-C2H3C(O)NH2, v=0
  872627.6784  0.0451 -4.1793 3 1079.5834177  71510 303882465      872364        syn-C2H3C(O)NH2, v=0
  872703.4203  0.1899 -5.4155 3 1989.4323251  71510 303C519A6      C420A5        syn-C2H3C(O)NH2, v=0
  872703.4204  0.1899 -5.4155 3 1989.4323251  71510 303C520A6      C419A5        syn-C2H3C(O)NH2, v=0
  872757.0614  0.0029 -3.9977 3  331.9791107  71510 30353 746      52 647        syn-C2H3C(O)NH2, v=0
  872757.2422  0.0029 -3.9977 3  331.9791107  71510 30353 846      52 547        syn-C2H3C(O)NH2, v=0
  872782.0963  0.0051 -2.8643 3  608.2286107  71510 303533518      523419        syn-C2H3C(O)NH2, v=0
  872782.0963  0.0051 -2.8643 3  608.2286107  71510 303533519      523418        syn-C2H3C(O)NH2, v=0
  872823.0942  0.0038 -3.1218 3  693.7297131  71510 303652936      642837        syn-C2H3C(O)NH2, v=0
  872823.0942  0.0038 -3.1218 3  693.7297131  71510 303652937      642836        syn-C2H3C(O)NH2, v=0
  872823.2471  0.0040 -4.2613 3  333.5162 99  71510 303491634      481335        syn-C2H3C(O)NH2, v=0
  872865.8858  0.0070 -5.1814 3  660.5748143  71510 303711457      711160        syn-C2H3C(O)NH2, v=0
  872877.5448  0.0038 -3.8845 3  493.2085121  71510 303601744      591445        syn-C2H3C(O)NH2, v=0
  872987.0244  0.0212 -5.2208 3  816.7153157  71510 303781761      781464        syn-C2H3C(O)NH2, v=0
  873036.1591  0.0070 -5.1813 3  660.5748143  71510 303711557      711260        syn-C2H3C(O)NH2, v=0
  873077.4253  0.0042 -2.8976 3  618.6542111  71510 303553421      543322        syn-C2H3C(O)NH2, v=0
  873077.4253  0.0042 -2.8976 3  618.6542111  71510 303553422      543321        syn-C2H3C(O)NH2, v=0
  873108.8142  0.1839 -5.4174 3 1978.3016249  71510 303C420A4      C321A3        syn-C2H3C(O)NH2, v=0
  873108.8142  0.1839 -5.4174 3 1978.3016249  71510 303C421A4      C320A3        syn-C2H3C(O)NH2, v=0
  873251.2910  0.0034 -3.0682 3  675.5891127  71510 303633033      622934        syn-C2H3C(O)NH2, v=0
  873251.2910  0.0034 -3.0682 3  675.5891127  71510 303633034      622933        syn-C2H3C(O)NH2, v=0
  873273.2972  0.1666 -5.0777 3 1583.2554215  71510 303A72781      A62680        syn-C2H3C(O)NH2, v=0
  873302.8799  0.0036 -2.9344 3  630.5874115  71510 303573324      563225        syn-C2H3C(O)NH2, v=0
  873302.8799  0.0036 -2.9344 3  630.5874115  71510 303573325      563224        syn-C2H3C(O)NH2, v=0
  873318.5057  0.0073 -5.4058 3  187.6150 79  71510 30339 930      38 633        syn-C2H3C(O)NH2, v=0
  873431.6970  0.0033 -3.0194 3  659.0356123  71510 303613130      603031        syn-C2H3C(O)NH2, v=0
  873431.6970  0.0033 -3.0194 3  659.0356123  71510 303613131      603030        syn-C2H3C(O)NH2, v=0
  873432.6926  0.0033 -2.9749 3  644.0422119  71510 303593227      583128        syn-C2H3C(O)NH2, v=0
  873432.6926  0.0033 -2.9749 3  644.0422119  71510 303593228      583127        syn-C2H3C(O)NH2, v=0
  873631.7734  0.0119 -5.1653 3  839.0524153  71510 303762552      762255        syn-C2H3C(O)NH2, v=0
  873635.6933  0.1780 -5.4200 3 1966.4950247  71510 303C321A2      C222A1        syn-C2H3C(O)NH2, v=0
  873635.6949  0.1780 -5.4200 3 1966.4950247  71510 303C322A2      C221A1        syn-C2H3C(O)NH2, v=0
  873731.5048  0.0031 -5.1151 3  472.8826111  71510 303552332      552035        syn-C2H3C(O)NH2, v=0
  873732.7197  0.0031 -5.1151 3  472.8825111  71510 303552333      552036        syn-C2H3C(O)NH2, v=0
  873755.2281  0.0425 -5.5206 3 1177.6513183  71510 303912765      912468        syn-C2H3C(O)NH2, v=0
  873756.1199  0.0028 -3.8032 3  394.6461113  71510 303561046      55 947        syn-C2H3C(O)NH2, v=0
  873824.7934  0.0028 -3.8031 3  394.6461113  71510 303561146      55 847        syn-C2H3C(O)NH2, v=0
  873886.6361  0.0035 -3.8418 3  508.6850123  71510 303611745      601446        syn-C2H3C(O)NH2, v=0
  873942.6750  0.0598 -5.4784 3 1109.5275177  71510 303882761      882464        syn-C2H3C(O)NH2, v=0
  874026.7650  0.0030 -5.0925 3  203.0959 79  71510 303391327      38 830        syn-C2H3C(O)NH2, v=0
  874030.5936  0.1466 -5.4321 3 1866.5957235  71510 303B72691      B62790        syn-C2H3C(O)NH2, v=0
  874207.4236  0.0153 -3.7643 3  898.5652161  71510 303802357      792258        syn-C2H3C(O)NH2, v=0
  874314.8355  0.0027 -3.9169 3  352.6336109  71510 30354 846      53 747        syn-C2H3C(O)NH2, v=0
  874316.3438  0.0027 -3.9169 3  352.6336109  71510 30354 946      53 647        syn-C2H3C(O)NH2, v=0
  874322.5922  0.1723 -5.4238 3 1953.9803245  71510 303C222A0      C12399        syn-C2H3C(O)NH2, v=0
  874322.6235  0.1723 -5.4238 3 1953.9803245  71510 303C223A0      C12299        syn-C2H3C(O)NH2, v=0
  874329.3401  0.1009 -5.5644 3 1195.7184187  71510 303932470      932173        syn-C2H3C(O)NH2, v=0
  874363.5162  0.0036 -3.7403 3  517.9111125  71510 303621647      611348        syn-C2H3C(O)NH2, v=0
  874510.7106  0.2645 -5.5435 3 1811.7942173  71510 303866323      866224        syn-C2H3C(O)NH2, v=0
  874510.7106  0.2645 -5.5435 3 1811.7942173  71510 303866324      866225        syn-C2H3C(O)NH2, v=0
  874620.4793  0.0672 -5.3905 3 1008.4844173  71510 303862066      861769        syn-C2H3C(O)NH2, v=0
  874687.3111  0.0046 -5.0691 3  666.5228135  71510 303672443      672146        syn-C2H3C(O)NH2, v=0
  874736.3663  0.0027 -3.8531 3  373.5278111  71510 30355 946      54 847        syn-C2H3C(O)NH2, v=0
  874740.0678  0.2647 -5.5166 3 1790.9494171  71510 303856322      856223        syn-C2H3C(O)NH2, v=0
  874740.0678  0.2647 -5.5166 3 1790.9494171  71510 303856323      856224        syn-C2H3C(O)NH2, v=0
  874747.2667  0.0027 -3.8531 3  373.5278111  71510 303551046      54 747        syn-C2H3C(O)NH2, v=0
  874931.0799  0.0046 -5.0689 3  666.5147135  71510 303672444      672147        syn-C2H3C(O)NH2, v=0
  874950.7746  0.0045 -5.4240 3  456.0973123  71510 30361 952      61 655        syn-C2H3C(O)NH2, v=0
  874951.0766  0.0045 -5.4240 3  456.0973123  71510 303611052      61 755        syn-C2H3C(O)NH2, v=0
  874963.7643  0.2650 -5.4910 3 1770.3487169  71510 303846321      846222        syn-C2H3C(O)NH2, v=0
  874963.7643  0.2650 -5.4910 3 1770.3487169  71510 303846322      846223        syn-C2H3C(O)NH2, v=0
  875109.3629  0.0046 -4.3036 3  321.4369 99  71510 303491435      481138        syn-C2H3C(O)NH2, v=0
  875181.9074  0.2652 -5.4667 3 1749.9921167  71510 303836320      836221        syn-C2H3C(O)NH2, v=0
  875181.9074  0.2652 -5.4667 3 1749.9921167  71510 303836321      836222        syn-C2H3C(O)NH2, v=0
  875200.0463  0.0022 -4.6260 3  222.4866 79  71510 303391624      381325        syn-C2H3C(O)NH2, v=0
  875225.5508  0.1668 -5.4295 3 1940.7164243  71510 303C12398      C02497        syn-C2H3C(O)NH2, v=0
  875226.1025  0.1668 -5.4295 3 1940.7164243  71510 303C12498      C02397        syn-C2H3C(O)NH2, v=0
  875235.9192  0.0203 -5.2189 3  816.7154157  71510 303781861      781564        syn-C2H3C(O)NH2, v=0
  875291.8571  0.0032 -4.2144 3  326.9804 99  71510 303491534      481237        syn-C2H3C(O)NH2, v=0
  875321.8551  0.0067 -3.3522 3  775.7682145  71510 303722647      712546        syn-C2H3C(O)NH2, v=0
  875322.2494  0.0067 -3.3522 3  775.7682145  71510 303722646      712547        syn-C2H3C(O)NH2, v=0
  875394.6027  0.2656 -5.4439 3 1729.8795165  71510 303826319      826220        syn-C2H3C(O)NH2, v=0
  875394.6027  0.2656 -5.4439 3 1729.8795165  71510 303826320      826221        syn-C2H3C(O)NH2, v=0
  875450.3136  0.0042 -3.9389 3  477.8825119  71510 303591743      581444        syn-C2H3C(O)NH2, v=0
  875455.5079  0.0022 -4.6258 3  222.4781 79  71510 303391623      381326        syn-C2H3C(O)NH2, v=0
  875507.4989  0.0685 -5.4190 3 1062.0595177  71510 303882267      881970        syn-C2H3C(O)NH2, v=0
  875581.6483  0.0036 -3.7290 3  495.6538123  71510 303611547      601248        syn-C2H3C(O)NH2, v=0
  875601.9544  0.2659 -5.4227 3 1710.0109163  71510 303816318      816219        syn-C2H3C(O)NH2, v=0
  875601.9544  0.2659 -5.4227 3 1710.0109163  71510 303816319      816220        syn-C2H3C(O)NH2, v=0
  875804.0652  0.2663 -5.4031 3 1690.3862161  71510 303806317      806218        syn-C2H3C(O)NH2, v=0
  875804.0652  0.2663 -5.4031 3 1690.3862161  71510 303806318      806219        syn-C2H3C(O)NH2, v=0
  875967.6858  0.1424 -5.4301 3 1866.5563235  71510 303B72791      B62690        syn-C2H3C(O)NH2, v=0
  875996.9503  0.0083 -3.8060 3  588.4347133  71510 303661650      651551        syn-C2H3C(O)NH2, v=0
  876001.0364  0.2668 -5.3853 3 1671.0054159  71510 303796316      796217        syn-C2H3C(O)NH2, v=0
  876001.0364  0.2668 -5.3853 3 1671.0054159  71510 303796317      796218        syn-C2H3C(O)NH2, v=0
  876077.5208  0.0058 -5.2021 3  617.2009139  71510 303691356      691059        syn-C2H3C(O)NH2, v=0
  876132.3881  0.0058 -5.2020 3  617.2009139  71510 303691456      691159        syn-C2H3C(O)NH2, v=0
  876192.9680  0.2673 -5.3695 3 1651.8683157  71510 303786315      786216        syn-C2H3C(O)NH2, v=0
  876192.9680  0.2673 -5.3695 3 1651.8683157  71510 303786316      786217        syn-C2H3C(O)NH2, v=0
  876223.3249  0.0238 -3.8581 3  890.4350161  71510 303802258      792159        syn-C2H3C(O)NH2, v=0
  876292.0882  0.0058 -4.6893 3  262.2120101  71510 30350 347      49 248        syn-C2H3C(O)NH2, v=0
  876292.0882  0.0058 -4.6893 3  262.2120101  71510 30350 447      49 148        syn-C2H3C(O)NH2, v=0
  876379.9584  0.2678 -5.3559 3 1632.9750155  71510 303776314      776215        syn-C2H3C(O)NH2, v=0
  876379.9584  0.2678 -5.3559 3 1632.9750155  71510 303776315      776216        syn-C2H3C(O)NH2, v=0
  876397.2781  0.0037 -3.7399 3  473.4508121  71510 303601347      591248        syn-C2H3C(O)NH2, v=0
  876427.9551  0.1614 -5.4380 3 1926.6489241  71510 303C02496      B92595        syn-C2H3C(O)NH2, v=0
  876436.4152  0.1614 -5.4379 3 1926.6487241  71510 303C02596      B92495        syn-C2H3C(O)NH2, v=0
  876443.7483  0.0261 -3.8900 3  795.9718153  71510 303762056      751957        syn-C2H3C(O)NH2, v=0
  876562.1046  0.2683 -5.3447 3 1614.3253153  71510 303766313      766214        syn-C2H3C(O)NH2, v=0
  876562.1046  0.2683 -5.3447 3 1614.3253153  71510 303766314      766215        syn-C2H3C(O)NH2, v=0
  876689.1154  0.0031 -5.1352 3  459.1948109  71510 303542331      542034        syn-C2H3C(O)NH2, v=0
  876689.7086  0.0031 -5.1352 3  459.1948109  71510 303542332      542035        syn-C2H3C(O)NH2, v=0
  876739.5024  0.2689 -5.3361 3 1595.9193151  71510 303756312      756213        syn-C2H3C(O)NH2, v=0
  876739.5024  0.2689 -5.3361 3 1595.9193151  71510 303756313      756214        syn-C2H3C(O)NH2, v=0
  876855.8738  0.0114 -3.6224 3  867.5548157  71510 303782455      772354        syn-C2H3C(O)NH2, v=0
  876868.3334  0.0162 -3.8656 3  688.5314143  71510 303711853      701754        syn-C2H3C(O)NH2, v=0
  876912.2460  0.2695 -5.3306 3 1577.7569149  71510 303746311      746212        syn-C2H3C(O)NH2, v=0
  876912.2460  0.2695 -5.3306 3 1577.7569149  71510 303746312      746213        syn-C2H3C(O)NH2, v=0
  877045.3684  0.0048 -5.3427 3  494.4970127  71510 303631053      63 756        syn-C2H3C(O)NH2, v=0
  877046.6060  0.0048 -5.3427 3  494.4970127  71510 303631153      63 856        syn-C2H3C(O)NH2, v=0
  877080.4284  0.2702 -5.3285 3 1559.8379147  71510 303736310      736211        syn-C2H3C(O)NH2, v=0
  877080.4284  0.2702 -5.3285 3 1559.8379147  71510 303736311      736212        syn-C2H3C(O)NH2, v=0
  877131.7597  0.0401 -5.3032 3  935.7012167  71510 303832064      831767        syn-C2H3C(O)NH2, v=0
  877186.6426  0.0272 -5.3057 3  969.3817165  71510 303822656      822359        syn-C2H3C(O)NH2, v=0
  877244.1413  0.2709 -5.3305 3 1542.1624145  71510 3037263 9      726210        syn-C2H3C(O)NH2, v=0
  877244.1413  0.2709 -5.3305 3 1542.1624145  71510 303726310      726211        syn-C2H3C(O)NH2, v=0
  877403.4747  0.2716 -5.3373 3 1524.7303143  71510 3037163 8      7162 9        syn-C2H3C(O)NH2, v=0
  877403.4747  0.2716 -5.3373 3 1524.7303143  71510 3037163 9      716210        syn-C2H3C(O)NH2, v=0
  877510.3363  0.0056 -3.2768 3  752.0409141  71510 303702744      692643        syn-C2H3C(O)NH2, v=0
  877510.3436  0.0056 -3.2768 3  752.0409141  71510 303702743      692644        syn-C2H3C(O)NH2, v=0
  877558.5178  0.2723 -5.3500 3 1507.5416141  71510 3037063 7      7062 8        syn-C2H3C(O)NH2, v=0
  877558.5178  0.2723 -5.3500 3 1507.5416141  71510 3037063 8      7062 9        syn-C2H3C(O)NH2, v=0
  877567.4016  0.0186 -2.7426 3  586.7750 85  71510 3034241 1      4140 2        syn-C2H3C(O)NH2, v=0
  877567.4016  0.0186 -2.7426 3  586.7750 85  71510 3034241 2      4140 1        syn-C2H3C(O)NH2, v=0
  877574.8310  0.2617 -5.4498 3 2091.3637271  71510 303D510C5      D411C4        syn-C2H3C(O)NH2, v=0
  877574.8310  0.2617 -5.4498 3 2091.3637271  71510 303D511C5      D410C4        syn-C2H3C(O)NH2, v=0
  877577.8851  0.2701 -5.4463 3 2096.6353273  71510 303D6 9C7      D510C6        syn-C2H3C(O)NH2, v=0
  877577.8851  0.2701 -5.4463 3 2096.6353273  71510 303D610C7      D5 9C6        syn-C2H3C(O)NH2, v=0
  877582.3515  0.0020 -5.1793 3  160.0521 63  71510 303311715      301416        syn-C2H3C(O)NH2, v=0
  877582.3812  0.0020 -5.1793 3  160.0521 63  71510 303311714      301417        syn-C2H3C(O)NH2, v=0
  877582.6162  0.2538 -5.4528 3 2085.5493269  71510 303D411C3      D312C2        syn-C2H3C(O)NH2, v=0
  877582.6162  0.2538 -5.4528 3 2085.5493269  71510 303D412C3      D311C2        syn-C2H3C(O)NH2, v=0
  877588.9722  0.2791 -5.4422 3 2101.3692275  71510 303D7 8C9      D6 9C8        syn-C2H3C(O)NH2, v=0
  877588.9722  0.2791 -5.4422 3 2101.3692275  71510 303D7 9C9      D6 8C8        syn-C2H3C(O)NH2, v=0
  877604.5663  0.2462 -5.4553 3 2079.1859267  71510 303D312C1      D213C0        syn-C2H3C(O)NH2, v=0
  877604.5663  0.2462 -5.4553 3 2079.1859267  71510 303D313C1      D212C0        syn-C2H3C(O)NH2, v=0
  877605.7055  0.2889 -5.4375 3 2105.5702277  71510 303D8 7D1      D7 8D0        syn-C2H3C(O)NH2, v=0
  877605.7055  0.2889 -5.4375 3 2105.5702277  71510 303D8 8D1      D7 7D0        syn-C2H3C(O)NH2, v=0
  877626.0397  0.2996 -5.4321 3 2109.2422279  71510 303D9 6D3      D8 7D2        syn-C2H3C(O)NH2, v=0
  877626.0397  0.2996 -5.4321 3 2109.2422279  71510 303D9 7D3      D8 6D2        syn-C2H3C(O)NH2, v=0
  877644.6549  0.2389 -5.4573 3 2072.2667265  71510 303D213B9      D114B8        syn-C2H3C(O)NH2, v=0
  877644.6549  0.2389 -5.4573 3 2072.2667265  71510 303D214B9      D113B8        syn-C2H3C(O)NH2, v=0
  877648.2105  0.3116 -5.4261 3 2112.3889281  71510 303E0 5D5      D9 6D4        syn-C2H3C(O)NH2, v=0
  877648.2105  0.3116 -5.4261 3 2112.3889281  71510 303E0 6D5      D9 5D4        syn-C2H3C(O)NH2, v=0
  877670.6851  0.3251 -5.4194 3 2115.0135283  71510 303E1 4D7      E0 5D6        syn-C2H3C(O)NH2, v=0
  877670.6851  0.3251 -5.4194 3 2115.0135283  71510 303E1 5D7      E0 4D6        syn-C2H3C(O)NH2, v=0
  877692.1234  0.3405 -5.4119 3 2117.1187285  71510 303E2 3D9      E1 4D8        syn-C2H3C(O)NH2, v=0
  877692.1234  0.3405 -5.4119 3 2117.1187285  71510 303E2 4D9      E1 3D8        syn-C2H3C(O)NH2, v=0
  877707.6746  0.2319 -5.4589 3 2064.7840263  71510 303D114B7      D015B6        syn-C2H3C(O)NH2, v=0
  877707.6746  0.2319 -5.4589 3 2064.7840263  71510 303D115B7      D014B6        syn-C2H3C(O)NH2, v=0
  877709.3581  0.2730 -5.3699 3 1490.5961139  71510 3036963 6      6962 7        syn-C2H3C(O)NH2, v=0
  877709.3581  0.2730 -5.3699 3 1490.5961139  71510 3036963 7      6962 8        syn-C2H3C(O)NH2, v=0
  877711.3464  0.3581 -5.4038 3 2118.7070287  71510 303E3 2E1      E2 3E0        syn-C2H3C(O)NH2, v=0
  877711.3464  0.3581 -5.4038 3 2118.7070287  71510 303E3 3E1      E2 2E0        syn-C2H3C(O)NH2, v=0
  877727.3101  0.3783 -5.3949 3 2119.7806289  71510 303E4 1E3      E3 2E2        syn-C2H3C(O)NH2, v=0
  877727.3101  0.3783 -5.3949 3 2119.7806289  71510 303E4 2E3      E3 1E2        syn-C2H3C(O)NH2, v=0
  877728.9636  0.0053 -5.2345 3  575.0573135  71510 303671255      67 958        syn-C2H3C(O)NH2, v=0
  877739.0841  0.4015 -5.3852 3 2120.3412291  71510 303E5 0E5      E4 1E4        syn-C2H3C(O)NH2, v=0
  877739.0841  0.4015 -5.3852 3 2120.3412291  71510 303E5 1E5      E4 0E4        syn-C2H3C(O)NH2, v=0
  877745.5576  0.0053 -5.2345 3  575.0573135  71510 303671355      671058        syn-C2H3C(O)NH2, v=0
  877799.4634  0.2249 -5.4602 3 2056.7285261  71510 303D015B5      C916B4        syn-C2H3C(O)NH2, v=0
  877799.4634  0.2249 -5.4602 3 2056.7285261  71510 303D016B5      C915B4        syn-C2H3C(O)NH2, v=0
  877856.0819  0.2738 -5.3992 3 1473.8939137  71510 3036863 5      6862 6        syn-C2H3C(O)NH2, v=0
  877856.0819  0.2738 -5.3992 3 1473.8939137  71510 3036863 6      6862 7        syn-C2H3C(O)NH2, v=0
  877927.2149  0.2181 -5.4613 3 2048.0900259  71510 303C916B3      C817B2        syn-C2H3C(O)NH2, v=0
  877927.2149  0.2181 -5.4613 3 2048.0900259  71510 303C917B3      C816B2        syn-C2H3C(O)NH2, v=0
  877998.7741  0.2746 -5.4412 3 1457.4350135  71510 3036763 4      6762 5        syn-C2H3C(O)NH2, v=0
  877998.7741  0.2746 -5.4412 3 1457.4350135  71510 3036763 5      6762 6        syn-C2H3C(O)NH2, v=0
  878006.3814  0.0050 -5.2806 3  534.1531131  71510 303651154      65 857        syn-C2H3C(O)NH2, v=0
  878011.0771  0.0050 -5.2806 3  534.1531131  71510 303651254      65 957        syn-C2H3C(O)NH2, v=0
  878013.7183  0.0152 -2.7593 3  588.8283 89  71510 3034440 4      4339 5        syn-C2H3C(O)NH2, v=0
  878013.7183  0.0152 -2.7593 3  588.8283 89  71510 3034440 5      4339 4        syn-C2H3C(O)NH2, v=0
  878031.0726  0.1564 -5.4510 3 1911.7031239  71510 303B92594      B82693        syn-C2H3C(O)NH2, v=0
  878058.5441  0.0088 -3.4743 3  819.8834151  71510 303752551      742450        syn-C2H3C(O)NH2, v=0
  878060.4479  0.0116 -3.6214 3  867.5223157  71510 303782454      772355        syn-C2H3C(O)NH2, v=0
  878086.5443  0.0088 -3.4743 3  819.8826151  71510 303752550      742451        syn-C2H3C(O)NH2, v=0
  878099.9066  0.2115 -5.4622 3 2038.8561257  71510 303C817B1      C718B0        syn-C2H3C(O)NH2, v=0
  878099.9066  0.2115 -5.4622 3 2038.8561257  71510 303C818B1      C717B0        syn-C2H3C(O)NH2, v=0
  878137.5186  0.2754 -5.5014 3 1441.2191133  71510 3036663 3      6662 4        syn-C2H3C(O)NH2, v=0
  878137.5186  0.2754 -5.5014 3 1441.2191133  71510 3036663 4      6662 5        syn-C2H3C(O)NH2, v=0
  878142.4205  0.1562 -5.4509 3 1911.7008239  71510 303B92694      B82593        syn-C2H3C(O)NH2, v=0
  878300.0838  0.0964 -5.4811 3 1083.8760179  71510 303892168      891871        syn-C2H3C(O)NH2, v=0
  878328.9091  0.2049 -5.4631 3 2029.0126255  71510 303C718A9      C619A8        syn-C2H3C(O)NH2, v=0
  878328.9091  0.2049 -5.4631 3 2029.0126255  71510 303C719A9      C618A8        syn-C2H3C(O)NH2, v=0
  878450.4299  0.0123 -2.7785 3  592.3455 93  71510 3034639 7      4538 8        syn-C2H3C(O)NH2, v=0
  878450.4299  0.0123 -2.7785 3  592.3455 93  71510 3034639 8      4538 7        syn-C2H3C(O)NH2, v=0
  878469.9429  0.0072 -5.3622 3  611.8731133  71510 303662046      661551        syn-C2H3C(O)NH2, v=0
  878518.1158  0.0034 -3.8126 3  524.3061125  71510 303621746      611447        syn-C2H3C(O)NH2, v=0
  878628.8740  0.1985 -5.4642 3 2018.5425253  71510 303C619A7      C520A6        syn-C2H3C(O)NH2, v=0
  878628.8740  0.1985 -5.4642 3 2018.5425253  71510 303C620A7      C519A6        syn-C2H3C(O)NH2, v=0
  878666.6725  0.0241 -5.3108 3  990.1857167  71510 303832658      832361        syn-C2H3C(O)NH2, v=0
  878694.9916  0.1629 -5.5134 3 1878.7492235  71510 303B72790      B62889        syn-C2H3C(O)NH2, v=0
  878810.0709  0.0098 -5.3670 3  621.3691135  71510 303671948      671453        syn-C2H3C(O)NH2, v=0
  878872.9515  0.0099 -2.8005 3  597.3313 97  71510 303483810      473711        syn-C2H3C(O)NH2, v=0
  878872.9515  0.0099 -2.8005 3  597.3313 97  71510 303483811      473710        syn-C2H3C(O)NH2, v=0
  878908.4743  0.0078 -5.3454 3  628.8230135  71510 303672047      671552        syn-C2H3C(O)NH2, v=0
  878914.0839  0.0048 -3.2095 3  730.0594137  71510 303682841      672740        syn-C2H3C(O)NH2, v=0
  878914.0840  0.0048 -3.2095 3  730.0594137  71510 303682840      672741        syn-C2H3C(O)NH2, v=0
  878939.6171  0.0110 -5.1606 3  819.8541151  71510 303752550      752253        syn-C2H3C(O)NH2, v=0
  879019.0711  0.1923 -5.4657 3 2007.4254251  71510 303C520A5      C421A4        syn-C2H3C(O)NH2, v=0
  879019.0712  0.1923 -5.4657 3 2007.4254251  71510 303C521A5      C420A4        syn-C2H3C(O)NH2, v=0
  879168.4902  0.0023 -4.5819 3  232.2662 81  71510 303401625      391326        syn-C2H3C(O)NH2, v=0
  879275.0535  0.0079 -2.8253 3  603.7915101  71510 303503713      493614        syn-C2H3C(O)NH2, v=0
  879275.0535  0.0079 -2.8253 3  603.7915101  71510 303503714      493613        syn-C2H3C(O)NH2, v=0
  879458.6100  0.0031 -5.1571 3  445.7698107  71510 303532330      532033        syn-C2H3C(O)NH2, v=0
  879458.8943  0.0031 -5.1571 3  445.7698107  71510 303532331      532034        syn-C2H3C(O)NH2, v=0
  879525.4787  0.1862 -5.4678 3 1995.6363249  71510 303C421A3      C322A2        syn-C2H3C(O)NH2, v=0
  879525.4796  0.1862 -5.4678 3 1995.6363249  71510 303C422A3      C321A2        syn-C2H3C(O)NH2, v=0
  879646.5134  0.0023 -4.5815 3  232.2503 81  71510 303401624      391327        syn-C2H3C(O)NH2, v=0
  879648.3384  0.0063 -2.8532 3  611.7329105  71510 303523616      513517        syn-C2H3C(O)NH2, v=0
  879648.3384  0.0063 -2.8532 3  611.7329105  71510 303523617      513516        syn-C2H3C(O)NH2, v=0
  879771.4402  0.0037 -4.2969 3  320.9904 97  71510 303481633      471334        syn-C2H3C(O)NH2, v=0
  879786.1125  0.0041 -3.1488 3  709.7576133  71510 303662937      652838        syn-C2H3C(O)NH2, v=0
  879786.1125  0.0041 -3.1488 3  709.7576133  71510 303662938      652837        syn-C2H3C(O)NH2, v=0
  879848.3384  0.1527 -5.4722 3 1895.7754237  71510 303B82692      B72791        syn-C2H3C(O)NH2, v=0
  879981.5318  0.0051 -2.8842 3  621.1636109  71510 303543519      533420        syn-C2H3C(O)NH2, v=0
  879981.5318  0.0051 -2.8842 3  621.1636109  71510 303543520      533419        syn-C2H3C(O)NH2, v=0
  880167.9214  0.0042 -5.0722 3  649.6642133  71510 303662442      662145        syn-C2H3C(O)NH2, v=0
  880184.2051  0.1803 -5.4710 3 1983.1446247  71510 303C322A1      C223A0        syn-C2H3C(O)NH2, v=0
  880184.2229  0.1803 -5.4710 3 1983.1446247  71510 303C323A1      C222A0        syn-C2H3C(O)NH2, v=0
  880259.5071  0.0043 -2.9185 3  632.0934113  71510 303563422      553323        syn-C2H3C(O)NH2, v=0
  880259.5071  0.0043 -2.9185 3  632.0934113  71510 303563423      553322        syn-C2H3C(O)NH2, v=0
  880286.0022  0.0037 -3.0938 3  691.0869129  71510 303643034      632935        syn-C2H3C(O)NH2, v=0
  880286.0022  0.0037 -3.0938 3  691.0869129  71510 303643035      632934        syn-C2H3C(O)NH2, v=0
  880301.2623  0.0100 -5.4385 3  580.6408131  71510 303651847      651352        syn-C2H3C(O)NH2, v=0
  880305.8321  0.0042 -5.0720 3  649.6596133  71510 303662443      662146        syn-C2H3C(O)NH2, v=0
  880461.9200  0.0037 -2.9563 3  644.5342117  71510 303583325      573226        syn-C2H3C(O)NH2, v=0
  880461.9200  0.0037 -2.9563 3  644.5342117  71510 303583326      573225        syn-C2H3C(O)NH2, v=0
  880519.9420  0.0035 -3.0436 3  674.0107125  71510 303623131      613032        syn-C2H3C(O)NH2, v=0
  880519.9420  0.0035 -3.0436 3  674.0107125  71510 303623132      613031        syn-C2H3C(O)NH2, v=0
  880561.2534  0.0035 -2.9980 3  658.5007121  71510 303603228      593129        syn-C2H3C(O)NH2, v=0
  880561.2534  0.0035 -2.9980 3  658.5007121  71510 303603229      593128        syn-C2H3C(O)NH2, v=0
  881011.5340  0.0911 -4.4757 3 1228.5845189  71510 303942570      932469        syn-C2H3C(O)NH2, v=0
  881032.9102  0.0048 -4.4292 3  282.1898103  71510 30351 447      50 348        syn-C2H3C(O)NH2, v=0
  881032.9102  0.0048 -4.4292 3  282.1898103  71510 30351 547      50 248        syn-C2H3C(O)NH2, v=0
  881047.3339  0.1745 -5.4759 3 1969.9108245  71510 303C22399      C12498        syn-C2H3C(O)NH2, v=0
  881047.6537  0.1745 -5.4759 3 1969.9108245  71510 303C22499      C12398        syn-C2H3C(O)NH2, v=0
  881080.4456  0.1499 -5.4709 3 1895.7503237  71510 303B82792      B72691        syn-C2H3C(O)NH2, v=0
  881195.6836  0.0034 -3.7366 3  473.4464121  71510 303601447      591148        syn-C2H3C(O)NH2, v=0
  881240.5834  0.0047 -4.0008 3  462.7226117  71510 303581742      571443        syn-C2H3C(O)NH2, v=0
  881256.6945  0.0106 -5.1585 3  819.7767151  71510 303752551      752254        syn-C2H3C(O)NH2, v=0
  881514.2075  0.0412 -5.4995 3 1154.4046181  71510 303902764      902467        syn-C2H3C(O)NH2, v=0
  881698.3210  0.0124 -3.6658 3  887.3146159  71510 303792456      782355        syn-C2H3C(O)NH2, v=0
  881804.4407  0.0074 -3.3854 3  793.7192147  71510 303732648      722547        syn-C2H3C(O)NH2, v=0
  881805.2161  0.0074 -3.3854 3  793.7191147  71510 303732647      722548        syn-C2H3C(O)NH2, v=0
  882051.7701  0.0031 -5.1809 3  432.6067105  71510 303522329      522032        syn-C2H3C(O)NH2, v=0
  882051.9038  0.0031 -5.1809 3  432.6067105  71510 303522330      522033        syn-C2H3C(O)NH2, v=0
  882111.4869  0.0361 -4.1107 3 1056.8142175  71510 303872464      862363        syn-C2H3C(O)NH2, v=0
  882117.1413  0.1455 -4.7648 3 1387.3885201  71510 303A02675      992574        syn-C2H3C(O)NH2, v=0
  882120.5192  0.0148 -5.2110 3  769.0914153  71510 303761660      761363        syn-C2H3C(O)NH2, v=0
  882135.9264  0.0070 -5.3969 3  595.0743131  71510 303652045      651550        syn-C2H3C(O)NH2, v=0
  882192.3452  0.1690 -5.4834 3 1955.8835243  71510 303C12497      C02596        syn-C2H3C(O)NH2, v=0
  882197.3690  0.1690 -5.4834 3 1955.8834243  71510 303C12597      C02496        syn-C2H3C(O)NH2, v=0
  882425.2529  0.0181 -3.8165 3  918.9582163  71510 303812358      802259        syn-C2H3C(O)NH2, v=0
  882678.4236  0.0024 -4.5399 3  242.3208 83  71510 303411626      401327        syn-C2H3C(O)NH2, v=0
  882970.9487  0.0146 -5.2103 3  769.0914153  71510 303761760      761463        syn-C2H3C(O)NH2, v=0
  882999.3171  0.0031 -5.0240 3  212.8381 81  71510 303401328      39 831        syn-C2H3C(O)NH2, v=0
  883300.8952  0.0045 -3.7537 3  510.6102125  71510 303621448      611349        syn-C2H3C(O)NH2, v=0
  883368.0316  0.0087 -5.3457 3  645.9326137  71510 303682048      681553        syn-C2H3C(O)NH2, v=0
  883544.6990  0.2729 -5.5011 3 2120.6365273  71510 303D610C6      D511C5        syn-C2H3C(O)NH2, v=0
  883544.6990  0.2729 -5.5011 3 2120.6365273  71510 303D611C6      D510C5        syn-C2H3C(O)NH2, v=0
  883548.9306  0.2816 -5.4977 3 2125.9082275  71510 303D7 9C8      D610C7        syn-C2H3C(O)NH2, v=0
  883548.9306  0.2816 -5.4977 3 2125.9082275  71510 303D710C8      D6 9C7        syn-C2H3C(O)NH2, v=0
  883549.9384  0.0023 -4.5393 3  242.2917 83  71510 303411625      401328        syn-C2H3C(O)NH2, v=0
  883550.9760  0.2647 -5.5039 3 2114.8223271  71510 303D511C4      D412C3        syn-C2H3C(O)NH2, v=0
  883550.9760  0.2647 -5.5039 3 2114.8223271  71510 303D512C4      D411C3        syn-C2H3C(O)NH2, v=0
  883560.9307  0.2909 -5.4937 3 2130.6425277  71510 303D8 8D0      D7 9C9        syn-C2H3C(O)NH2, v=0
  883560.9307  0.2909 -5.4937 3 2130.6425277  71510 303D8 9D0      D7 8C9        syn-C2H3C(O)NH2, v=0
  883571.0025  0.2568 -5.5062 3 2108.4596269  71510 303D412C2      D313C1        syn-C2H3C(O)NH2, v=0
  883571.0025  0.2568 -5.5062 3 2108.4596269  71510 303D413C2      D312C1        syn-C2H3C(O)NH2, v=0
  883578.3641  0.3010 -5.4891 3 2134.8440279  71510 303D9 7D2      D8 8D1        syn-C2H3C(O)NH2, v=0
  883578.3641  0.3010 -5.4891 3 2134.8440279  71510 303D9 8D2      D8 7D1        syn-C2H3C(O)NH2, v=0
  883599.2268  0.3122 -5.4838 3 2138.5167281  71510 303E0 6D4      D9 7D3        syn-C2H3C(O)NH2, v=0
  883599.2268  0.3122 -5.4838 3 2138.5167281  71510 303E0 7D4      D9 6D3        syn-C2H3C(O)NH2, v=0
  883608.6428  0.2492 -5.5081 3 2101.5418267  71510 303D313C0      D214B9        syn-C2H3C(O)NH2, v=0
  883608.6428  0.2492 -5.5081 3 2101.5418267  71510 303D314C0      D213B9        syn-C2H3C(O)NH2, v=0
  883621.7867  0.3246 -5.4779 3 2141.6641283  71510 303E1 5D6      E0 6D5        syn-C2H3C(O)NH2, v=0
  883621.7867  0.3246 -5.4779 3 2141.6641283  71510 303E1 6D6      E0 5D5        syn-C2H3C(O)NH2, v=0
  883644.5366  0.3386 -5.4713 3 2144.2894285  71510 303E2 4D8      E1 5D7        syn-C2H3C(O)NH2, v=0
  883644.5366  0.3386 -5.4713 3 2144.2894285  71510 303E2 5D8      E1 4D7        syn-C2H3C(O)NH2, v=0
  883666.1571  0.3545 -5.4640 3 2146.3953287  71510 303E3 3E0      E2 4D9        syn-C2H3C(O)NH2, v=0
  883666.1571  0.3545 -5.4640 3 2146.3953287  71510 303E3 4E0      E2 3D9        syn-C2H3C(O)NH2, v=0
  883668.5471  0.2419 -5.5095 3 2094.0611265  71510 303D214B8      D115B7        syn-C2H3C(O)NH2, v=0
  883668.5471  0.2419 -5.5095 3 2094.0611265  71510 303D215B8      D114B7        syn-C2H3C(O)NH2, v=0
  883685.4851  0.3727 -5.4559 3 2147.9843289  71510 303E4 2E2      E3 3E1        syn-C2H3C(O)NH2, v=0
  883685.4851  0.3727 -5.4559 3 2147.9843289  71510 303E4 3E2      E3 2E1        syn-C2H3C(O)NH2, v=0
  883701.4894  0.3936 -5.4471 3 2149.0584291  71510 303E5 1E4      E4 2E3        syn-C2H3C(O)NH2, v=0
  883701.4894  0.3936 -5.4471 3 2149.0584291  71510 303E5 2E4      E4 1E3        syn-C2H3C(O)NH2, v=0
  883705.2012  0.0059 -3.7783 3  548.9421129  71510 303641549      631450        syn-C2H3C(O)NH2, v=0
  883706.0910  0.0127 -3.6641 3  887.2608159  71510 303792455      782356        syn-C2H3C(O)NH2, v=0
  883713.2500  0.4175 -5.4375 3 2149.6195293  71510 303E6 0E6      E5 1E5        syn-C2H3C(O)NH2, v=0
  883713.2500  0.4175 -5.4375 3 2149.6195293  71510 303E6 1E6      E5 0E5        syn-C2H3C(O)NH2, v=0
  883722.6795  0.1637 -5.4950 3 1940.9925241  71510 303C02595      B92694        syn-C2H3C(O)NH2, v=0
  883756.3660  0.2347 -5.5106 3 2086.0088263  71510 303D115B6      D016B5        syn-C2H3C(O)NH2, v=0
  883756.3660  0.2347 -5.5106 3 2086.0088263  71510 303D116B6      D015B5        syn-C2H3C(O)NH2, v=0
  883790.6697  0.1636 -5.4949 3 1940.9911241  71510 303C02695      B92594        syn-C2H3C(O)NH2, v=0
  883801.0749  0.0020 -5.1103 3  167.6986 65  71510 303321716      311417        syn-C2H3C(O)NH2, v=0
  883801.1517  0.0020 -5.1103 3  167.6986 65  71510 303321715      311418        syn-C2H3C(O)NH2, v=0
  883879.0431  0.2277 -5.5114 3 2077.3745261  71510 303D016B4      C917B3        syn-C2H3C(O)NH2, v=0
  883879.0431  0.2277 -5.5114 3 2077.3745261  71510 303D017B4      C916B3        syn-C2H3C(O)NH2, v=0
  884045.2173  0.2208 -5.5121 3 2068.1464259  71510 303C917B2      C818B1        syn-C2H3C(O)NH2, v=0
  884045.2173  0.2208 -5.5121 3 2068.1464259  71510 303C918B2      C817B1        syn-C2H3C(O)NH2, v=0
  884111.5474  0.0324 -5.2816 3  885.0829163  71510 303811863      811566        syn-C2H3C(O)NH2, v=0
  884117.3347  0.0097 -3.5113 3  838.7026153  71510 303762552      752451        syn-C2H3C(O)NH2, v=0
  884168.1864  0.0097 -3.5113 3  838.7012153  71510 303762551      752452        syn-C2H3C(O)NH2, v=0
  884203.4747  0.0062 -3.3078 3  769.4205143  71510 303712745      702644        syn-C2H3C(O)NH2, v=0
  884203.4902  0.0062 -3.3078 3  769.4205143  71510 303712744      702645        syn-C2H3C(O)NH2, v=0
  884265.7925  0.2141 -5.5127 3 2058.3105257  71510 303C818B0      C719A9        syn-C2H3C(O)NH2, v=0
  884265.7925  0.2141 -5.5127 3 2058.3105257  71510 303C819B0      C718A9        syn-C2H3C(O)NH2, v=0
  884479.3742  0.0031 -5.2067 3  419.7046103  71510 303512328      512031        syn-C2H3C(O)NH2, v=0
  884479.4359  0.0031 -5.2067 3  419.7046103  71510 303512329      512032        syn-C2H3C(O)NH2, v=0
  884554.7625  0.2074 -5.5135 3 2047.8504255  71510 303C719A8      C620A7        syn-C2H3C(O)NH2, v=0
  884554.7625  0.2074 -5.5135 3 2047.8504255  71510 303C720A8      C619A7        syn-C2H3C(O)NH2, v=0
  884636.2096  0.1831 -5.0424 3 1555.6159213  71510 303A62780      A52679        syn-C2H3C(O)NH2, v=0
  884805.1474  0.0184 -2.7577 3  596.9774 87  71510 3034341 2      4240 3        syn-C2H3C(O)NH2, v=0
  884805.1474  0.0184 -2.7577 3  596.9774 87  71510 3034341 3      4240 2        syn-C2H3C(O)NH2, v=0
  884811.9343  0.0034 -4.3291 3  308.7985 95  71510 303471632      461333        syn-C2H3C(O)NH2, v=0
  884930.4442  0.2010 -5.5145 3 2036.7463253  71510 303C620A6      C521A5        syn-C2H3C(O)NH2, v=0
  884930.4443  0.2010 -5.5145 3 2036.7463253  71510 303C621A6      C520A5        syn-C2H3C(O)NH2, v=0
  885149.4108  0.0040 -4.2493 3  302.4537105  71510 30352 547      51 448        syn-C2H3C(O)NH2, v=0
  885149.4116  0.0040 -4.2493 3  302.4537105  71510 30352 647      51 348        syn-C2H3C(O)NH2, v=0
  885248.9683  0.0151 -2.7751 3  599.5231 91  71510 3034540 5      4439 6        syn-C2H3C(O)NH2, v=0
  885248.9683  0.0151 -2.7751 3  599.5231 91  71510 3034540 6      4439 5        syn-C2H3C(O)NH2, v=0
  885269.8422  0.0039 -5.0765 3  633.0815131  71510 303652441      652144        syn-C2H3C(O)NH2, v=0
  885282.9918  0.0891 -5.5130 3 1139.2307183  71510 303912369      912072        syn-C2H3C(O)NH2, v=0
  885346.6703  0.0039 -5.0765 3  633.0789131  71510 303652442      652145        syn-C2H3C(O)NH2, v=0
  885417.3910  0.1947 -5.5162 3 2024.9742251  71510 303C521A4      C422A3        syn-C2H3C(O)NH2, v=0
  885417.3915  0.1947 -5.5162 3 2024.9742251  71510 303C522A4      C421A3        syn-C2H3C(O)NH2, v=0
  885583.2983  0.1594 -5.5137 3 1925.1399239  71510 303B92693      B82792        syn-C2H3C(O)NH2, v=0
  885620.1140  0.0025 -4.5001 3  252.6551 85  71510 303421627      411328        syn-C2H3C(O)NH2, v=0
  885621.1477  0.0032 -3.7559 3  451.3603119  71510 303591247      581148        syn-C2H3C(O)NH2, v=0
  885681.8942  0.0122 -2.7952 3  603.5340 95  71510 3034739 8      4638 9        syn-C2H3C(O)NH2, v=0
  885681.8942  0.0122 -2.7952 3  603.5340 95  71510 3034739 9      4638 8        syn-C2H3C(O)NH2, v=0
  885734.8279  0.1639 -5.5485 3 1908.2060237  71510 303B82791      B72890        syn-C2H3C(O)NH2, v=0
  885752.1673  0.0053 -3.2387 3  746.8847139  71510 303692842      682741        syn-C2H3C(O)NH2, v=0
  885752.1676  0.0053 -3.2387 3  746.8847139  71510 303692841      682742        syn-C2H3C(O)NH2, v=0
  886049.4920  0.1885 -5.5189 3 2012.5043249  71510 303C422A2      C323A1        syn-C2H3C(O)NH2, v=0
  886049.5020  0.1885 -5.5189 3 2012.5043249  71510 303C423A2      C322A1        syn-C2H3C(O)NH2, v=0
  886083.9625  0.0135 -3.7111 3  907.3692161  71510 303802457      792356        syn-C2H3C(O)NH2, v=0
  886098.9537  0.0098 -2.8180 3  609.0153 99  71510 303493811      483712        syn-C2H3C(O)NH2, v=0
  886098.9537  0.0098 -2.8180 3  609.0153 99  71510 303493812      483711        syn-C2H3C(O)NH2, v=0
  886361.3335  0.1575 -5.5129 3 1925.1240239  71510 303B92793      B82692        syn-C2H3C(O)NH2, v=0
  886413.9250  0.1388 -5.4274 3 1819.9107231  71510 303B52888      B42787        syn-C2H3C(O)NH2, v=0
  886493.4278  0.0079 -2.8437 3  615.9728103  71510 303513714      503615        syn-C2H3C(O)NH2, v=0
  886493.4278  0.0079 -2.8437 3  615.9728103  71510 303513715      503614        syn-C2H3C(O)NH2, v=0
  886538.2707  0.0036 -3.7963 3  540.0739127  71510 303631747      621448        syn-C2H3C(O)NH2, v=0
  886728.0551  0.0046 -3.1765 3  726.0411135  71510 303672938      662839        syn-C2H3C(O)NH2, v=0
  886728.0551  0.0046 -3.1765 3  726.0411135  71510 303672939      662838        syn-C2H3C(O)NH2, v=0
  886738.0874  0.0032 -3.7550 3  451.3596119  71510 303591347      581048        syn-C2H3C(O)NH2, v=0
  886751.3348  0.0031 -5.2345 3  407.0624101  71510 303502327      502030        syn-C2H3C(O)NH2, v=0
  886751.3626  0.0031 -5.2345 3  407.0624101  71510 303502328      502031        syn-C2H3C(O)NH2, v=0
  886856.2959  0.0063 -2.8725 3  624.4136107  71510 303533617      523518        syn-C2H3C(O)NH2, v=0
  886856.2959  0.0063 -2.8725 3  624.4136107  71510 303533618      523517        syn-C2H3C(O)NH2, v=0
  886875.2313  0.1826 -5.5230 3 1999.2993247  71510 303C323A0      C22499        syn-C2H3C(O)NH2, v=0
  886875.4160  0.1826 -5.5230 3 1999.2993247  71510 303C324A0      C22399        syn-C2H3C(O)NH2, v=0
  886881.6006  0.0035 -4.2173 3  339.2800101  71510 303501535      491238        syn-C2H3C(O)NH2, v=0
  887097.1833  0.0096 -5.1541 3  800.8299149  71510 303742549      742252        syn-C2H3C(O)NH2, v=0
  887168.1137  0.0024 -4.4990 3  252.6035 85  71510 303421626      411329        syn-C2H3C(O)NH2, v=0
  887175.4815  0.0052 -2.9045 3  634.3463111  71510 303553520      543421        syn-C2H3C(O)NH2, v=0
  887175.4815  0.0052 -2.9045 3  634.3463111  71510 303553521      543420        syn-C2H3C(O)NH2, v=0
  887179.6363  0.1474 -5.3917 3 1790.8025229  71510 303B42887      B32786        syn-C2H3C(O)NH2, v=0
  887304.2477  0.0041 -3.1200 3  706.8384131  71510 303653035      642936        syn-C2H3C(O)NH2, v=0
  887304.2477  0.0041 -3.1200 3  706.8384131  71510 303653036      642935        syn-C2H3C(O)NH2, v=0
  887404.2753  0.1377 -5.4641 3 1849.1486233  71510 303B62889      B52788        syn-C2H3C(O)NH2, v=0
  887434.8148  0.0044 -2.9399 3  645.7811115  71510 303573423      563324        syn-C2H3C(O)NH2, v=0
  887434.8148  0.0044 -2.9399 3  645.7811115  71510 303573424      563323        syn-C2H3C(O)NH2, v=0
  887436.5448  0.0220 -5.2974 3  969.0387165  71510 303822657      822360        syn-C2H3C(O)NH2, v=0
  887595.1464  0.0038 -3.0685 3  689.2380127  71510 303633132      623033        syn-C2H3C(O)NH2, v=0
  887595.1464  0.0038 -3.0685 3  689.2380127  71510 303633133      623032        syn-C2H3C(O)NH2, v=0
  887612.5739  0.0039 -2.9789 3  658.7306119  71510 303593326      583227        syn-C2H3C(O)NH2, v=0
  887612.5739  0.0039 -2.9789 3  658.7306119  71510 303593327      583226        syn-C2H3C(O)NH2, v=0
  887679.3893  0.0037 -3.0216 3  673.2099123  71510 303613229      603130        syn-C2H3C(O)NH2, v=0
  887679.3893  0.0037 -3.0216 3  673.2099123  71510 303613230      603129        syn-C2H3C(O)NH2, v=0
  887739.1317  0.0303 -5.2787 3  885.0832163  71510 303811963      811666        syn-C2H3C(O)NH2, v=0
  887766.3665  0.0556 -5.3809 3 1008.4859173  71510 303862166      861869        syn-C2H3C(O)NH2, v=0
  887842.6458  0.0026 -4.4623 3  263.2753 87  71510 303431628      421329        syn-C2H3C(O)NH2, v=0
  887917.0184  0.0032 -4.3605 3  296.9400 93  71510 303461631      451332        syn-C2H3C(O)NH2, v=0
  887966.4609  0.1768 -5.5296 3 1985.3103245  71510 303C22498      C12597        syn-C2H3C(O)NH2, v=0
  887969.4313  0.1768 -5.5296 3 1985.3102245  71510 303C22598      C12497        syn-C2H3C(O)NH2, v=0
  888230.8583  0.0082 -3.4194 3  811.9362149  71510 303742649      732548        syn-C2H3C(O)NH2, v=0
  888232.3626  0.0082 -3.4194 3  811.9361149  71510 303742648      732549        syn-C2H3C(O)NH2, v=0
  888506.9710  0.0094 -5.1528 3  800.7827149  71510 303742550      742253        syn-C2H3C(O)NH2, v=0
  888566.0503  0.0033 -4.1160 3  322.9943107  71510 30353 647      52 548        syn-C2H3C(O)NH2, v=0
  888566.0599  0.0033 -4.1160 3  322.9943107  71510 30353 747      52 448        syn-C2H3C(O)NH2, v=0
  888618.4010  0.0105 -5.2102 3  722.6698149  71510 303741559      741262        syn-C2H3C(O)NH2, v=0
  888876.8079  0.0031 -5.2644 3  394.6795 99  71510 303492326      492029        syn-C2H3C(O)NH2, v=0
  888876.8203  0.0031 -5.2644 3  394.6795 99  71510 303492327      492030        syn-C2H3C(O)NH2, v=0
  888882.0371  0.0287 -4.0433 3 1034.4118173  71510 303862463      852362        syn-C2H3C(O)NH2, v=0
  888921.1393  0.0105 -5.2099 3  722.6698149  71510 303741659      741362        syn-C2H3C(O)NH2, v=0
  888983.3351  0.2904 -5.5562 3 1799.5343169  71510 303846420      846321        syn-C2H3C(O)NH2, v=0
  888983.3351  0.2904 -5.5562 3 1799.5343169  71510 303846421      846322        syn-C2H3C(O)NH2, v=0
  889128.8566  0.0072 -5.1388 3  252.5317101  71510 30350 248      49 149        syn-C2H3C(O)NH2, v=0
  889128.8566  0.0072 -5.1388 3  252.5317101  71510 30350 348      49 049        syn-C2H3C(O)NH2, v=0
  889143.7548  0.0027 -4.4265 3  274.1894 89  71510 303441629      431330        syn-C2H3C(O)NH2, v=0
  889197.4618  0.2907 -5.5329 3 1779.1850167  71510 303836419      836320        syn-C2H3C(O)NH2, v=0
  889197.4618  0.2907 -5.5329 3 1779.1850167  71510 303836420      836321        syn-C2H3C(O)NH2, v=0
  889266.8092  0.0029 -4.3927 3  285.4072 91  71510 303451630      441331        syn-C2H3C(O)NH2, v=0
  889380.8684  0.0140 -3.7083 3  907.2815161  71510 303802456      792357        syn-C2H3C(O)NH2, v=0
  889406.3230  0.2911 -5.5112 3 1759.0795165  71510 303826418      826319        syn-C2H3C(O)NH2, v=0
  889406.3230  0.2911 -5.5112 3 1759.0795165  71510 303826419      826320        syn-C2H3C(O)NH2, v=0
  889416.3179  0.0229 -5.2904 3  948.3928163  71510 303812655      812358        syn-C2H3C(O)NH2, v=0
  889424.4187  0.1713 -5.5398 3 1970.4712243  71510 303C12596      C02695        syn-C2H3C(O)NH2, v=0
  889465.7150  0.1712 -5.5397 3 1970.4703243  71510 303C12696      C02595        syn-C2H3C(O)NH2, v=0
  889513.4314  0.2844 -5.5528 3 2150.1084275  71510 303D710C7      D611C6        syn-C2H3C(O)NH2, v=0
  889513.4314  0.2844 -5.5528 3 2150.1084275  71510 303D711C7      D610C6        syn-C2H3C(O)NH2, v=0
  889518.2320  0.2759 -5.5555 3 2144.2944273  71510 303D611C5      D512C4        syn-C2H3C(O)NH2, v=0
  889518.2320  0.2759 -5.5555 3 2144.2944273  71510 303D612C5      D511C4        syn-C2H3C(O)NH2, v=0
  889518.8180  0.2934 -5.5495 3 2155.3802277  71510 303D8 9C9      D710C8        syn-C2H3C(O)NH2, v=0
  889518.8180  0.2934 -5.5495 3 2155.3802277  71510 303D810C9      D7 9C8        syn-C2H3C(O)NH2, v=0
  889531.7152  0.3031 -5.5457 3 2160.1149279  71510 303D9 8D1      D8 9D0        syn-C2H3C(O)NH2, v=0
  889531.7152  0.3031 -5.5457 3 2160.1149279  71510 303D9 9D1      D8 8D0        syn-C2H3C(O)NH2, v=0
  889549.8381  0.3136 -5.5412 3 2164.3170281  71510 303E0 7D3      D9 8D2        syn-C2H3C(O)NH2, v=0
  889549.8381  0.3136 -5.5412 3 2164.3170281  71510 303E0 8D3      D9 7D2        syn-C2H3C(O)NH2, v=0
  889571.2221  0.3251 -5.5361 3 2167.9904283  71510 303E1 6D5      E0 7D4        syn-C2H3C(O)NH2, v=0
  889571.2221  0.3251 -5.5361 3 2167.9904283  71510 303E1 7D5      E0 6D4        syn-C2H3C(O)NH2, v=0
  889592.6150  0.0050 -4.0650 3  447.7525115  71510 303571741      561442        syn-C2H3C(O)NH2, v=0
  889594.1664  0.3380 -5.5302 3 2171.1386285  71510 303E2 5D7      E1 6D6        syn-C2H3C(O)NH2, v=0
  889594.1664  0.3380 -5.5302 3 2171.1386285  71510 303E2 6D7      E1 5D6        syn-C2H3C(O)NH2, v=0
  889610.0180  0.2915 -5.4911 3 1739.2178163  71510 303816417      816318        syn-C2H3C(O)NH2, v=0
  889610.0180  0.2915 -5.4911 3 1739.2178163  71510 303816418      816319        syn-C2H3C(O)NH2, v=0
  889617.1890  0.3525 -5.5237 3 2173.7646287  71510 303E3 4D9      E2 5D8        syn-C2H3C(O)NH2, v=0
  889617.1890  0.3525 -5.5237 3 2173.7646287  71510 303E3 5D9      E2 4D8        syn-C2H3C(O)NH2, v=0
  889638.9900  0.3690 -5.5165 3 2175.8713289  71510 303E4 3E1      E3 4E0        syn-C2H3C(O)NH2, v=0
  889638.9900  0.3690 -5.5165 3 2175.8713289  71510 303E4 4E1      E3 3E0        syn-C2H3C(O)NH2, v=0
  889658.4223  0.3878 -5.5085 3 2177.4609291  71510 303E5 2E3      E4 3E2        syn-C2H3C(O)NH2, v=0
  889658.4223  0.3878 -5.5085 3 2177.4609291  71510 303E5 3E3      E4 2E2        syn-C2H3C(O)NH2, v=0
  889674.4670  0.4093 -5.4998 3 2178.5355293  71510 303E6 1E5      E5 2E4        syn-C2H3C(O)NH2, v=0
  889674.4670  0.4093 -5.4998 3 2178.5355293  71510 303E6 2E5      E5 1E4        syn-C2H3C(O)NH2, v=0
  889686.2139  0.4339 -5.4903 3 2179.0970295  71510 303E7 0E7      E6 1E6        syn-C2H3C(O)NH2, v=0
  889686.2139  0.4339 -5.4903 3 2179.0970295  71510 303E7 1E7      E6 0E6        syn-C2H3C(O)NH2, v=0
  889723.0809  0.1416 -5.5020 3 1878.5280235  71510 303B72890      B62789        syn-C2H3C(O)NH2, v=0
  889808.6443  0.2920 -5.4729 3 1719.5999161  71510 303806416      806317        syn-C2H3C(O)NH2, v=0
  889808.6443  0.2920 -5.4729 3 1719.5999161  71510 303806417      806318        syn-C2H3C(O)NH2, v=0
  889846.6725  0.0146 -3.7586 3  927.7257163  71510 303812458      802357        syn-C2H3C(O)NH2, v=0
  889897.8152  0.0020 -5.0453 3  175.6007 67  71510 303331717      321418        syn-C2H3C(O)NH2, v=0
  889898.0065  0.0020 -5.0453 3  175.6007 67  71510 303331716      321419        syn-C2H3C(O)NH2, v=0
  889983.9339  0.0394 -5.4797 3 1131.4154179  71510 303892763      892466        syn-C2H3C(O)NH2, v=0
  889984.9321  0.0070 -5.4504 3  578.4194129  71510 303642044      641549        syn-C2H3C(O)NH2, v=0
  890002.2983  0.2925 -5.4566 3 1700.2256159  71510 303796415      796316        syn-C2H3C(O)NH2, v=0
  890002.2983  0.2925 -5.4566 3 1700.2256159  71510 303796416      796317        syn-C2H3C(O)NH2, v=0
  890031.9664  0.0037 -5.0822 3  616.7724129  71510 303642440      642143        syn-C2H3C(O)NH2, v=0
  890072.1213  0.0107 -3.5494 3  857.7957155  71510 303772553      762452        syn-C2H3C(O)NH2, v=0
  890074.1118  0.0037 -5.0822 3  616.7710129  71510 303642441      642144        syn-C2H3C(O)NH2, v=0
  890163.2667  0.0107 -3.5493 3  857.7932155  71510 303772552      762453        syn-C2H3C(O)NH2, v=0
  890171.1167  0.1644 -5.3567 3 1761.8119227  71510 303B32886      B22785        syn-C2H3C(O)NH2, v=0
  890191.0750  0.2931 -5.4425 3 1681.0950157  71510 303786414      786315        syn-C2H3C(O)NH2, v=0
  890191.0750  0.2931 -5.4425 3 1681.0950157  71510 303786415      786316        syn-C2H3C(O)NH2, v=0
  890375.0682  0.2937 -5.4308 3 1662.2079155  71510 303776413      776314        syn-C2H3C(O)NH2, v=0
  890375.0682  0.2937 -5.4308 3 1662.2079155  71510 303776414      776315        syn-C2H3C(O)NH2, v=0
  890465.4380  0.0030 -3.7832 3  429.4334117  71510 303581147      571048        syn-C2H3C(O)NH2, v=0
  890520.1191  0.0025 -4.4606 3  263.1862 87  71510 303431627      421330        syn-C2H3C(O)NH2, v=0
  890554.3701  0.2943 -5.4217 3 1643.5643153  71510 303766412      766313        syn-C2H3C(O)NH2, v=0
  890554.3701  0.2943 -5.4217 3 1643.5643153  71510 303766413      766314        syn-C2H3C(O)NH2, v=0
  890690.1703  0.0030 -3.7830 3  429.4332117  71510 303581247      57 948        syn-C2H3C(O)NH2, v=0
  890729.0719  0.2950 -5.4157 3 1625.1642151  71510 303756411      756312        syn-C2H3C(O)NH2, v=0
  890729.0719  0.2950 -5.4157 3 1625.1642151  71510 303756412      756313        syn-C2H3C(O)NH2, v=0
  890857.2584  0.0069 -3.3396 3  787.0619145  71510 303722746      712645        syn-C2H3C(O)NH2, v=0
  890857.2905  0.0069 -3.3396 3  787.0619145  71510 303722745      712646        syn-C2H3C(O)NH2, v=0
  890864.2840  0.0030 -5.2966 3  382.5550 97  71510 303482325      482028        syn-C2H3C(O)NH2, v=0
  890864.2894  0.0030 -5.2966 3  382.5550 97  71510 303482326      482029        syn-C2H3C(O)NH2, v=0
  890899.2633  0.2957 -5.4132 3 1607.0075149  71510 303746410      746311        syn-C2H3C(O)NH2, v=0
  890899.2633  0.2957 -5.4132 3 1607.0075149  71510 303746411      746312        syn-C2H3C(O)NH2, v=0
  890919.0444  0.0050 -5.1847 3  202.5302 81  71510 303401130      39 633        syn-C2H3C(O)NH2, v=0
  891021.7311  0.0491 -5.4558 3 1086.8070175  71510 303872760      872463        syn-C2H3C(O)NH2, v=0
  891065.0329  0.2964 -5.4147 3 1589.0942147  71510 3037364 9      736310        syn-C2H3C(O)NH2, v=0
  891065.0329  0.2964 -5.4147 3 1589.0942147  71510 303736410      736311        syn-C2H3C(O)NH2, v=0
  891188.2329  0.0029 -4.0136 3  343.8010109  71510 30354 747      53 648        syn-C2H3C(O)NH2, v=0
  891188.3286  0.0029 -4.0136 3  343.8010109  71510 30354 847      53 548        syn-C2H3C(O)NH2, v=0
  891226.4677  0.2971 -5.4211 3 1571.4241145  71510 3037264 8      7263 9        syn-C2H3C(O)NH2, v=0
  891226.4677  0.2971 -5.4211 3 1571.4241145  71510 3037264 9      726310        syn-C2H3C(O)NH2, v=0
  891320.8159  0.0038 -3.7528 3  533.3157127  71510 303631648      621349        syn-C2H3C(O)NH2, v=0
  891383.6539  0.2979 -5.4333 3 1553.9973143  71510 3037164 7      7163 8        syn-C2H3C(O)NH2, v=0
  891383.6539  0.2979 -5.4333 3 1553.9973143  71510 3037164 8      7163 9        syn-C2H3C(O)NH2, v=0
  891536.6761  0.2987 -5.4527 3 1536.8138141  71510 3037064 6      7063 7        syn-C2H3C(O)NH2, v=0
  891536.6761  0.2987 -5.4527 3 1536.8138141  71510 3037064 7      7063 8        syn-C2H3C(O)NH2, v=0
  891591.9289  0.0221 -2.7576 3  605.8480 85  71510 3034242 0      4141 1        syn-C2H3C(O)NH2, v=0
  891591.9289  0.0221 -2.7576 3  605.8480 85  71510 3034242 1      4141 0        syn-C2H3C(O)NH2, v=0
  891667.9761  0.0232 -3.9121 3  750.5866149  71510 303741955      731856        syn-C2H3C(O)NH2, v=0
  891685.6176  0.2995 -5.4816 3 1519.8734139  71510 3036964 5      6963 6        syn-C2H3C(O)NH2, v=0
  891685.6176  0.2995 -5.4816 3 1519.8734139  71510 3036964 6      6963 7        syn-C2H3C(O)NH2, v=0
  891829.9492  0.0100 -5.3622 3  663.2101139  71510 303692049      691554        syn-C2H3C(O)NH2, v=0
  891830.5608  0.3003 -5.5232 3 1503.1761137  71510 3036864 4      6863 5        syn-C2H3C(O)NH2, v=0
  891830.5608  0.3003 -5.5232 3 1503.1761137  71510 3036864 5      6863 6        syn-C2H3C(O)NH2, v=0
  892041.1917  0.0183 -2.7732 3  607.4242 89  71510 3034441 3      4340 4        syn-C2H3C(O)NH2, v=0
  892041.1917  0.0183 -2.7732 3  607.4242 89  71510 3034441 4      4340 3        syn-C2H3C(O)NH2, v=0
  892079.4183  0.0043 -5.0191 3  217.6297 83  71510 303411230      40 733        syn-C2H3C(O)NH2, v=0
  892156.3271  0.0220 -3.8722 3  939.6226165  71510 303822359      812260        syn-C2H3C(O)NH2, v=0
  892450.3180  0.0062 -4.5431 3  303.7472 97  71510 303481335      471038        syn-C2H3C(O)NH2, v=0
  892482.1405  0.0149 -2.7915 3  610.4627 93  71510 3034640 6      4539 7        syn-C2H3C(O)NH2, v=0
  892482.1405  0.0149 -2.7915 3  610.4627 93  71510 3034640 7      4539 6        syn-C2H3C(O)NH2, v=0
  892561.1645  0.0059 -3.2687 3  763.9685141  71510 303702843      692742        syn-C2H3C(O)NH2, v=0
  892561.1650  0.0059 -3.2687 3  763.9685141  71510 303702842      692743        syn-C2H3C(O)NH2, v=0
  892721.6627  0.0030 -5.3311 3  370.6882 95  71510 303472324      472027        syn-C2H3C(O)NH2, v=0
  892721.6649  0.0030 -5.3311 3  370.6882 95  71510 303472325      472028        syn-C2H3C(O)NH2, v=0
  892757.1964  0.0158 -3.8087 3  948.3928165  71510 303822459      812358        syn-C2H3C(O)NH2, v=0
  892839.7152  0.0028 -3.8211 3  407.6947115  71510 303571047      56 948        syn-C2H3C(O)NH2, v=0
  892879.2401  0.0028 -3.8210 3  407.6947115  71510 303571147      56 848        syn-C2H3C(O)NH2, v=0
  892894.3974  0.0028 -3.9336 3  364.8624111  71510 30355 847      54 748        syn-C2H3C(O)NH2, v=0
  892895.2172  0.0028 -3.9336 3  364.8623111  71510 30355 947      54 648        syn-C2H3C(O)NH2, v=0
  892910.8137  0.0121 -2.8123 3  614.9680 97  71510 3034839 9      473810        syn-C2H3C(O)NH2, v=0
  892910.8137  0.0121 -2.8123 3  614.9680 97  71510 303483910      4738 9        syn-C2H3C(O)NH2, v=0
  892992.5592  0.0232 -3.9789 3 1012.3780171  71510 303852462      842361        syn-C2H3C(O)NH2, v=0
  893016.6644  0.1483 -5.5410 3 1908.0593237  71510 303B82891      B72790        syn-C2H3C(O)NH2, v=0
  893071.8773  0.0079 -5.2189 3  677.4611145  71510 303721458      721161        syn-C2H3C(O)NH2, v=0
  893173.4087  0.0078 -5.2188 3  677.4611145  71510 303721558      721261        syn-C2H3C(O)NH2, v=0
  893321.8341  0.0098 -2.8361 3  620.9451101  71510 303503812      493713        syn-C2H3C(O)NH2, v=0
  893321.8341  0.0098 -2.8361 3  620.9451101  71510 303503813      493712        syn-C2H3C(O)NH2, v=0
  893390.8013  0.0312 -3.9255 3  910.8442163  71510 303812259      802160        syn-C2H3C(O)NH2, v=0
  893522.2760  0.0027 -3.8705 3  386.1653113  71510 30356 947      55 848        syn-C2H3C(O)NH2, v=0
  893528.3663  0.0027 -3.8705 3  386.1653113  71510 303561047      55 748        syn-C2H3C(O)NH2, v=0
  893642.4690  0.0047 -5.4545 3  469.9358125  71510 30362 953      62 656        syn-C2H3C(O)NH2, v=0
  893642.6323  0.0047 -5.4545 3  469.9358125  71510 303621053      62 756        syn-C2H3C(O)NH2, v=0
  893647.7939  0.0051 -3.2048 3  742.5806137  71510 303682939      672840        syn-C2H3C(O)NH2, v=0
  893647.7939  0.0051 -3.2048 3  742.5806137  71510 303682940      672839        syn-C2H3C(O)NH2, v=0
  893648.7262  0.0026 -4.4239 3  274.0395 89  71510 303441628      431331        syn-C2H3C(O)NH2, v=0
  893660.7130  0.0479 -5.3531 3  956.0718169  71510 303841965      841668        syn-C2H3C(O)NH2, v=0
  893707.9693  0.0078 -2.8627 3  628.4005105  71510 303523715      513616        syn-C2H3C(O)NH2, v=0
  893707.9693  0.0078 -2.8627 3  628.4005105  71510 303523716      513615        syn-C2H3C(O)NH2, v=0
  894059.5435  0.0063 -2.8925 3  637.3414109  71510 303543618      533519        syn-C2H3C(O)NH2, v=0
  894059.5435  0.0063 -2.8925 3  637.3414109  71510 303543619      533518        syn-C2H3C(O)NH2, v=0
  894305.1742  0.0045 -3.1469 3  722.8440133  71510 303663036      652937        syn-C2H3C(O)NH2, v=0
  894305.1742  0.0045 -3.1469 3  722.8440133  71510 303663037      652936        syn-C2H3C(O)NH2, v=0
  894311.1587  0.0120 -3.8575 3  646.1020139  71510 303691752      681653        syn-C2H3C(O)NH2, v=0
  894363.6371  0.0052 -2.9255 3  647.7769113  71510 303563521      553422        syn-C2H3C(O)NH2, v=0
  894363.6371  0.0052 -2.9255 3  647.7769113  71510 303563522      553421        syn-C2H3C(O)NH2, v=0
  894373.3895  0.0334 -3.9394 3  862.4277159  71510 303792158      782059        syn-C2H3C(O)NH2, v=0
  894449.6820  0.0060 -4.7026 3  272.6181103  71510 30351 348      50 249        syn-C2H3C(O)NH2, v=0
  894449.6820  0.0060 -4.7026 3  272.6181103  71510 30351 448      50 149        syn-C2H3C(O)NH2, v=0
  894456.3167  0.0030 -5.3682 3  359.0783 93  71510 303462323      462026        syn-C2H3C(O)NH2, v=0
  894456.3177  0.0030 -5.3682 3  359.0783 93  71510 303462324      462027        syn-C2H3C(O)NH2, v=0
  894485.6840  0.0035 -5.0893 3  600.7353127  71510 303632439      632142        syn-C2H3C(O)NH2, v=0
  894508.4487  0.0035 -5.0893 3  600.7346127  71510 303632440      632143        syn-C2H3C(O)NH2, v=0
  894511.7683  0.0174 -3.8618 3  969.3817167  71510 303832460      822359        syn-C2H3C(O)NH2, v=0
  894523.3481  0.0085 -5.1489 3  782.0981147  71510 303732548      732251        syn-C2H3C(O)NH2, v=0
  894596.7394  0.0090 -3.4543 3  830.4202151  71510 303752650      742549        syn-C2H3C(O)NH2, v=0
  894599.6202  0.0090 -3.4543 3  830.4201151  71510 303752649      742550        syn-C2H3C(O)NH2, v=0
  894602.9814  0.0045 -2.9619 3  659.7177117  71510 303583424      573325        syn-C2H3C(O)NH2, v=0
  894602.9814  0.0045 -2.9619 3  659.7177117  71510 303583425      573324        syn-C2H3C(O)NH2, v=0
  894656.6413  0.0041 -3.0941 3  704.7176129  71510 303643133      633034        syn-C2H3C(O)NH2, v=0
  894656.6413  0.0041 -3.0941 3  704.7176129  71510 303643134      633033        syn-C2H3C(O)NH2, v=0
  894732.4039  0.0197 -3.9184 3  990.7054169  71510 303842461      832360        syn-C2H3C(O)NH2, v=0
  894754.4004  0.0041 -3.0020 3  673.1768121  71510 303603327      593228        syn-C2H3C(O)NH2, v=0
  894754.4004  0.0041 -3.0020 3  673.1768121  71510 303603328      593227        syn-C2H3C(O)NH2, v=0
  894786.5625  0.0040 -3.0459 3  688.1701125  71510 303623230      613131        syn-C2H3C(O)NH2, v=0
  894786.5625  0.0040 -3.0459 3  688.1701125  71510 303623231      613130        syn-C2H3C(O)NH2, v=0
  894830.8653  0.0033 -4.9780 3  222.7552 83  71510 303411329      40 832        syn-C2H3C(O)NH2, v=0
  894980.9945  0.0036 -3.7472 3  510.5967125  71510 303621548      611249        syn-C2H3C(O)NH2, v=0
  895176.7035  0.0155 -3.7542 3  927.5850163  71510 303812457      802358        syn-C2H3C(O)NH2, v=0
  895308.2262  0.0230 -5.2622 3  835.6474159  71510 303791762      791465        syn-C2H3C(O)NH2, v=0
  895367.5262  0.0084 -5.1482 3  782.0699147  71510 303732549      732252        syn-C2H3C(O)NH2, v=0
  895596.4817  0.0068 -4.7722 3  275.1467 93  71510 303461234      45 937        syn-C2H3C(O)NH2, v=0
  895657.9677  0.4508 -5.5435 3 2208.7737297  71510 303E8 0E8      E7 1E7        syn-C2H3C(O)NH2, v=0
  895657.9677  0.4508 -5.5435 3 2208.7737297  71510 303E8 1E8      E7 0E7        syn-C2H3C(O)NH2, v=0
  895673.5482  0.0789 -4.4109 3 1204.0774187  71510 303932569      922468        syn-C2H3C(O)NH2, v=0
  895829.1688  0.1881 -5.3221 3 1732.9287225  71510 303B22885      B12784        syn-C2H3C(O)NH2, v=0
  895833.5402  0.0064 -5.2382 3  633.4751141  71510 303701357      701060        syn-C2H3C(O)NH2, v=0
  895861.4682  0.0020 -4.9841 3  183.7594 69  71510 303341718      331419        syn-C2H3C(O)NH2, v=0
  895861.9282  0.0020 -4.9841 3  183.7594 69  71510 303341717      331420        syn-C2H3C(O)NH2, v=0
  895865.5925  0.0064 -5.2382 3  633.4751141  71510 303701457      701160        syn-C2H3C(O)NH2, v=0
  895906.9048  0.0117 -3.5885 3  877.1646157  71510 303782554      772453        syn-C2H3C(O)NH2, v=0
  895927.5839  0.0050 -5.3746 3  508.9429129  71510 303641054      64 757        syn-C2H3C(O)NH2, v=0
  895928.2660  0.0050 -5.3746 3  508.9429129  71510 303641154      64 857        syn-C2H3C(O)NH2, v=0
  896044.9708  0.0199 -5.2850 3  948.1710163  71510 303812656      812359        syn-C2H3C(O)NH2, v=0
  896068.1371  0.0117 -3.5884 3  877.1602157  71510 303782553      772454        syn-C2H3C(O)NH2, v=0
  896075.1468  0.0030 -5.4080 3  347.7246 91  71510 303452322      452025        syn-C2H3C(O)NH2, v=0
  896075.1472  0.0030 -5.4080 3  347.7246 91  71510 303452323      452026        syn-C2H3C(O)NH2, v=0
  896627.7767  0.0027 -4.3890 3  285.1624 91  71510 303451629      441332        syn-C2H3C(O)NH2, v=0
  896730.8951  0.0223 -5.2611 3  835.6475159  71510 303791862      791565        syn-C2H3C(O)NH2, v=0
  897121.8281  0.0053 -5.3140 3  549.2073133  71510 303661155      66 858        syn-C2H3C(O)NH2, v=0
  897124.4659  0.0053 -5.3140 3  549.2073133  71510 303661255      66 958        syn-C2H3C(O)NH2, v=0
  897130.4408  0.0057 -5.2693 3  590.7208137  71510 303681256      68 959        syn-C2H3C(O)NH2, v=0
  897139.9448  0.0057 -5.2693 3  590.7208137  71510 303681356      681059        syn-C2H3C(O)NH2, v=0
  897469.1689  0.0076 -3.3722 3  804.9658147  71510 303732747      722646        syn-C2H3C(O)NH2, v=0
  897469.2346  0.0076 -3.3722 3  804.9658147  71510 303732746      722647        syn-C2H3C(O)NH2, v=0
  897539.6751  0.0038 -3.7913 3  555.9951129  71510 303641748      631449        syn-C2H3C(O)NH2, v=0
  897584.6283  0.0030 -5.4507 3  336.6265 89  71510 303442321      442024        syn-C2H3C(O)NH2, v=0
  897584.6284  0.0030 -5.4507 3  336.6265 89  71510 303442322      442025        syn-C2H3C(O)NH2, v=0
  897786.9457  0.0748 -5.4677 3 1083.8787179  71510 303892268      891971        syn-C2H3C(O)NH2, v=0
  898061.2418  0.0036 -3.7581 3  487.9550123  71510 303611348      601249        syn-C2H3C(O)NH2, v=0
  898555.4401  0.1391 -4.7129 3 1361.2900199  71510 303992674      982573        syn-C2H3C(O)NH2, v=0
  898617.9166  0.1933 -5.0026 3 1528.1080211  71510 303A52779      A42678        syn-C2H3C(O)NH2, v=0
  898656.9800  0.0034 -5.0977 3  584.9685125  71510 303622438      622141        syn-C2H3C(O)NH2, v=0
  898669.0862  0.0034 -5.0977 3  584.9680125  71510 303622439      622142        syn-C2H3C(O)NH2, v=0
  898828.2830  0.0219 -2.7729 3  616.0475 87  71510 3034342 1      4241 2        syn-C2H3C(O)NH2, v=0
  898828.2830  0.0219 -2.7729 3  616.0475 87  71510 3034342 2      4241 1        syn-C2H3C(O)NH2, v=0
  898891.9700  0.0372 -5.4609 3 1108.6912177  71510 303882762      882465        syn-C2H3C(O)NH2, v=0
  898990.8519  0.0030 -5.4964 3  325.7833 87  71510 303432320      432023        syn-C2H3C(O)NH2, v=0
  898990.8520  0.0030 -5.4964 3  325.7833 87  71510 303432321      432024        syn-C2H3C(O)NH2, v=0
  899222.2479  0.0049 -4.4434 3  292.9994105  71510 30352 448      51 349        syn-C2H3C(O)NH2, v=0
  899222.2479  0.0049 -4.4434 3  292.9994105  71510 30352 548      51 249        syn-C2H3C(O)NH2, v=0
  899275.4124  0.0181 -2.7893 3  618.1157 91  71510 3034541 4      4440 5        syn-C2H3C(O)NH2, v=0
  899275.4124  0.0181 -2.7893 3  618.1157 91  71510 3034541 5      4440 4        syn-C2H3C(O)NH2, v=0
  899339.4068  0.0065 -3.2993 3  781.3115143  71510 303712844      702743        syn-C2H3C(O)NH2, v=0
  899339.4079  0.0065 -3.2993 3  781.3115143  71510 303712843      702744        syn-C2H3C(O)NH2, v=0
  899367.4491  0.0053 -4.3666 3  333.5377101  71510 303501436      491139        syn-C2H3C(O)NH2, v=0
  899387.6325  0.0435 -5.3486 3  956.0723169  71510 303842065      841768        syn-C2H3C(O)NH2, v=0
  899399.9528  0.0116 -5.4283 3  638.1648137  71510 303681949      681454        syn-C2H3C(O)NH2, v=0
  899569.0243  0.0028 -4.3559 3  296.5528 93  71510 303461630      451333        syn-C2H3C(O)NH2, v=0
  899653.7737  0.0051 -4.1261 3  433.0015113  71510 303561740      551441        syn-C2H3C(O)NH2, v=0
  899713.0917  0.0148 -2.8083 3  621.6474 95  71510 3034740 7      4639 8        syn-C2H3C(O)NH2, v=0
  899713.0917  0.0148 -2.8083 3  621.6474 95  71510 3034740 8      4639 7        syn-C2H3C(O)NH2, v=0
  899858.1606  0.0057 -5.4160 3  187.6147 79  71510 303391030      38 533        syn-C2H3C(O)NH2, v=0
  900137.0210  0.0120 -2.8300 3  626.6473 99  71510 303493910      483811        syn-C2H3C(O)NH2, v=0
  900137.0210  0.0120 -2.8300 3  626.6473 99  71510 303493911      483810        syn-C2H3C(O)NH2, v=0
  900180.9686  0.0196 -5.2769 3  927.7257161  71510 303802654      802357        syn-C2H3C(O)NH2, v=0
  900299.5597  0.0030 -5.5454 3  315.1944 85  71510 303422319      422022        syn-C2H3C(O)NH2, v=0
  900299.5597  0.0030 -5.5454 3  315.1944 85  71510 303422320      422023        syn-C2H3C(O)NH2, v=0
  900541.3971  0.0097 -2.8546 3  633.1210103  71510 303513813      503714        syn-C2H3C(O)NH2, v=0
  900541.3971  0.0097 -2.8546 3  633.1210103  71510 303513814      503713        syn-C2H3C(O)NH2, v=0
  900544.1383  0.0056 -3.2338 3  759.3768139  71510 303692940      682841        syn-C2H3C(O)NH2, v=0
  900544.1383  0.0056 -3.2338 3  759.3768139  71510 303692941      682840        syn-C2H3C(O)NH2, v=0
  900897.1227  0.0100 -3.4901 3  849.1724153  71510 303762651      752550        syn-C2H3C(O)NH2, v=0
  900902.5681  0.0100 -3.4901 3  849.1723153  71510 303762650      752551        syn-C2H3C(O)NH2, v=0
  900918.4486  0.0079 -2.8822 3  641.0748107  71510 303533716      523617        syn-C2H3C(O)NH2, v=0
  900918.4486  0.0079 -2.8822 3  641.0748107  71510 303533717      523616        syn-C2H3C(O)NH2, v=0
  901119.6345  0.0033 -3.7560 3  487.9525123  71510 303611448      601149        syn-C2H3C(O)NH2, v=0
  901165.1007  0.0040 -4.2333 3  351.7920103  71510 303511536      501239        syn-C2H3C(O)NH2, v=0
  901233.1848  0.0172 -3.8019 3  948.1710165  71510 303822458      812359        syn-C2H3C(O)NH2, v=0
  901257.8117  0.0064 -2.9130 3  650.5166111  71510 303553619      543520        syn-C2H3C(O)NH2, v=0
  901257.8117  0.0064 -2.9130 3  650.5166111  71510 303553620      543519        syn-C2H3C(O)NH2, v=0
  901287.8875  0.0049 -3.1744 3  739.1041135  71510 303673037      662938        syn-C2H3C(O)NH2, v=0
  901287.8875  0.0049 -3.1744 3  739.1041135  71510 303673038      662937        syn-C2H3C(O)NH2, v=0
  901340.6015  0.0075 -5.1451 3  763.6537145  71510 303722547      722250        syn-C2H3C(O)NH2, v=0
  901385.4858  0.0691 -5.4347 3 1029.6760175  71510 303872067      871770        syn-C2H3C(O)NH2, v=0
  901545.6802  0.0053 -2.9470 3  661.4557115  71510 303573522      563423        syn-C2H3C(O)NH2, v=0
  901545.6802  0.0053 -2.9470 3  661.4557115  71510 303573523      563422        syn-C2H3C(O)NH2, v=0
  901594.4142  0.0023 -5.5317 3  145.4108 57  71510 303281810      271513        syn-C2H3C(O)NH2, v=0
  901594.4142  0.0023 -5.5317 3  145.4108 57  71510 303281811      271512        syn-C2H3C(O)NH2, v=0
  901599.9632  0.0128 -3.6289 3  896.8112159  71510 303792555      782454        syn-C2H3C(O)NH2, v=0
  901679.8298  0.0020 -4.9262 3  192.1759 71  71510 303351719      341420        syn-C2H3C(O)NH2, v=0
  901680.9001  0.0020 -4.9262 3  192.1758 71  71510 303351718      341421        syn-C2H3C(O)NH2, v=0
  901703.7298  0.0045 -3.1203 3  720.4501131  71510 303653134      643035        syn-C2H3C(O)NH2, v=0
  901703.7298  0.0045 -3.1203 3  720.4501131  71510 303653135      643034        syn-C2H3C(O)NH2, v=0
  901763.6279  0.0047 -2.9845 3  673.9033119  71510 303593425      583326        syn-C2H3C(O)NH2, v=0
  901763.6279  0.0047 -2.9845 3  673.9033119  71510 303593426      583325        syn-C2H3C(O)NH2, v=0
  901838.3479  0.0075 -5.1446 3  763.6371145  71510 303722548      722251        syn-C2H3C(O)NH2, v=0
  901881.4385  0.0129 -3.6286 3  896.8035159  71510 303792554      782455        syn-C2H3C(O)NH2, v=0
  901882.2146  0.0043 -3.0708 3  703.3817127  71510 303633231      623132        syn-C2H3C(O)NH2, v=0
  901882.2146  0.0043 -3.0708 3  703.3817127  71510 303633232      623131        syn-C2H3C(O)NH2, v=0
  901886.9428  0.0043 -3.0257 3  687.8730123  71510 303613328      603229        syn-C2H3C(O)NH2, v=0
  901886.9428  0.0043 -3.0257 3  687.8730123  71510 303613329      603228        syn-C2H3C(O)NH2, v=0
  901988.4843  0.0071 -5.5218 3  561.9055127  71510 303632043      631548        syn-C2H3C(O)NH2, v=0
  902567.8691  0.0033 -5.1075 3  569.4704123  71510 303612437      612140        syn-C2H3C(O)NH2, v=0
  902574.2064  0.0033 -5.1075 3  569.4702123  71510 303612438      612141        syn-C2H3C(O)NH2, v=0
  902627.3349  0.0028 -4.3249 3  308.2071 95  71510 303471631      461334        syn-C2H3C(O)NH2, v=0
  903388.3086  0.0040 -4.2643 3  313.6672107  71510 30353 548      52 449        syn-C2H3C(O)NH2, v=0
  903388.3090  0.0040 -4.2643 3  313.6672107  71510 30353 648      52 349        syn-C2H3C(O)NH2, v=0
  903407.7661  0.0164 -5.2514 3  787.4059155  71510 303771661      771364        syn-C2H3C(O)NH2, v=0
  903643.6510  0.0070 -5.0128 3  247.7485 89  71510 303441133      43 836        syn-C2H3C(O)NH2, v=0
  903933.0043  0.0162 -5.2510 3  787.4059155  71510 303771761      771464        syn-C2H3C(O)NH2, v=0
  903966.7660  0.0278 -3.9322 3  960.5523167  71510 303832360      822261        syn-C2H3C(O)NH2, v=0
  903991.5167  0.3202 -5.5308 3 1729.9129159  71510 303796514      796415        syn-C2H3C(O)NH2, v=0
  903991.5167  0.3202 -5.5308 3 1729.9129159  71510 303796515      796416        syn-C2H3C(O)NH2, v=0
  904036.4695  0.0084 -3.4055 3  823.1330149  71510 303742748      732647        syn-C2H3C(O)NH2, v=0
  904036.6018  0.0084 -3.4055 3  823.1330149  71510 303742747      732648        syn-C2H3C(O)NH2, v=0
  904177.4302  0.3209 -5.5186 3 1710.7885157  71510 303786513      786414        syn-C2H3C(O)NH2, v=0
  904177.4302  0.3209 -5.5186 3 1710.7885157  71510 303786514      786415        syn-C2H3C(O)NH2, v=0
  904358.7065  0.3215 -5.5091 3 1691.9076155  71510 303776512      776413        syn-C2H3C(O)NH2, v=0
  904358.7065  0.3215 -5.5091 3 1691.9076155  71510 303776513      776414        syn-C2H3C(O)NH2, v=0
  904375.6866  0.0118 -5.3946 3  680.6626141  71510 303702050      701555        syn-C2H3C(O)NH2, v=0
  904387.2970  0.0179 -5.2734 3  927.5850161  71510 303802655      802358        syn-C2H3C(O)NH2, v=0
  904456.3574  0.2142 -5.2867 3 1704.1488223  71510 303B12884      B02783        syn-C2H3C(O)NH2, v=0
  904535.4336  0.3222 -5.5026 3 1673.2700153  71510 303766511      766412        syn-C2H3C(O)NH2, v=0
  904535.4336  0.3222 -5.5026 3 1673.2700153  71510 303766512      766413        syn-C2H3C(O)NH2, v=0
  904707.6983  0.3229 -5.4996 3 1654.8757151  71510 303756510      756411        syn-C2H3C(O)NH2, v=0
  904707.6983  0.3229 -5.4996 3 1654.8757151  71510 303756511      756412        syn-C2H3C(O)NH2, v=0
  904875.5861  0.3237 -5.5007 3 1636.7247149  71510 3037465 9      746410        syn-C2H3C(O)NH2, v=0
  904875.5861  0.3237 -5.5007 3 1636.7247149  71510 303746510      746411        syn-C2H3C(O)NH2, v=0
  905039.1814  0.3245 -5.5066 3 1618.8169147  71510 3037365 8      7364 9        syn-C2H3C(O)NH2, v=0
  905039.1814  0.3245 -5.5066 3 1618.8169147  71510 3037365 9      736410        syn-C2H3C(O)NH2, v=0
  905198.5673  0.3253 -5.5183 3 1601.1522145  71510 3037265 7      7264 8        syn-C2H3C(O)NH2, v=0
  905198.5673  0.3253 -5.5183 3 1601.1522145  71510 3037265 8      7264 9        syn-C2H3C(O)NH2, v=0
  905353.8256  0.3261 -5.5373 3 1583.7307143  71510 3037165 6      7164 7        syn-C2H3C(O)NH2, v=0
  905353.8256  0.3261 -5.5373 3 1583.7307143  71510 3037165 7      7164 8        syn-C2H3C(O)NH2, v=0
  905756.4383  0.0032 -3.7750 3  465.4410121  71510 303601248      591149        syn-C2H3C(O)NH2, v=0
  905829.7530  0.0407 -5.4350 3 1064.4396173  71510 303862759      862462        syn-C2H3C(O)NH2, v=0
  906003.3581  0.0029 -4.2963 3  320.1207 97  71510 303481632      471335        syn-C2H3C(O)NH2, v=0
  906063.0246  0.0218 -2.7886 3  626.4913 89  71510 3034442 2      4341 3        syn-C2H3C(O)NH2, v=0
  906063.0246  0.0218 -2.7886 3  626.4913 89  71510 3034442 3      4341 2        syn-C2H3C(O)NH2, v=0
  906085.1112  0.0072 -3.3307 3  798.9144145  71510 303722845      712744        syn-C2H3C(O)NH2, v=0
  906085.1135  0.0072 -3.3307 3  798.9144145  71510 303722844      712745        syn-C2H3C(O)NH2, v=0
  906237.3777  0.0033 -5.1188 3  554.2397121  71510 303602436      602139        syn-C2H3C(O)NH2, v=0
  906240.6426  0.0033 -5.1188 3  554.2396121  71510 303602437      602140        syn-C2H3C(O)NH2, v=0
  906438.4215  0.0031 -3.7744 3  465.4406121  71510 303601348      591049        syn-C2H3C(O)NH2, v=0
  906461.2991  0.0319 -3.9611 3  815.2464155  71510 303772057      761958        syn-C2H3C(O)NH2, v=0
  906507.6825  0.0180 -2.8058 3  629.0518 93  71510 3034641 5      4540 6        syn-C2H3C(O)NH2, v=0
  906507.6825  0.0180 -2.8058 3  629.0518 93  71510 3034641 6      4540 5        syn-C2H3C(O)NH2, v=0
  906511.7689  0.0082 -3.8289 3  604.8250135  71510 303671651      661552        syn-C2H3C(O)NH2, v=0
  906876.8022  0.0034 -4.1318 3  334.6122109  71510 30354 648      53 549        syn-C2H3C(O)NH2, v=0
  906876.8072  0.0034 -4.1318 3  334.6122109  71510 30354 748      53 449        syn-C2H3C(O)NH2, v=0
  906941.6736  0.0147 -2.8256 3  633.0772 97  71510 3034840 8      4739 9        syn-C2H3C(O)NH2, v=0
  906941.6736  0.0147 -2.8256 3  633.0772 97  71510 3034840 9      4739 8        syn-C2H3C(O)NH2, v=0
  906981.1392  0.0978 -5.5263 3 1105.8893181  71510 303902169      901872        syn-C2H3C(O)NH2, v=0
  907021.4180  0.0042 -3.7716 3  525.7401127  71510 303631449      621350        syn-C2H3C(O)NH2, v=0
  907121.0487  0.0140 -3.6704 3  916.7381161  71510 303802556      792455        syn-C2H3C(O)NH2, v=0
  907126.2806  0.0109 -3.5268 3  868.1939155  71510 303772652      762551        syn-C2H3C(O)NH2, v=0
  907136.4421  0.0109 -3.5268 3  868.1936155  71510 303772651      762552        syn-C2H3C(O)NH2, v=0
  907267.2370  0.0074 -5.1519 3  262.7363103  71510 30351 249      50 150        syn-C2H3C(O)NH2, v=0
  907267.2370  0.0074 -5.1519 3  262.7363103  71510 30351 349      50 050        syn-C2H3C(O)NH2, v=0
  907268.5396  0.0345 -5.3245 3  904.8319165  71510 303821864      821567        syn-C2H3C(O)NH2, v=0
  907339.3754  0.0020 -4.8715 3  200.8511 73  71510 303361720      351421        syn-C2H3C(O)NH2, v=0
  907341.7890  0.0020 -4.8715 3  200.8510 73  71510 303361719      351422        syn-C2H3C(O)NH2, v=0
  907360.3429  0.0120 -2.8483 3  638.5724101  71510 303503911      493812        syn-C2H3C(O)NH2, v=0
  907360.3429  0.0120 -2.8483 3  638.5724101  71510 303503912      493811        syn-C2H3C(O)NH2, v=0
  907415.8302  0.0062 -3.2635 3  776.4302141  71510 303702941      692842        syn-C2H3C(O)NH2, v=0
  907415.8302  0.0062 -3.2635 3  776.4302141  71510 303702942      692841        syn-C2H3C(O)NH2, v=0
  907605.9559  0.0141 -3.6700 3  916.7249161  71510 303802555      792456        syn-C2H3C(O)NH2, v=0
  907640.3465  0.0067 -5.1425 3  745.4926143  71510 303712546      712249        syn-C2H3C(O)NH2, v=0
  907753.6116  0.0193 -3.8516 3  969.0387167  71510 303832459      822360        syn-C2H3C(O)NH2, v=0
  907757.4403  0.0097 -2.8738 3  645.5430105  71510 303523814      513715        syn-C2H3C(O)NH2, v=0
  907757.4403  0.0097 -2.8738 3  645.5430105  71510 303523815      513714        syn-C2H3C(O)NH2, v=0
  907929.4348  0.0067 -5.1422 3  745.4829143  71510 303712547      712250        syn-C2H3C(O)NH2, v=0
  908001.7422  0.0346 -5.4431 3 1086.2383175  71510 303872761      872464        syn-C2H3C(O)NH2, v=0
  908124.6289  0.0079 -2.9023 3  653.9959109  71510 303543717      533618        syn-C2H3C(O)NH2, v=0
  908124.6289  0.0079 -2.9023 3  653.9959109  71510 303543718      533617        syn-C2H3C(O)NH2, v=0
  908251.4502  0.0054 -3.2026 3  755.6191137  71510 303683038      672939        syn-C2H3C(O)NH2, v=0
  908251.4502  0.0054 -3.2026 3  755.6191137  71510 303683039      672938        syn-C2H3C(O)NH2, v=0
  908262.6725  0.0022 -5.4432 3  152.2828 59  71510 303291812      281513        syn-C2H3C(O)NH2, v=0
  908262.6726  0.0022 -5.4432 3  152.2828 59  71510 303291811      281514        syn-C2H3C(O)NH2, v=0
  908450.8223  0.0065 -2.9340 3  663.9393113  71510 303563620      553521        syn-C2H3C(O)NH2, v=0
  908450.8223  0.0065 -2.9340 3  663.9393113  71510 303563621      553520        syn-C2H3C(O)NH2, v=0
  908467.1360  0.0655 -4.3416 3 1179.8972185  71510 303922568      912467        syn-C2H3C(O)NH2, v=0
  908721.2821  0.0055 -2.9691 3  675.3828117  71510 303583523      573424        syn-C2H3C(O)NH2, v=0
  908721.2821  0.0055 -2.9691 3  675.3828117  71510 303583524      573423        syn-C2H3C(O)NH2, v=0
  908735.6855  0.0049 -3.1471 3  736.4357133  71510 303663135      653036        syn-C2H3C(O)NH2, v=0
  908735.6855  0.0049 -3.1471 3  736.4357133  71510 303663136      653035        syn-C2H3C(O)NH2, v=0
  908916.3622  0.0049 -3.0077 3  688.3381121  71510 303603426      593327        syn-C2H3C(O)NH2, v=0
  908916.3622  0.0049 -3.0077 3  688.3381121  71510 303603427      593326        syn-C2H3C(O)NH2, v=0
  908965.7657  0.0046 -3.0964 3  718.8450129  71510 303643232      633133        syn-C2H3C(O)NH2, v=0
  908965.7657  0.0046 -3.0964 3  718.8450129  71510 303643233      633132        syn-C2H3C(O)NH2, v=0
  909009.7284  0.0046 -3.0500 3  702.8197125  71510 303623329      613230        syn-C2H3C(O)NH2, v=0
  909009.7284  0.0046 -3.0500 3  702.8197125  71510 303623330      613229        syn-C2H3C(O)NH2, v=0
  909193.7859  0.0118 -5.2494 3  740.3690151  71510 303751560      751263        syn-C2H3C(O)NH2, v=0
  909361.5886  0.0036 -4.9513 3  232.8531 85  71510 303421330      41 833        syn-C2H3C(O)NH2, v=0
  909376.7013  0.0118 -5.2492 3  740.3690151  71510 303751660      751363        syn-C2H3C(O)NH2, v=0
  909379.0397  0.0116 -5.5306 3  596.7959133  71510 303661848      661353        syn-C2H3C(O)NH2, v=0
  909449.6317  0.0040 -3.7691 3  548.9032129  71510 303641649      631350        syn-C2H3C(O)NH2, v=0
  909597.4217  0.0330 -5.3226 3  904.8320165  71510 303821964      821667        syn-C2H3C(O)NH2, v=0
  909599.3710  0.0030 -4.0302 3  355.8243111  71510 30355 748      54 649        syn-C2H3C(O)NH2, v=0
  909599.4214  0.0030 -4.0302 3  355.8243111  71510 30355 848      54 549        syn-C2H3C(O)NH2, v=0
  909682.2222  0.0033 -5.1316 3  539.2753119  71510 303592435      592138        syn-C2H3C(O)NH2, v=0
  909683.8771  0.0033 -5.1316 3  539.2752119  71510 303592436      592139        syn-C2H3C(O)NH2, v=0
  909770.8998  0.0170 -5.2650 3  907.3692159  71510 303792653      792356        syn-C2H3C(O)NH2, v=0
  909880.0980  0.0030 -3.8022 3  443.0961119  71510 303591148      581049        syn-C2H3C(O)NH2, v=0
  909943.3405  0.0030 -4.2707 3  332.2877 99  71510 303491633      481336        syn-C2H3C(O)NH2, v=0
  910012.5530  0.0030 -3.8021 3  443.0960119  71510 303591248      58 949        syn-C2H3C(O)NH2, v=0
  910235.2019  0.0602 -5.4281 3 1029.6769175  71510 303872167      871870        syn-C2H3C(O)NH2, v=0
  910484.2972  0.0051 -4.1802 3  418.5013111  71510 303551739      541440        syn-C2H3C(O)NH2, v=0
  910541.2365  0.0181 -3.9123 3  706.3761145  71510 303721854      711755        syn-C2H3C(O)NH2, v=0
  910556.1725  0.0093 -3.4397 3  841.5644151  71510 303752749      742648        syn-C2H3C(O)NH2, v=0
  910556.4358  0.0093 -3.4397 3  841.5644151  71510 303752748      742649        syn-C2H3C(O)NH2, v=0
  910558.3372  0.0070 -5.2394 3  221.5676 85  71510 303421032      41 735        syn-C2H3C(O)NH2, v=0
  910563.0965  0.0056 -3.7963 3  564.7012131  71510 303651550      641451        syn-C2H3C(O)NH2, v=0
  911041.9065  0.0042 -3.7952 3  572.0779131  71510 303651749      641450        syn-C2H3C(O)NH2, v=0
  911443.5296  0.0028 -3.9509 3  377.2922113  71510 30356 848      55 749        syn-C2H3C(O)NH2, v=0
  911443.9728  0.0028 -3.9509 3  377.2922113  71510 30356 948      55 649        syn-C2H3C(O)NH2, v=0
  911549.3619  0.0069 -5.4582 3  196.6190 81  71510 30340 931      39 634        syn-C2H3C(O)NH2, v=0
  911846.8205  0.0029 -3.8397 3  420.9436117  71510 303581048      57 949        syn-C2H3C(O)NH2, v=0
  911869.4014  0.0029 -3.8396 3  420.9436117  71510 303581148      57 849        syn-C2H3C(O)NH2, v=0
  912261.2998  0.0028 -3.8885 3  399.0035115  71510 30357 948      56 849        syn-C2H3C(O)NH2, v=0
  912264.6815  0.0028 -3.8885 3  399.0035115  71510 303571048      56 749        syn-C2H3C(O)NH2, v=0
  912299.2690  0.0049 -5.4855 3  483.9756127  71510 30363 954      63 657        syn-C2H3C(O)NH2, v=0
  912299.3570  0.0049 -5.4855 3  483.9756127  71510 303631054      63 757        syn-C2H3C(O)NH2, v=0
  912394.0274  0.0161 -5.2628 3  907.2815159  71510 303792654      792357        syn-C2H3C(O)NH2, v=0
  912427.2518  0.0152 -3.7134 3  936.9481163  71510 303812557      802456        syn-C2H3C(O)NH2, v=0
  912604.1440  0.0061 -4.7166 3  283.2260105  71510 30352 349      51 250        syn-C2H3C(O)NH2, v=0
  912604.1440  0.0061 -4.7166 3  283.2260105  71510 30352 449      51 150        syn-C2H3C(O)NH2, v=0
  912796.3679  0.0079 -3.3628 3  816.7777147  71510 303732846      722745        syn-C2H3C(O)NH2, v=0
  912796.3729  0.0079 -3.3628 3  816.7777147  71510 303732845      722746        syn-C2H3C(O)NH2, v=0
  912824.9518  0.0020 -4.8196 3  209.7863 75  71510 303371721      361422        syn-C2H3C(O)NH2, v=0
  912830.2356  0.0020 -4.8196 3  209.7861 75  71510 303371720      361423        syn-C2H3C(O)NH2, v=0
  912845.9719  0.0259 -2.7895 3  635.5883 87  71510 3034343 0      4242 1        syn-C2H3C(O)NH2, v=0
  912845.9719  0.0259 -2.7895 3  635.5883 87  71510 3034343 1      4242 0        syn-C2H3C(O)NH2, v=0
  912917.2835  0.0033 -5.1460 3  524.5759117  71510 303582434      582137        syn-C2H3C(O)NH2, v=0
  912918.1086  0.0033 -5.1460 3  524.5759117  71510 303582435      582138        syn-C2H3C(O)NH2, v=0
  913123.0138  0.0089 -5.2568 3  694.5470147  71510 303731459      731162        syn-C2H3C(O)NH2, v=0
  913183.1060  0.0089 -5.2568 3  694.5470147  71510 303731559      731262        syn-C2H3C(O)NH2, v=0
  913251.4615  0.0154 -3.7127 3  936.9258163  71510 303812556      802457        syn-C2H3C(O)NH2, v=0
  913277.4646  0.0120 -3.5645 3  887.4859157  71510 303782653      772552        syn-C2H3C(O)NH2, v=0
  913296.0409  0.0216 -2.8048 3  637.1795 91  71510 3034542 3      4441 4        syn-C2H3C(O)NH2, v=0
  913296.0409  0.0216 -2.8048 3  637.1795 91  71510 3034542 4      4441 3        syn-C2H3C(O)NH2, v=0
  913296.1863  0.0120 -3.5645 3  887.4854157  71510 303782652      772553        syn-C2H3C(O)NH2, v=0
  913491.4386  0.0060 -5.1412 3  727.6115141  71510 303702545      702248        syn-C2H3C(O)NH2, v=0
  913656.8637  0.0060 -5.1410 3  727.6059141  71510 303702546      702249        syn-C2H3C(O)NH2, v=0
  913737.8703  0.0178 -2.8228 3  640.2327 95  71510 3034741 6      4640 7        syn-C2H3C(O)NH2, v=0
  913737.8703  0.0178 -2.8228 3  640.2327 95  71510 3034741 7      4640 6        syn-C2H3C(O)NH2, v=0
  914167.7326  0.0146 -2.8435 3  644.7523 99  71510 3034940 9      483910        syn-C2H3C(O)NH2, v=0
  914167.7326  0.0146 -2.8435 3  644.7523 99  71510 303494010      4839 9        syn-C2H3C(O)NH2, v=0
  914236.0270  0.0405 -3.9980 3  931.4958165  71510 303822260      812161        syn-C2H3C(O)NH2, v=0
  914261.5378  0.0068 -3.2939 3  793.7411143  71510 303712942      702843        syn-C2H3C(O)NH2, v=0
  914261.5378  0.0068 -3.2939 3  793.7411143  71510 303712943      702842        syn-C2H3C(O)NH2, v=0
  914580.6004  0.0119 -2.8670 3  650.7431103  71510 303513912      503813        syn-C2H3C(O)NH2, v=0
  914580.6004  0.0119 -2.8670 3  650.7431103  71510 303513913      503812        syn-C2H3C(O)NH2, v=0
  914582.3245  0.1951 -4.9566 3 1500.7618209  71510 303A42778      A32677        syn-C2H3C(O)NH2, v=0
  914736.5266  0.0031 -4.2490 3  344.7013101  71510 303501634      491337        syn-C2H3C(O)NH2, v=0
  914751.8826  0.0036 -3.7669 3  525.7320127  71510 303631549      621250        syn-C2H3C(O)NH2, v=0
  914763.0740  0.0052 -5.4070 3  523.5898131  71510 303651055      65 758        syn-C2H3C(O)NH2, v=0
  914763.4480  0.0052 -5.4070 3  523.5898131  71510 303651155      65 858        syn-C2H3C(O)NH2, v=0
  914855.8493  0.0022 -5.3611 3  159.4064 61  71510 303301813      291514        syn-C2H3C(O)NH2, v=0
  914855.8497  0.0022 -5.3611 3  159.4064 61  71510 303301812      291515        syn-C2H3C(O)NH2, v=0
  914969.7551  0.0097 -2.8934 3  658.2114107  71510 303533815      523716        syn-C2H3C(O)NH2, v=0
  914969.7551  0.0097 -2.8934 3  658.2114107  71510 303533816      523715        syn-C2H3C(O)NH2, v=0
  915003.2438  0.1270 -4.6530 3 1335.4387197  71510 303982673      972572        syn-C2H3C(O)NH2, v=0
  915022.5342  0.0222 -3.9038 3  990.1857169  71510 303842460      832361        syn-C2H3C(O)NH2, v=0
  915194.8782  0.0059 -3.2314 3  772.3895139  71510 303693039      682940        syn-C2H3C(O)NH2, v=0
  915194.8782  0.0059 -3.2314 3  772.3895139  71510 303693040      682939        syn-C2H3C(O)NH2, v=0
  915326.2660  0.0079 -2.9229 3  667.1641111  71510 303553718      543619        syn-C2H3C(O)NH2, v=0
  915326.2660  0.0079 -2.9229 3  667.1641111  71510 303553719      543618        syn-C2H3C(O)NH2, v=0
  915478.0891  0.0072 -5.2747 3  649.9492143  71510 303711358      711061        syn-C2H3C(O)NH2, v=0
  915496.6884  0.0072 -5.2747 3  649.9492143  71510 303711458      711161        syn-C2H3C(O)NH2, v=0
  915588.9376  0.0045 -5.0405 3  227.4710 85  71510 303421231      41 734        syn-C2H3C(O)NH2, v=0
  915638.2884  0.0066 -2.9557 3  677.6097115  71510 303573621      563522        syn-C2H3C(O)NH2, v=0
  915638.2884  0.0066 -2.9557 3  677.6097115  71510 303573622      563521        syn-C2H3C(O)NH2, v=0
  915751.7501  0.0053 -3.1745 3  752.6748135  71510 303673136      663037        syn-C2H3C(O)NH2, v=0
  915751.7501  0.0053 -3.1745 3  752.6748135  71510 303673137      663036        syn-C2H3C(O)NH2, v=0
  915890.1033  0.0056 -2.9918 3  689.5584119  71510 303593524      583425        syn-C2H3C(O)NH2, v=0
  915890.1033  0.0056 -2.9918 3  689.5584119  71510 303593525      583424        syn-C2H3C(O)NH2, v=0
  915955.9477  0.0033 -5.1619 3  510.1405115  71510 303572433      572136        syn-C2H3C(O)NH2, v=0
  915956.3522  0.0033 -5.1619 3  510.1405115  71510 303572434      572137        syn-C2H3C(O)NH2, v=0
  916036.6134  0.0050 -3.1225 3  734.5602131  71510 303653233      643134        syn-C2H3C(O)NH2, v=0
  916036.6134  0.0050 -3.1225 3  734.5602131  71510 303653234      643133        syn-C2H3C(O)NH2, v=0
  916060.7793  0.0051 -3.0315 3  703.0226123  71510 303613427      603328        syn-C2H3C(O)NH2, v=0
  916060.7793  0.0051 -3.0315 3  703.0226123  71510 303613428      603327        syn-C2H3C(O)NH2, v=0
  916097.6074  0.2373 -5.2490 3 1675.4780221  71510 303B02883      A92782        syn-C2H3C(O)NH2, v=0
  916122.2672  0.0049 -3.0749 3  718.0170127  71510 303633330      623231        syn-C2H3C(O)NH2, v=0
  916122.2672  0.0049 -3.0749 3  718.0170127  71510 303633331      623230        syn-C2H3C(O)NH2, v=0
  916175.1652  0.0057 -5.3477 3  564.4622135  71510 303671156      67 859        syn-C2H3C(O)NH2, v=0
  916176.6389  0.0057 -5.3477 3  564.4622135  71510 303671256      67 959        syn-C2H3C(O)NH2, v=0
  916449.2564  0.0062 -5.3044 3  606.5848139  71510 303691257      69 960        syn-C2H3C(O)NH2, v=0
  916454.6666  0.0062 -5.3044 3  606.5848139  71510 303691357      691060        syn-C2H3C(O)NH2, v=0
  917024.9999  0.0102 -3.4747 3  860.2608153  71510 303762750      752649        syn-C2H3C(O)NH2, v=0
  917025.5169  0.0102 -3.4747 3  860.2608153  71510 303762749      752650        syn-C2H3C(O)NH2, v=0
  917118.1672  0.0319 -5.4262 3 1064.0617173  71510 303862760      862463        syn-C2H3C(O)NH2, v=0
  917171.8930  0.0250 -5.3042 3  854.7770161  71510 303801763      801466        syn-C2H3C(O)NH2, v=0
  917406.5501  0.0050 -4.4582 3  304.0108107  71510 30353 449      52 350        syn-C2H3C(O)NH2, v=0
  917406.5501  0.0050 -4.4582 3  304.0108107  71510 30353 549      52 250        syn-C2H3C(O)NH2, v=0
  917457.0407  0.0164 -3.7578 3  957.4449165  71510 303822558      812457        syn-C2H3C(O)NH2, v=0
  917852.1050  0.0502 -5.3972 3  976.6387171  71510 303851966      851669        syn-C2H3C(O)NH2, v=0
  918062.6230  0.0245 -5.3035 3  854.7771161  71510 303801863      801566        syn-C2H3C(O)NH2, v=0
  918119.3313  0.0021 -4.7704 3  218.9828 77  71510 303381722      371423        syn-C2H3C(O)NH2, v=0
  918130.5752  0.0021 -4.7704 3  218.9824 77  71510 303381721      371424        syn-C2H3C(O)NH2, v=0
  918415.1320  0.0149 -5.2546 3  887.3146157  71510 303782652      782355        syn-C2H3C(O)NH2, v=0
  918486.6409  0.0360 -3.9970 3  981.7405169  71510 303842361      832262        syn-C2H3C(O)NH2, v=0
  918616.5576  0.0045 -4.2647 3  364.5115105  71510 303521537      511240        syn-C2H3C(O)NH2, v=0
  918738.9658  0.0343 -5.4160 3 1042.4109171  71510 303852758      852461        syn-C2H3C(O)NH2, v=0
  918788.8016  0.0525 -4.2706 3 1156.0708183  71510 303912567      902466        syn-C2H3C(O)NH2, v=0
  918810.3559  0.0033 -5.1795 3  495.9681113  71510 303562432      562135        syn-C2H3C(O)NH2, v=0
  918810.5508  0.0033 -5.1795 3  495.9681113  71510 303562433      562136        syn-C2H3C(O)NH2, v=0
  918838.9262  0.0168 -3.7566 3  957.4077165  71510 303822557      812458        syn-C2H3C(O)NH2, v=0
  918923.3432  0.0096 -5.4293 3  688.1304141  71510 303702149      701654        syn-C2H3C(O)NH2, v=0
  918946.6444  0.0054 -5.1411 3  710.0077139  71510 303692544      692247        syn-C2H3C(O)NH2, v=0
  919028.8557  0.0052 -5.2231 3  211.9487 83  71510 303411131      40 634        syn-C2H3C(O)NH2, v=0
  919039.9226  0.0054 -5.1410 3  710.0046139  71510 303692545      692248        syn-C2H3C(O)NH2, v=0
  919140.8808  0.0035 -3.7776 3  502.6565125  71510 303621349      611250        syn-C2H3C(O)NH2, v=0
  919342.5206  0.0131 -3.6031 3  907.0498159  71510 303792654      782553        syn-C2H3C(O)NH2, v=0
  919376.5796  0.0131 -3.6031 3  907.0488159  71510 303792653      782554        syn-C2H3C(O)NH2, v=0
  919407.6074  0.0106 -5.4181 3  706.1085143  71510 303712150      711655        syn-C2H3C(O)NH2, v=0
  919471.1264  0.0087 -3.3957 3  834.9021149  71510 303742847      732746        syn-C2H3C(O)NH2, v=0
  919471.1368  0.0087 -3.3957 3  834.9021149  71510 303742846      732747        syn-C2H3C(O)NH2, v=0
  920024.5025  0.0144 -5.2532 3  887.2608157  71510 303782653      782356        syn-C2H3C(O)NH2, v=0
  920079.2761  0.0257 -2.8054 3  646.0292 89  71510 3034443 1      4342 2        syn-C2H3C(O)NH2, v=0
  920079.2761  0.0257 -2.8054 3  646.0292 89  71510 3034443 2      4342 1        syn-C2H3C(O)NH2, v=0
  920362.0744  0.0809 -5.5168 3 1105.8909181  71510 303902269      901972        syn-C2H3C(O)NH2, v=0
  920527.2150  0.0214 -2.8215 3  648.1123 93  71510 3034642 4      4541 5        syn-C2H3C(O)NH2, v=0
  920527.2150  0.0214 -2.8215 3  648.1123 93  71510 3034642 5      4541 4        syn-C2H3C(O)NH2, v=0
  920711.3275  0.0032 -4.2325 3  357.3541103  71510 303511635      501338        syn-C2H3C(O)NH2, v=0
  920965.8396  0.0177 -2.8403 3  651.6586 97  71510 3034841 7      4740 8        syn-C2H3C(O)NH2, v=0
  920965.8396  0.0177 -2.8403 3  651.6586 97  71510 3034841 8      4740 7        syn-C2H3C(O)NH2, v=0
  921063.1626  0.0033 -3.7763 3  502.6550125  71510 303621449      611150        syn-C2H3C(O)NH2, v=0
  921079.8485  0.0075 -3.3250 3  811.3102145  71510 303722944      712843        syn-C2H3C(O)NH2, v=0
  921079.8486  0.0075 -3.3250 3  811.3102145  71510 303722943      712844        syn-C2H3C(O)NH2, v=0
  921156.0801  0.0049 -4.2253 3  404.2819109  71510 303541738      531439        syn-C2H3C(O)NH2, v=0
  921192.8047  0.0143 -5.4431 3  698.2953143  71510 303712051      711556        syn-C2H3C(O)NH2, v=0
  921367.3044  0.0021 -5.2846 3  166.7822 63  71510 303311814      301515        syn-C2H3C(O)NH2, v=0
  921367.3056  0.0021 -5.2846 3  166.7822 63  71510 303311813      301516        syn-C2H3C(O)NH2, v=0
  921391.1101  0.0145 -2.8619 3  656.6727101  71510 303504010      493911        syn-C2H3C(O)NH2, v=0
  921391.1101  0.0145 -2.8619 3  656.6727101  71510 303504011      493910        syn-C2H3C(O)NH2, v=0
  921491.5934  0.0033 -5.1988 3  482.0577111  71510 303552431      552134        syn-C2H3C(O)NH2, v=0
  921491.6856  0.0033 -5.1988 3  482.0577111  71510 303552432      552135        syn-C2H3C(O)NH2, v=0
  921585.6003  0.0470 -5.3943 3  976.6390171  71510 303852066      851769        syn-C2H3C(O)NH2, v=0
  921619.2596  0.0041 -4.2799 3  325.0824109  71510 30354 549      53 450        syn-C2H3C(O)NH2, v=0
  921619.2598  0.0041 -4.2799 3  325.0824109  71510 30354 649      53 350        syn-C2H3C(O)NH2, v=0
  921797.6088  0.0119 -2.8863 3  663.1598105  71510 303523913      513814        syn-C2H3C(O)NH2, v=0
  921797.6088  0.0119 -2.8863 3  663.1598105  71510 303523914      513813        syn-C2H3C(O)NH2, v=0
  922009.6610  0.0417 -4.0144 3  882.5109161  71510 303802159      792060        syn-C2H3C(O)NH2, v=0
  922117.1370  0.0065 -3.2609 3  789.4158141  71510 303703040      692941        syn-C2H3C(O)NH2, v=0
  922117.1370  0.0065 -3.2609 3  789.4158141  71510 303703041      692940        syn-C2H3C(O)NH2, v=0
  922121.9482  0.0177 -3.8039 3  978.2329167  71510 303832559      822458        syn-C2H3C(O)NH2, v=0
  922178.1259  0.0097 -2.9136 3  671.1262109  71510 303543816      533717        syn-C2H3C(O)NH2, v=0
  922178.1259  0.0097 -2.9136 3  671.1262109  71510 303543817      533716        syn-C2H3C(O)NH2, v=0
  922523.1081  0.0080 -2.9441 3  680.5793113  71510 303563719      553620        syn-C2H3C(O)NH2, v=0
  922523.1081  0.0080 -2.9441 3  680.5793113  71510 303563720      553619        syn-C2H3C(O)NH2, v=0
  922677.3805  0.0090 -5.4580 3  670.3013139  71510 303692148      691653        syn-C2H3C(O)NH2, v=0
  922751.1316  0.0058 -3.2026 3  769.1678137  71510 303683137      673038        syn-C2H3C(O)NH2, v=0
  922751.1316  0.0058 -3.2026 3  769.1678137  71510 303683138      673037        syn-C2H3C(O)NH2, v=0
  922819.9141  0.0067 -2.9779 3  691.5280117  71510 303583622      573523        syn-C2H3C(O)NH2, v=0
  922819.9141  0.0067 -2.9779 3  691.5280117  71510 303583623      573522        syn-C2H3C(O)NH2, v=0
  923051.7936  0.0058 -3.0150 3  703.9829121  71510 303603525      593426        syn-C2H3C(O)NH2, v=0
  923051.7936  0.0058 -3.0150 3  703.9829121  71510 303603526      593425        syn-C2H3C(O)NH2, v=0
  923094.1315  0.0054 -3.1493 3  750.5277133  71510 303663234      653135        syn-C2H3C(O)NH2, v=0
  923094.1315  0.0054 -3.1493 3  750.5277133  71510 303663235      653134        syn-C2H3C(O)NH2, v=0
  923196.4604  0.0053 -3.0558 3  717.9568125  71510 303623428      613329        syn-C2H3C(O)NH2, v=0
  923196.4604  0.0053 -3.0558 3  717.9568125  71510 303623429      613328        syn-C2H3C(O)NH2, v=0
  923202.5496  0.0021 -4.7237 3  228.4420 79  71510 303391723      381424        syn-C2H3C(O)NH2, v=0
  923224.0519  0.0052 -3.1005 3  733.4653129  71510 303643331      633232        syn-C2H3C(O)NH2, v=0
  923224.0519  0.0052 -3.1005 3  733.4653129  71510 303643332      633231        syn-C2H3C(O)NH2, v=0
  923225.8358  0.0021 -4.7236 3  228.4412 79  71510 303391722      381425        syn-C2H3C(O)NH2, v=0
  923421.9124  0.0262 -3.9588 3 1011.6089171  71510 303852461      842362        syn-C2H3C(O)NH2, v=0
  923439.3317  0.0112 -3.5105 3  879.2231155  71510 303772751      762650        syn-C2H3C(O)NH2, v=0
  923440.3340  0.0112 -3.5105 3  879.2231155  71510 303772750      762651        syn-C2H3C(O)NH2, v=0
  924009.8366  0.0033 -5.2199 3  468.4085109  71510 303542430      542133        syn-C2H3C(O)NH2, v=0
  924009.8794  0.0033 -5.2199 3  468.4085109  71510 303542431      542134        syn-C2H3C(O)NH2, v=0
  924046.5752  0.0122 -5.4234 3  724.2444145  71510 303722151      721656        syn-C2H3C(O)NH2, v=0
  924047.3126  0.0049 -5.1422 3  692.6791137  71510 303682543      682246        syn-C2H3C(O)NH2, v=0
  924099.1438  0.0049 -5.1421 3  692.6774137  71510 303682544      682247        syn-C2H3C(O)NH2, v=0
  924406.5464  0.0183 -3.8020 3  978.1720167  71510 303832558      822459        syn-C2H3C(O)NH2, v=0
  924408.4599  0.0181 -5.2923 3  805.9186157  71510 303781662      781365        syn-C2H3C(O)NH2, v=0
  924655.6650  0.0139 -5.5068 3  655.1489139  71510 303691950      691455        syn-C2H3C(O)NH2, v=0
  924729.9893  0.0180 -5.2920 3  805.9187157  71510 303781762      781465        syn-C2H3C(O)NH2, v=0
  924881.9637  0.0046 -3.9395 3  561.9055129  71510 303641847      631548        syn-C2H3C(O)NH2, v=0
  925175.2995  0.0034 -4.1482 3  346.4317111  71510 30355 649      54 550        syn-C2H3C(O)NH2, v=0
  925175.3021  0.0034 -4.1482 3  346.4317111  71510 30355 749      54 450        syn-C2H3C(O)NH2, v=0
  925252.0299  0.0267 -3.9689 3  769.2539151  71510 303751956      741857        syn-C2H3C(O)NH2, v=0
  925311.3079  0.0143 -3.6427 3  926.8871161  71510 303802655      792554        syn-C2H3C(O)NH2, v=0
  925372.4922  0.0144 -3.6427 3  926.8854161  71510 303802654      792555        syn-C2H3C(O)NH2, v=0
  925403.6624  0.0077 -5.1656 3  273.1427105  71510 30352 250      51 151        syn-C2H3C(O)NH2, v=0
  925403.6624  0.0077 -5.1656 3  273.1427105  71510 30352 350      51 051        syn-C2H3C(O)NH2, v=0
  925648.3262  0.0031 -3.7950 3  479.7204123  71510 303611249      601150        syn-C2H3C(O)NH2, v=0
  925698.4191  0.0044 -3.9022 3  578.4194131  71510 303651848      641549        syn-C2H3C(O)NH2, v=0
  926060.4411  0.0031 -3.7947 3  479.7201123  71510 303611349      601050        syn-C2H3C(O)NH2, v=0
  926089.1201  0.0291 -5.4101 3 1042.1650171  71510 303852759      852462        syn-C2H3C(O)NH2, v=0
  926107.1785  0.0096 -3.4293 3  853.2884151  71510 303752848      742747        syn-C2H3C(O)NH2, v=0
  926107.2001  0.0096 -3.4293 3  853.2884151  71510 303752847      742748        syn-C2H3C(O)NH2, v=0
  926288.0744  0.0131 -5.2455 3  867.5548155  71510 303772651      772354        syn-C2H3C(O)NH2, v=0
  926295.5324  0.0191 -3.8519 3  999.3181169  71510 303842560      832459        syn-C2H3C(O)NH2, v=0
  926341.5546  0.0415 -4.2007 3 1132.6132181  71510 303902566      892465        syn-C2H3C(O)NH2, v=0
  926374.4707  0.0033 -5.2428 3  455.0196107  71510 303532429      532132        syn-C2H3C(O)NH2, v=0
  926374.4902  0.0033 -5.2428 3  455.0196107  71510 303532430      532133        syn-C2H3C(O)NH2, v=0
  926435.3602  0.0039 -4.9411 3  243.1369 87  71510 303431331      42 834        syn-C2H3C(O)NH2, v=0
  926562.6581  0.0047 -3.8058 3  588.3302133  71510 303661750      651451        syn-C2H3C(O)NH2, v=0
  926654.5987  0.0126 -3.8870 3  663.3192141  71510 303701753      691654        syn-C2H3C(O)NH2, v=0
  926862.6588  0.0714 -5.4800 3 1051.0619177  71510 303882068      881771        syn-C2H3C(O)NH2, v=0
  927260.2784  0.0129 -5.2446 3  867.5223155  71510 303772652      772355        syn-C2H3C(O)NH2, v=0
  927310.9382  0.0255 -2.8218 3  656.7143 91  71510 3034543 2      4442 3        syn-C2H3C(O)NH2, v=0
  927310.9382  0.0255 -2.8218 3  656.7143 91  71510 3034543 3      4442 2        syn-C2H3C(O)NH2, v=0
  927674.7805  0.0068 -4.6471 3  315.4233 99  71510 303491336      481039        syn-C2H3C(O)NH2, v=0
  927756.4256  0.0213 -2.8387 3  659.2896 95  71510 3034742 5      4641 6        syn-C2H3C(O)NH2, v=0
  927756.4256  0.0213 -2.8387 3  659.2896 95  71510 3034742 6      4641 5        syn-C2H3C(O)NH2, v=0
  927767.1977  0.0061 -4.4480 3  345.8381103  71510 303511437      501140        syn-C2H3C(O)NH2, v=0
  927787.6746  0.0050 -3.9882 3  545.5380127  71510 303631846      621547        syn-C2H3C(O)NH2, v=0
  927789.9292  0.0021 -5.2132 3  174.4110 65  71510 303321815      311516        syn-C2H3C(O)NH2, v=0
  927789.9326  0.0021 -5.2132 3  174.4110 65  71510 303321814      311517        syn-C2H3C(O)NH2, v=0
  927869.2616  0.0083 -3.3567 3  829.1381147  71510 303732945      722844        syn-C2H3C(O)NH2, v=0
  927869.2620  0.0083 -3.3567 3  829.1381147  71510 303732944      722845        syn-C2H3C(O)NH2, v=0
  927991.9449  0.0030 -4.0474 3  368.0490113  71510 30356 749      55 650        syn-C2H3C(O)NH2, v=0
  927991.9714  0.0030 -4.0474 3  368.0490113  71510 30356 849      55 550        syn-C2H3C(O)NH2, v=0
  928050.9016  0.0022 -4.6793 3  238.1654 81  71510 303401724      391425        syn-C2H3C(O)NH2, v=0
  928097.8825  0.0022 -4.6793 3  238.1639 81  71510 303401723      391426        syn-C2H3C(O)NH2, v=0
  928191.4491  0.0176 -2.8583 3  663.3295 99  71510 3034941 8      4840 9        syn-C2H3C(O)NH2, v=0
  928191.4491  0.0176 -2.8583 3  663.3295 99  71510 3034941 9      4840 8        syn-C2H3C(O)NH2, v=0
  928231.8653  0.0034 -4.2225 3  370.2386105  71510 303521636      511339        syn-C2H3C(O)NH2, v=0
  928426.0660  0.0042 -3.7880 3  564.6773131  71510 303651650      641351        syn-C2H3C(O)NH2, v=0
  928594.1855  0.0033 -5.2677 3  441.8901105  71510 303522428      522131        syn-C2H3C(O)NH2, v=0
  928594.1942  0.0033 -5.2677 3  441.8901105  71510 303522429      522132        syn-C2H3C(O)NH2, v=0
  928611.6420  0.0145 -2.8808 3  668.8386103  71510 303514011      503912        syn-C2H3C(O)NH2, v=0
  928611.6420  0.0145 -2.8808 3  668.8386103  71510 303514012      503911        syn-C2H3C(O)NH2, v=0
  928826.6608  0.0045 -5.1446 3  675.6237135  71510 303672542      672245        syn-C2H3C(O)NH2, v=0
  928855.0421  0.0045 -5.1446 3  675.6228135  71510 303672543      672246        syn-C2H3C(O)NH2, v=0
  929011.1774  0.0119 -2.9061 3  675.8225107  71510 303533914      523815        syn-C2H3C(O)NH2, v=0
  929011.1774  0.0119 -2.9061 3  675.8225107  71510 303533915      523814        syn-C2H3C(O)NH2, v=0
  929017.1377  0.0072 -3.2911 3  806.6983143  71510 303713041      702942        syn-C2H3C(O)NH2, v=0
  929017.1377  0.0072 -3.2911 3  806.6983143  71510 303713042      702941        syn-C2H3C(O)NH2, v=0
  929178.0279  0.0030 -3.8220 3  456.9584121  71510 303601149      591050        syn-C2H3C(O)NH2, v=0
  929255.4487  0.0030 -3.8219 3  456.9584121  71510 303601249      59 950        syn-C2H3C(O)NH2, v=0
  929382.3306  0.0097 -2.9344 3  684.2877111  71510 303553817      543718        syn-C2H3C(O)NH2, v=0
  929382.3306  0.0097 -2.9344 3  684.2877111  71510 303553818      543717        syn-C2H3C(O)NH2, v=0
  929577.7362  0.0132 -5.2890 3  758.2672153  71510 303761561      761264        syn-C2H3C(O)NH2, v=0
  929687.3935  0.0132 -5.2889 3  758.2672153  71510 303761661      761364        syn-C2H3C(O)NH2, v=0
  929711.1305  0.0041 -3.7910 3  541.0660129  71510 303641450      631351        syn-C2H3C(O)NH2, v=0
  929714.8955  0.0081 -2.9659 3  694.2419115  71510 303573720      563621        syn-C2H3C(O)NH2, v=0
  929714.8955  0.0081 -2.9659 3  694.2419115  71510 303573721      563620        syn-C2H3C(O)NH2, v=0
  929733.0023  0.0064 -3.2313 3  785.9151139  71510 303693138      683039        syn-C2H3C(O)NH2, v=0
  929733.0023  0.0064 -3.2313 3  785.9151139  71510 303693139      683038        syn-C2H3C(O)NH2, v=0
  929795.1382  0.0123 -3.5471 3  898.4524157  71510 303782752      772651        syn-C2H3C(O)NH2, v=0
  929797.0566  0.0123 -3.5471 3  898.4524157  71510 303782751      772652        syn-C2H3C(O)NH2, v=0
  929799.8343  0.0205 -3.9021 3 1020.7076171  71510 303852561      842460        syn-C2H3C(O)NH2, v=0
  929826.5846  0.0369 -5.3680 3  924.7775167  71510 303831865      831568        syn-C2H3C(O)NH2, v=0
  929964.7690  0.0028 -3.9689 3  389.9233115  71510 30357 849      56 750        syn-C2H3C(O)NH2, v=0
  929965.0074  0.0028 -3.9689 3  389.9233115  71510 30357 949      56 650        syn-C2H3C(O)NH2, v=0
  929995.3941  0.0068 -3.0006 3  705.6945119  71510 303593623      583524        syn-C2H3C(O)NH2, v=0
  929995.3941  0.0068 -3.0006 3  705.6945119  71510 303593624      583523        syn-C2H3C(O)NH2, v=0
  930018.0554  0.0200 -3.8489 3  999.2194169  71510 303842559      832460        syn-C2H3C(O)NH2, v=0
  930106.0622  0.0294 -5.3988 3 1020.7076169  71510 303842757      842460        syn-C2H3C(O)NH2, v=0
  930137.6685  0.0058 -3.1767 3  766.7478135  71510 303673235      663136        syn-C2H3C(O)NH2, v=0
  930137.6685  0.0058 -3.1767 3  766.7478135  71510 303673236      663135        syn-C2H3C(O)NH2, v=0
  930205.9915  0.0060 -3.0389 3  718.6563123  71510 303613526      603427        syn-C2H3C(O)NH2, v=0
  930205.9915  0.0060 -3.0389 3  718.6563123  71510 303613527      603426        syn-C2H3C(O)NH2, v=0
  930247.0985  0.0045 -3.8778 3  595.0743133  71510 303661849      651550        syn-C2H3C(O)NH2, v=0
  930314.5564  0.0056 -3.1266 3  749.1648131  71510 303653332      643233        syn-C2H3C(O)NH2, v=0
  930314.5564  0.0056 -3.1266 3  749.1648131  71510 303653333      643232        syn-C2H3C(O)NH2, v=0
  930322.9725  0.0056 -3.0808 3  733.1410127  71510 303633429      623330        syn-C2H3C(O)NH2, v=0
  930322.9725  0.0056 -3.0808 3  733.1410127  71510 303633430      623329        syn-C2H3C(O)NH2, v=0
  930462.0696  0.2525 -5.2072 3 1646.9342219  71510 303A92882      A82781        syn-C2H3C(O)NH2, v=0
  930480.5420  0.1109 -4.5864 3 1309.8762195  71510 303972672      962571        syn-C2H3C(O)NH2, v=0
  930549.0186  0.0057 -5.4595 3  196.6188 81  71510 303401031      39 534        syn-C2H3C(O)NH2, v=0
  930677.0552  0.0033 -5.2947 3  429.0194103  71510 303512427      512130        syn-C2H3C(O)NH2, v=0
  930677.0591  0.0033 -5.2947 3  429.0194103  71510 303512428      512131        syn-C2H3C(O)NH2, v=0
  930755.5093  0.0088 -5.5047 3  652.6132137  71510 303682147      681652        syn-C2H3C(O)NH2, v=0
  930755.5628  0.0063 -4.7311 3  294.0357107  71510 30353 350      52 251        syn-C2H3C(O)NH2, v=0
  930755.5628  0.0063 -4.7311 3  294.0357107  71510 30353 450      52 151        syn-C2H3C(O)NH2, v=0
  930787.2850  0.0029 -3.8590 3  434.3929119  71510 303591049      58 950        syn-C2H3C(O)NH2, v=0
  930800.0965  0.0029 -3.8589 3  434.3929119  71510 303591149      58 850        syn-C2H3C(O)NH2, v=0
  930845.4038  0.0045 -4.2619 3  390.3700107  71510 303531737      521438        syn-C2H3C(O)NH2, v=0
  930958.0820  0.0028 -3.9072 3  412.0426117  71510 30358 949      57 850        syn-C2H3C(O)NH2, v=0
  930959.9487  0.0028 -3.9072 3  412.0426117  71510 303581049      57 750        syn-C2H3C(O)NH2, v=0
  931147.5733  0.0333 -4.1336 3 1109.5275179  71510 303892565      882464        syn-C2H3C(O)NH2, v=0
  931170.8118  0.0156 -3.6834 3  946.9994163  71510 303812656      802555        syn-C2H3C(O)NH2, v=0
  931279.3485  0.0157 -3.6833 3  946.9964163  71510 303812655      802556        syn-C2H3C(O)NH2, v=0
  931305.0411  0.0359 -5.3668 3  924.7775167  71510 303831965      831668        syn-C2H3C(O)NH2, v=0
  931654.0608  0.1881 -4.9029 3 1473.6162207  71510 303A32777      A22676        syn-C2H3C(O)NH2, v=0
  932391.0410  0.0221 -3.9549 3 1042.4109173  71510 303862562      852461        syn-C2H3C(O)NH2, v=0
  932630.6058  0.0033 -5.3237 3  416.4066101  71510 303502426      502129        syn-C2H3C(O)NH2, v=0
  932630.6075  0.0033 -5.3237 3  416.4066101  71510 303502427      502130        syn-C2H3C(O)NH2, v=0
  932635.4090  0.0023 -4.6372 3  248.1550 83  71510 303411725      401426        syn-C2H3C(O)NH2, v=0
  932702.1393  0.0106 -3.4637 3  871.9373153  71510 303762849      752748        syn-C2H3C(O)NH2, v=0
  932702.1832  0.0106 -3.4637 3  871.9373153  71510 303762848      752749        syn-C2H3C(O)NH2, v=0
  932726.5944  0.0648 -5.4756 3 1051.0625177  71510 303882168      881871        syn-C2H3C(O)NH2, v=0
  932727.8241  0.0023 -4.6371 3  248.1519 83  71510 303411724      401427        syn-C2H3C(O)NH2, v=0
  932827.0953  0.0146 -5.4446 3  742.5468147  71510 303732152      731657        syn-C2H3C(O)NH2, v=0
  933038.6209  0.0100 -5.2950 3  711.8324149  71510 303741460      741163        syn-C2H3C(O)NH2, v=0
  933073.9389  0.0100 -5.2950 3  711.8324149  71510 303741560      741263        syn-C2H3C(O)NH2, v=0
  933312.0515  0.0042 -5.1483 3  658.8398133  71510 303662541      662244        syn-C2H3C(O)NH2, v=0
  933327.3650  0.0042 -5.1482 3  658.8393133  71510 303662542      662245        syn-C2H3C(O)NH2, v=0
  933440.0302  0.0321 -4.0173 3 1033.3034173  71510 303862462      852363        syn-C2H3C(O)NH2, v=0
  933480.1988  0.0278 -4.0703 3 1086.8070177  71510 303882564      872463        syn-C2H3C(O)NH2, v=0
  933520.3935  0.0116 -5.2376 3  848.0842153  71510 303762650      762353        syn-C2H3C(O)NH2, v=0
  933555.3696  0.0056 -5.4397 3  538.4378133  71510 303661056      66 759        syn-C2H3C(O)NH2, v=0
  933555.5737  0.0056 -5.4397 3  538.4378133  71510 303661156      66 859        syn-C2H3C(O)NH2, v=0
  933749.0358  0.0244 -4.0108 3 1064.4396175  71510 303872563      862462        syn-C2H3C(O)NH2, v=0
  934074.8741  0.0054 -4.0445 3  529.3317125  71510 303621845      611546        syn-C2H3C(O)NH2, v=0
  934089.9766  0.0302 -2.8235 3  666.0376 89  71510 3034444 0      4343 1        syn-C2H3C(O)NH2, v=0
  934089.9766  0.0302 -2.8235 3  666.0376 89  71510 3034444 1      4343 0        syn-C2H3C(O)NH2, v=0
  934098.9792  0.0115 -5.2371 3  848.0649153  71510 303762651      762354        syn-C2H3C(O)NH2, v=0
  934116.0958  0.0020 -5.1462 3  182.2936 67  71510 303331816      321517        syn-C2H3C(O)NH2, v=0
  934116.1048  0.0020 -5.1462 3  182.2936 67  71510 303331815      321518        syn-C2H3C(O)NH2, v=0
  934461.8724  0.0033 -5.3551 3  404.0511 99  71510 303492425      492128        syn-C2H3C(O)NH2, v=0
  934461.8731  0.0033 -5.3551 3  404.0511 99  71510 303492426      492129        syn-C2H3C(O)NH2, v=0
  934540.8504  0.0254 -2.8387 3  667.6438 93  71510 3034643 3      4542 4        syn-C2H3C(O)NH2, v=0
  934540.8504  0.0254 -2.8387 3  667.6438 93  71510 3034643 4      4542 3        syn-C2H3C(O)NH2, v=0
  934628.1796  0.0091 -3.3892 3  847.2253149  71510 303742946      732845        syn-C2H3C(O)NH2, v=0
  934628.1804  0.0091 -3.3892 3  847.2253149  71510 303742945      732846        syn-C2H3C(O)NH2, v=0
  934735.7026  0.0037 -3.7878 3  541.0612129  71510 303641550      631251        syn-C2H3C(O)NH2, v=0
  934803.3237  0.0264 -5.3950 3 1020.5505169  71510 303842758      842461        syn-C2H3C(O)NH2, v=0
  934983.5471  0.0211 -2.8564 3  670.7118 97  71510 3034842 6      4741 7        syn-C2H3C(O)NH2, v=0
  934983.5471  0.0211 -2.8564 3  670.7118 97  71510 3034842 7      4741 6        syn-C2H3C(O)NH2, v=0
  935022.7902  0.0080 -5.3116 3  666.6235145  71510 303721359      721062        syn-C2H3C(O)NH2, v=0
  935033.5149  0.0080 -5.3116 3  666.6235145  71510 303721459      721162        syn-C2H3C(O)NH2, v=0
  935171.4724  0.0061 -5.3818 3  579.9179137  71510 303681157      68 860        syn-C2H3C(O)NH2, v=0
  935172.2914  0.0061 -5.3818 3  579.9179137  71510 303681257      68 960        syn-C2H3C(O)NH2, v=0
  935405.8258  0.0071 -4.8752 3  286.2001 95  71510 303471235      46 938        syn-C2H3C(O)NH2, v=0
  935414.5531  0.0175 -2.8769 3  675.2456101  71510 3035041 9      494010        syn-C2H3C(O)NH2, v=0
  935414.5531  0.0175 -2.8769 3  675.2456101  71510 303504110      4940 9        syn-C2H3C(O)NH2, v=0
  935438.1305  0.0082 -3.8496 3  621.4104137  71510 303681652      671553        syn-C2H3C(O)NH2, v=0
  935571.5373  0.2717 -5.5064 3 1829.4435231  71510 303B52987      B42886        syn-C2H3C(O)NH2, v=0
  935586.0310  0.0051 -4.4736 3  315.2239109  71510 30354 450      53 351        syn-C2H3C(O)NH2, v=0
  935586.0310  0.0051 -4.4736 3  315.2239109  71510 30354 550      53 251        syn-C2H3C(O)NH2, v=0
  935692.9064  0.0069 -5.3399 3  622.6492141  71510 303701258      70 961        syn-C2H3C(O)NH2, v=0
  935695.9685  0.0069 -5.3399 3  622.6492141  71510 303701358      701061        syn-C2H3C(O)NH2, v=0
  935773.7250  0.0219 -3.8974 3 1020.5505171  71510 303852560      842461        syn-C2H3C(O)NH2, v=0
  935829.1591  0.0144 -2.9002 3  681.2503105  71510 303524012      513913        syn-C2H3C(O)NH2, v=0
  935829.1591  0.0144 -2.9002 3  681.2503105  71510 303524013      513912        syn-C2H3C(O)NH2, v=0
  935884.4931  0.0054 -3.8153 3  580.6554133  71510 303661551      651452        syn-C2H3C(O)NH2, v=0
  935893.7323  0.0079 -3.3220 3  824.2376145  71510 303723042      712943        syn-C2H3C(O)NH2, v=0
  935893.7323  0.0079 -3.3220 3  824.2376145  71510 303723043      712942        syn-C2H3C(O)NH2, v=0
  936087.8864  0.0135 -3.5846 3  917.9496159  71510 303792753      782652        syn-C2H3C(O)NH2, v=0
  936091.5128  0.0135 -3.5846 3  917.9495159  71510 303792752      782653        syn-C2H3C(O)NH2, v=0
  936177.4487  0.0033 -5.3888 3  391.9522 97  71510 303482424      482127        syn-C2H3C(O)NH2, v=0
  936177.4489  0.0033 -5.3888 3  391.9522 97  71510 303482425      482128        syn-C2H3C(O)NH2, v=0
  936221.1095  0.0119 -2.9264 3  688.7315109  71510 303543915      533816        syn-C2H3C(O)NH2, v=0
  936221.1095  0.0119 -2.9264 3  688.7315109  71510 303543916      533815        syn-C2H3C(O)NH2, v=0
  936331.2334  0.0470 -4.0672 3 1003.1791171  71510 303852362      842263        syn-C2H3C(O)NH2, v=0
  936582.1404  0.0098 -2.9557 3  697.6961113  71510 303563818      553719        syn-C2H3C(O)NH2, v=0
  936582.1404  0.0098 -2.9557 3  697.6961113  71510 303563819      553718        syn-C2H3C(O)NH2, v=0
  936696.4956  0.0070 -3.2607 3  802.9171141  71510 303703139      693040        syn-C2H3C(O)NH2, v=0
  936696.4956  0.0070 -3.2607 3  802.9171141  71510 303703140      693039        syn-C2H3C(O)NH2, v=0
  936901.3605  0.0082 -2.9881 3  708.1521117  71510 303583721      573622        syn-C2H3C(O)NH2, v=0
  936901.3605  0.0082 -2.9881 3  708.1521117  71510 303583722      573621        syn-C2H3C(O)NH2, v=0
  936903.7966  0.0170 -3.7252 3  967.3886165  71510 303822657      812556        syn-C2H3C(O)NH2, v=0
  936919.4847  0.0023 -4.5971 3  258.4127 85  71510 303421726      411427        syn-C2H3C(O)NH2, v=0
  937093.9186  0.0170 -3.7250 3  967.3834165  71510 303822656      812557        syn-C2H3C(O)NH2, v=0
  937096.8398  0.0023 -4.5970 3  258.4068 85  71510 303421725      411428        syn-C2H3C(O)NH2, v=0
  937164.4137  0.0070 -3.0240 3  720.1092121  71510 303603624      593525        syn-C2H3C(O)NH2, v=0
  937164.4137  0.0070 -3.0240 3  720.1092121  71510 303603625      593524        syn-C2H3C(O)NH2, v=0
  937166.5461  0.0064 -3.2047 3  783.2210137  71510 303683236      673137        syn-C2H3C(O)NH2, v=0
  937166.5461  0.0064 -3.2047 3  783.2210137  71510 303683237      673136        syn-C2H3C(O)NH2, v=0
  937352.3235  0.0063 -3.0633 3  733.5791125  71510 303623527      613428        syn-C2H3C(O)NH2, v=0
  937352.3235  0.0063 -3.0633 3  733.5791125  71510 303623528      613427        syn-C2H3C(O)NH2, v=0
  937393.2352  0.0060 -3.1534 3  765.1159133  71510 303663333      653234        syn-C2H3C(O)NH2, v=0
  937393.2352  0.0060 -3.1534 3  765.1159133  71510 303663334      653233        syn-C2H3C(O)NH2, v=0
  937439.8678  0.0060 -3.1063 3  748.5756129  71510 303643430      633331        syn-C2H3C(O)NH2, v=0
  937439.8678  0.0060 -3.1063 3  748.5756129  71510 303643431      633330        syn-C2H3C(O)NH2, v=0
  937526.5547  0.0040 -5.1532 3  642.3259131  71510 303652540      652243        syn-C2H3C(O)NH2, v=0
  937534.6956  0.0040 -5.1532 3  642.3256131  71510 303652541      652244        syn-C2H3C(O)NH2, v=0
  937696.3098  0.0036 -4.2208 3  383.3474107  71510 303531637      521340        syn-C2H3C(O)NH2, v=0
  937783.5299  0.0033 -5.4250 3  380.1092 95  71510 303472423      472126        syn-C2H3C(O)NH2, v=0
  937783.5300  0.0033 -5.4250 3  380.1092 95  71510 303472424      472127        syn-C2H3C(O)NH2, v=0
  938265.3460  0.0049 -3.8659 3  611.8731135  71510 303671850      661551        syn-C2H3C(O)NH2, v=0
  938668.5923  0.0272 -5.3468 3  874.1042163  71510 303811764      811467        syn-C2H3C(O)NH2, v=0
  938927.0448  0.0042 -4.2920 3  376.7851105  71510 303521736      511437        syn-C2H3C(O)NH2, v=0
  939002.8109  0.0516 -4.0740 3  952.3812167  71510 303832261      822162        syn-C2H3C(O)NH2, v=0
  939144.6512  0.0377 -4.0269 3  834.7330157  71510 303782058      771959        syn-C2H3C(O)NH2, v=0
  939221.0354  0.0269 -5.3463 3  874.1043163  71510 303811864      811567        syn-C2H3C(O)NH2, v=0
  939253.4241  0.0116 -3.4988 3  890.8494155  71510 303772850      762749        syn-C2H3C(O)NH2, v=0
  939253.5124  0.0116 -3.4988 3  890.8494155  71510 303772849      762750        syn-C2H3C(O)NH2, v=0
  939285.9502  0.0033 -5.4639 3  368.5215 93  71510 303462422      462125        syn-C2H3C(O)NH2, v=0
  939285.9503  0.0033 -5.4639 3  368.5215 93  71510 303462423      462126        syn-C2H3C(O)NH2, v=0
  939708.2050  0.0052 -4.3136 3  377.4346107  71510 303531538      521241        syn-C2H3C(O)NH2, v=0
  939779.6191  0.0034 -3.7983 3  517.5555127  71510 303631350      621251        syn-C2H3C(O)NH2, v=0
  939842.6873  0.0041 -4.2961 3  336.6992111  71510 30355 550      54 451        syn-C2H3C(O)NH2, v=0
  939842.6874  0.0041 -4.2961 3  336.6992111  71510 30355 650      54 351        syn-C2H3C(O)NH2, v=0
  940209.7229  0.0104 -5.2310 3  828.8988151  71510 303752649      752352        syn-C2H3C(O)NH2, v=0
  940234.6514  0.0255 -5.3831 3  999.3181167  71510 303832756      832459        syn-C2H3C(O)NH2, v=0
  940337.5962  0.0020 -5.0833 3  190.4307 69  71510 303341817      331518        syn-C2H3C(O)NH2, v=0
  940337.6197  0.0020 -5.0833 3  190.4307 69  71510 303341816      331519        syn-C2H3C(O)NH2, v=0
  940549.0810  0.0103 -5.2307 3  828.8874151  71510 303752650      752353        syn-C2H3C(O)NH2, v=0
  940690.2156  0.0033 -5.5056 3  357.1886 91  71510 303452421      452124        syn-C2H3C(O)NH2, v=0
  940690.2156  0.0033 -5.5056 3  357.1886 91  71510 303452422      452125        syn-C2H3C(O)NH2, v=0
  940803.4577  0.0035 -5.2119 3  227.0250 83  71510 303411428      40 931        syn-C2H3C(O)NH2, v=0
  940855.4222  0.0024 -4.5590 3  268.9411 87  71510 303431727      421428        syn-C2H3C(O)NH2, v=0
  940950.5913  0.0047 -5.0701 3  237.5095 87  71510 303431232      42 735        syn-C2H3C(O)NH2, v=0
  940972.9636  0.0033 -3.7975 3  517.5547127  71510 303631450      621151        syn-C2H3C(O)NH2, v=0
  941187.6408  0.0024 -4.5588 3  268.9301 87  71510 303431726      421429        syn-C2H3C(O)NH2, v=0
  941258.5227  0.0530 -5.4422 3  997.4013173  71510 303861967      861670        syn-C2H3C(O)NH2, v=0
  941320.1560  0.0300 -2.8401 3  676.7197 91  71510 3034544 1      4443 2        syn-C2H3C(O)NH2, v=0
  941320.1560  0.0300 -2.8401 3  676.7197 91  71510 3034544 2      4443 1        syn-C2H3C(O)NH2, v=0
  941354.8981  0.0100 -3.4224 3  865.5724151  71510 303752947      742846        syn-C2H3C(O)NH2, v=0
  941354.8997  0.0100 -3.4224 3  865.5724151  71510 303752946      742847        syn-C2H3C(O)NH2, v=0
  941490.0220  0.0038 -5.1595 3  626.0806129  71510 303642539      642242        syn-C2H3C(O)NH2, v=0
  941494.2854  0.0038 -5.1595 3  626.0805129  71510 303642540      642243        syn-C2H3C(O)NH2, v=0
  941532.9724  0.0038 -5.3431 3  216.7457 81  71510 303401427      39 930        syn-C2H3C(O)NH2, v=0
  941768.9004  0.0252 -2.8560 3  678.8178 95  71510 3034743 4      4642 5        syn-C2H3C(O)NH2, v=0
  941768.9004  0.0252 -2.8560 3  678.8178 95  71510 3034743 5      4642 4        syn-C2H3C(O)NH2, v=0
  941824.2379  0.0242 -3.9477 3 1042.1650173  71510 303862561      852462        syn-C2H3C(O)NH2, v=0
  942208.4493  0.0210 -2.8746 3  682.3787 99  71510 3034942 7      4841 8        syn-C2H3C(O)NH2, v=0
  942208.4493  0.0210 -2.8746 3  682.3787 99  71510 3034942 8      4841 7        syn-C2H3C(O)NH2, v=0
  942312.4090  0.0147 -3.6230 3  937.7159161  71510 303802754      792653        syn-C2H3C(O)NH2, v=0
  942319.1800  0.0147 -3.6230 3  937.7157161  71510 303802753      792654        syn-C2H3C(O)NH2, v=0
  942486.7732  0.0184 -3.7681 3  988.0569167  71510 303832658      822557        syn-C2H3C(O)NH2, v=0
  942635.0008  0.0174 -2.8959 3  687.4070103  71510 303514110      504011        syn-C2H3C(O)NH2, v=0
  942635.0008  0.0174 -2.8959 3  687.4070103  71510 303514111      504010        syn-C2H3C(O)NH2, v=0
  942745.7092  0.0087 -3.3535 3  842.0342147  71510 303733043      722944        syn-C2H3C(O)NH2, v=0
  942745.7092  0.0087 -3.3535 3  842.0342147  71510 303733044      722943        syn-C2H3C(O)NH2, v=0
  942815.6078  0.0185 -3.7678 3  988.0480167  71510 303832657      822558        syn-C2H3C(O)NH2, v=0
  943043.4866  0.0144 -2.9201 3  693.9077107  71510 303534013      523914        syn-C2H3C(O)NH2, v=0
  943043.4866  0.0144 -2.9201 3  693.9077107  71510 303534014      523913        syn-C2H3C(O)NH2, v=0
  943096.2215  0.0058 -4.1033 3  513.3103123  71510 303611844      601545        syn-C2H3C(O)NH2, v=0
  943185.6307  0.0239 -5.3807 3  999.2194167  71510 303832757      832460        syn-C2H3C(O)NH2, v=0
  943198.8205  0.0034 -5.1043 3  237.4683 85  71510 303421429      41 932        syn-C2H3C(O)NH2, v=0
  943427.2025  0.0119 -2.9473 3  701.8868111  71510 303553916      543817        syn-C2H3C(O)NH2, v=0
  943427.2025  0.0119 -2.9473 3  701.8868111  71510 303553917      543816        syn-C2H3C(O)NH2, v=0
  943462.3025  0.0035 -4.1652 3  358.4528113  71510 30356 650      55 551        syn-C2H3C(O)NH2, v=0
  943462.3038  0.0035 -4.1652 3  358.4528113  71510 30356 750      55 451        syn-C2H3C(O)NH2, v=0
  943538.1477  0.0079 -5.1799 3  283.7509107  71510 30353 251      52 152        syn-C2H3C(O)NH2, v=0
  943538.1477  0.0079 -5.1799 3  283.7509107  71510 30353 351      52 052        syn-C2H3C(O)NH2, v=0
  943640.7038  0.0077 -3.2907 3  820.1743143  71510 303713140      703041        syn-C2H3C(O)NH2, v=0
  943640.7038  0.0077 -3.2907 3  820.1743143  71510 303713141      703040        syn-C2H3C(O)NH2, v=0
  943656.9970  0.0051 -3.8213 3  604.7589135  71510 303671751      661452        syn-C2H3C(O)NH2, v=0
  943662.7087  0.0507 -5.4403 3  997.4015173  71510 303862067      861770        syn-C2H3C(O)NH2, v=0
  943777.3191  0.0099 -2.9775 3  711.3514115  71510 303573819      563720        syn-C2H3C(O)NH2, v=0
  943777.3191  0.0099 -2.9775 3  711.3514115  71510 303573820      563719        syn-C2H3C(O)NH2, v=0
  944082.2272  0.0083 -3.0110 3  722.3100119  71510 303593722      583623        syn-C2H3C(O)NH2, v=0
  944082.2272  0.0083 -3.0110 3  722.3100119  71510 303593723      583622        syn-C2H3C(O)NH2, v=0
  944120.5254  0.0927 -4.5151 3 1284.6394193  71510 303962671      952570        syn-C2H3C(O)NH2, v=0
  944180.0577  0.0069 -3.2333 3  799.9475139  71510 303693237      683138        syn-C2H3C(O)NH2, v=0
  944180.0577  0.0069 -3.2333 3  799.9475139  71510 303693238      683137        syn-C2H3C(O)NH2, v=0
  944274.8596  0.0198 -3.9504 3  724.4200147  71510 303731855      721756        syn-C2H3C(O)NH2, v=0
  944326.6481  0.0072 -3.0479 3  734.7726123  71510 303613625      603526        syn-C2H3C(O)NH2, v=0
  944326.6482  0.0072 -3.0479 3  734.7726123  71510 303613626      603525        syn-C2H3C(O)NH2, v=0
  944379.2497  0.0025 -4.5229 3  279.7434 89  71510 303441728      431429        syn-C2H3C(O)NH2, v=0
  944459.5223  0.0065 -3.1807 3  781.3188135  71510 303673334      663235        syn-C2H3C(O)NH2, v=0
  944459.5223  0.0065 -3.1807 3  781.3188135  71510 303673335      663234        syn-C2H3C(O)NH2, v=0
  944490.4043  0.0066 -3.0883 3  748.7513127  71510 303633528      623429        syn-C2H3C(O)NH2, v=0
  944490.4043  0.0066 -3.0883 3  748.7513127  71510 303633529      623428        syn-C2H3C(O)NH2, v=0
  944546.6830  0.0063 -3.1325 3  764.2607131  71510 303653431      643332        syn-C2H3C(O)NH2, v=0
  944546.6830  0.0063 -3.1325 3  764.2607131  71510 303653432      643331        syn-C2H3C(O)NH2, v=0
  944939.4467  0.0070 -5.0960 3  258.1826 91  71510 303451134      44 837        syn-C2H3C(O)NH2, v=0
  944986.8176  0.0025 -4.5224 3  279.7231 89  71510 303441727      431430        syn-C2H3C(O)NH2, v=0
  945049.3101  0.0038 -4.3184 3  363.5373103  71510 303511735      501436        syn-C2H3C(O)NH2, v=0
  945068.3142  0.0042 -5.4934 3  206.6398 79  71510 303391426      38 929        syn-C2H3C(O)NH2, v=0
  945170.6426  0.0200 -5.3336 3  824.6299159  71510 303791663      791366        syn-C2H3C(O)NH2, v=0
  945219.8279  0.0037 -5.1672 3  610.1027127  71510 303632538      632241        syn-C2H3C(O)NH2, v=0
  945222.0269  0.0037 -5.1672 3  610.1026127  71510 303632539      632242        syn-C2H3C(O)NH2, v=0
  945349.3173  0.0031 -3.8158 3  494.1986125  71510 303621250      611151        syn-C2H3C(O)NH2, v=0
  945365.8566  0.0199 -5.3334 3  824.6299159  71510 303791763      791466        syn-C2H3C(O)NH2, v=0
  945595.9998  0.0031 -3.8156 3  494.1984125  71510 303621350      611051        syn-C2H3C(O)NH2, v=0
  945662.9126  0.0407 -4.0800 3 1055.2631175  71510 303872463      862364        syn-C2H3C(O)NH2, v=0
  945758.2208  0.0127 -3.5347 3  910.0258157  71510 303782851      772750        syn-C2H3C(O)NH2, v=0
  945758.3962  0.0127 -3.5347 3  910.0258157  71510 303782850      772751        syn-C2H3C(O)NH2, v=0
  945839.7671  0.0178 -5.4813 3  761.0227149  71510 303742153      741658        syn-C2H3C(O)NH2, v=0
  945902.1921  0.0042 -4.9448 3  253.6105 89  71510 303441332      43 835        syn-C2H3C(O)NH2, v=0
  946367.2575  0.0030 -4.0653 3  380.4752115  71510 30357 750      56 651        syn-C2H3C(O)NH2, v=0
  946367.2714  0.0030 -4.0653 3  380.4752115  71510 30357 850      56 551        syn-C2H3C(O)NH2, v=0
  946429.5776  0.0093 -5.2255 3  809.9949149  71510 303742648      742351        syn-C2H3C(O)NH2, v=0
  946445.5692  0.0020 -5.0240 3  198.8232 71  71510 303351818      341519        syn-C2H3C(O)NH2, v=0
  946445.6283  0.0020 -5.0240 3  198.8232 71  71510 303351817      341520        syn-C2H3C(O)NH2, v=0
  946625.7989  0.0092 -5.2253 3  809.9883149  71510 303742649      742352        syn-C2H3C(O)NH2, v=0
  946926.2556  0.2569 -5.1593 3 1618.5473217  71510 303A82881      A72780        syn-C2H3C(O)NH2, v=0
  947403.4901  0.0026 -4.4886 3  290.8234 91  71510 303451729      441430        syn-C2H3C(O)NH2, v=0
  947477.3439  0.3031 -5.4665 3 1799.7429229  71510 303B42986      B32885        syn-C2H3C(O)NH2, v=0
  947886.9682  0.0199 -3.8123 3 1009.0068169  71510 303842659      832558        syn-C2H3C(O)NH2, v=0
  947984.5677  0.0044 -3.8088 3  580.6408133  71510 303661651      651352        syn-C2H3C(O)NH2, v=0
  948047.5947  0.0110 -3.4564 3  884.1800153  71510 303762948      752847        syn-C2H3C(O)NH2, v=0
  948047.5980  0.0110 -3.4564 3  884.1800153  71510 303762947      752848        syn-C2H3C(O)NH2, v=0
  948341.5882  0.0052 -5.2649 3  221.5669 85  71510 303421132      41 635        syn-C2H3C(O)NH2, v=0
  948377.8546  0.0030 -3.8425 3  471.0205123  71510 303611150      601051        syn-C2H3C(O)NH2, v=0
  948387.1001  0.0272 -4.0001 3 1064.0617175  71510 303872562      862463        syn-C2H3C(O)NH2, v=0
  948422.7577  0.0030 -3.8425 3  471.0205123  71510 303611250      60 951        syn-C2H3C(O)NH2, v=0
  948448.4800  0.0200 -3.8118 3 1008.9916169  71510 303842658      832559        syn-C2H3C(O)NH2, v=0
  948460.3261  0.0029 -3.9874 3  402.7557117  71510 30358 850      57 751        syn-C2H3C(O)NH2, v=0
  948460.4537  0.0029 -3.9874 3  402.7557117  71510 30358 950      57 651        syn-C2H3C(O)NH2, v=0
  948462.7146  0.0160 -3.6622 3  957.7525163  71510 303812755      802654        syn-C2H3C(O)NH2, v=0
  948475.2030  0.0160 -3.6622 3  957.7521163  71510 303812754      802655        syn-C2H3C(O)NH2, v=0
  948488.3220  0.0026 -4.4878 3  290.7873 91  71510 303451728      441431        syn-C2H3C(O)NH2, v=0
  948548.6634  0.0298 -2.8571 3  687.6461 93  71510 3034644 2      4543 3        syn-C2H3C(O)NH2, v=0
  948548.6634  0.0298 -2.8571 3  687.6461 93  71510 3034644 3      4543 2        syn-C2H3C(O)NH2, v=0
  948731.3895  0.0036 -5.1763 3  594.3909125  71510 303622537      622240        syn-C2H3C(O)NH2, v=0
  948732.5064  0.0036 -5.1763 3  594.3909125  71510 303622538      622241        syn-C2H3C(O)NH2, v=0
  948807.5714  0.0034 -5.0215 3  248.0743 87  71510 303431430      42 933        syn-C2H3C(O)NH2, v=0
  948833.7292  0.1732 -4.8414 3 1446.7138205  71510 303A22776      A12675        syn-C2H3C(O)NH2, v=0
  948904.0167  0.0065 -4.7463 3  305.0472109  71510 30354 351      53 252        syn-C2H3C(O)NH2, v=0
  948904.0167  0.0065 -4.7463 3  305.0472109  71510 30354 451      53 152        syn-C2H3C(O)NH2, v=0
  948994.9723  0.0250 -2.8739 3  690.2363 97  71510 3034843 5      4742 6        syn-C2H3C(O)NH2, v=0
  948994.9723  0.0250 -2.8739 3  690.2363 97  71510 3034843 6      4742 5        syn-C2H3C(O)NH2, v=0
  949148.5440  0.0035 -4.3436 3  350.6274101  71510 303501734      491435        syn-C2H3C(O)NH2, v=0
  949322.3702  0.0055 -3.8647 3  628.8230137  71510 303681851      671552        syn-C2H3C(O)NH2, v=0
  949366.2465  0.0224 -5.3689 3  978.2329165  71510 303822755      822458        syn-C2H3C(O)NH2, v=0
  949430.9980  0.0209 -2.8933 3  694.2907101  71510 3035042 8      4941 9        syn-C2H3C(O)NH2, v=0
  949430.9980  0.0209 -2.8933 3  694.2907101  71510 3035042 9      4941 8        syn-C2H3C(O)NH2, v=0
  949537.1351  0.0040 -4.2297 3  396.6737109  71510 303541638      531341        syn-C2H3C(O)NH2, v=0
  949571.7871  0.0095 -3.3857 3  860.0885149  71510 303743044      732945        syn-C2H3C(O)NH2, v=0
  949571.7871  0.0095 -3.3857 3  860.0885149  71510 303743045      732944        syn-C2H3C(O)NH2, v=0
  949616.5203  0.0029 -3.9265 3  425.2826119  71510 30359 950      58 851        syn-C2H3C(O)NH2, v=0
  949617.5449  0.0029 -3.9265 3  425.2826119  71510 303591050      58 751        syn-C2H3C(O)NH2, v=0
  949668.8419  0.0030 -3.8789 3  448.0426121  71510 303601050      59 951        syn-C2H3C(O)NH2, v=0
  949676.0633  0.0030 -3.8789 3  448.0426121  71510 303601150      59 851        syn-C2H3C(O)NH2, v=0
  949796.4776  0.0149 -5.3289 3  776.3645155  71510 303771562      771265        syn-C2H3C(O)NH2, v=0
  949807.6523  0.0027 -4.4561 3  302.1863 93  71510 303461730      451431        syn-C2H3C(O)NH2, v=0
  949852.6366  0.0174 -2.9155 3  699.8138105  71510 303524111      514012        syn-C2H3C(O)NH2, v=0
  949852.6366  0.0174 -2.9155 3  699.8138105  71510 303524112      514011        syn-C2H3C(O)NH2, v=0
  949861.7372  0.0148 -5.3289 3  776.3645155  71510 303771662      771365        syn-C2H3C(O)NH2, v=0
  950254.4444  0.0144 -2.9406 3  706.8110109  71510 303544014      533915        syn-C2H3C(O)NH2, v=0
  950254.4444  0.0144 -2.9406 3  706.8110109  71510 303544015      533914        syn-C2H3C(O)NH2, v=0
  950527.8424  0.0067 -5.3000 3  231.3856 87  71510 303431033      42 736        syn-C2H3C(O)NH2, v=0
  950564.6747  0.0084 -3.3214 3  837.6870145  71510 303723141      713042        syn-C2H3C(O)NH2, v=0
  950564.6747  0.0084 -3.3214 3  837.6870145  71510 303723142      713041        syn-C2H3C(O)NH2, v=0
  950629.2473  0.0119 -2.9687 3  715.2886113  71510 303563917      553818        syn-C2H3C(O)NH2, v=0
  950629.2473  0.0119 -2.9687 3  715.2886113  71510 303563918      553817        syn-C2H3C(O)NH2, v=0
  950967.6238  0.0100 -2.9999 3  725.2539117  71510 303583820      573721        syn-C2H3C(O)NH2, v=0
  950967.6238  0.0100 -2.9999 3  725.2539117  71510 303583821      573720        syn-C2H3C(O)NH2, v=0
  951177.4665  0.0075 -3.2626 3  816.9277141  71510 303703238      693139        syn-C2H3C(O)NH2, v=0
  951177.4665  0.0075 -3.2626 3  816.9277141  71510 303703239      693138        syn-C2H3C(O)NH2, v=0
  951190.8272  0.0216 -5.3674 3  978.1720165  71510 303822756      822459        syn-C2H3C(O)NH2, v=0
  951257.2115  0.0085 -3.0344 3  736.7158121  71510 303603723      593624        syn-C2H3C(O)NH2, v=0
  951257.2115  0.0085 -3.0344 3  736.7158121  71510 303603724      593623        syn-C2H3C(O)NH2, v=0
  951386.4058  0.0032 -4.3694 3  338.0483 99  71510 303491733      481434        syn-C2H3C(O)NH2, v=0
  951427.2222  0.0029 -4.4254 3  313.8388 95  71510 303471731      461432        syn-C2H3C(O)NH2, v=0
  951481.7628  0.0075 -3.0724 3  749.6847125  71510 303623626      613527        syn-C2H3C(O)NH2, v=0
  951481.7628  0.0075 -3.0724 3  749.6847125  71510 303623627      613526        syn-C2H3C(O)NH2, v=0
  951512.8300  0.0070 -3.2087 3  797.7739137  71510 303683335      673236        syn-C2H3C(O)NH2, v=0
  951512.8300  0.0070 -3.2087 3  797.7739137  71510 303683336      673235        syn-C2H3C(O)NH2, v=0
  951600.5952  0.0040 -3.8119 3  556.5883131  71510 303651451      641352        syn-C2H3C(O)NH2, v=0
  951619.8358  0.0069 -3.1139 3  764.1732129  71510 303643529      633430        syn-C2H3C(O)NH2, v=0
  951619.8358  0.0069 -3.1139 3  764.1732129  71510 303643530      633429        syn-C2H3C(O)NH2, v=0
  951642.9386  0.0068 -3.1593 3  780.1968133  71510 303663432      653333        syn-C2H3C(O)NH2, v=0
  951642.9386  0.0068 -3.1593 3  780.1968133  71510 303663433      653332        syn-C2H3C(O)NH2, v=0
  951698.2552  0.0027 -4.4549 3  302.1234 93  71510 303461729      451432        syn-C2H3C(O)NH2, v=0
  951910.3157  0.0396 -5.4121 3  944.9200169  71510 303841866      841569        syn-C2H3C(O)NH2, v=0
  952038.5379  0.0035 -5.1868 3  578.9442123  71510 303612536      612239        syn-C2H3C(O)NH2, v=0
  952039.0963  0.0035 -5.1868 3  578.9442123  71510 303612537      612240        syn-C2H3C(O)NH2, v=0
  952044.1914  0.0030 -4.3966 3  325.7893 97  71510 303481732      471433        syn-C2H3C(O)NH2, v=0
  952213.4561  0.0139 -3.5714 3  929.4670159  71510 303792852      782751        syn-C2H3C(O)NH2, v=0
  952213.8001  0.0139 -3.5714 3  929.4670159  71510 303792851      782752        syn-C2H3C(O)NH2, v=0
  952236.1794  0.0083 -5.2212 3  791.3698147  71510 303732647      732350        syn-C2H3C(O)NH2, v=0
  952307.6004  0.0059 -5.4728 3  553.4868135  71510 303671057      67 760        syn-C2H3C(O)NH2, v=0
  952307.7113  0.0059 -5.4728 3  553.4868135  71510 303671157      67 860        syn-C2H3C(O)NH2, v=0
  952348.0476  0.0083 -5.2211 3  791.3661147  71510 303732648      732351        syn-C2H3C(O)NH2, v=0
  952430.4118  0.0020 -4.9681 3  207.4720 73  71510 303361819      351520        syn-C2H3C(O)NH2, v=0
  952430.5554  0.0020 -4.9681 3  207.4720 73  71510 303361818      351521        syn-C2H3C(O)NH2, v=0
  952833.9763  0.0113 -5.3337 3  729.3175151  71510 303751461      751164        syn-C2H3C(O)NH2, v=0
  952839.4359  0.0389 -5.4114 3  944.9200169  71510 303841966      841669        syn-C2H3C(O)NH2, v=0
  952854.5971  0.0113 -5.3336 3  729.3175151  71510 303751561      751264        syn-C2H3C(O)NH2, v=0
  952995.4949  0.0503 -4.0870 3  902.8123163  71510 303812160      802061        syn-C2H3C(O)NH2, v=0
  953057.8838  0.0214 -3.8578 3 1030.2415171  71510 303852660      842559        syn-C2H3C(O)NH2, v=0
  953760.8835  0.0052 -4.4896 3  326.6388111  71510 30355 451      54 352        syn-C2H3C(O)NH2, v=0
  953760.8835  0.0052 -4.4896 3  326.6388111  71510 30355 551      54 252        syn-C2H3C(O)NH2, v=0
  953988.8448  0.0059 -4.1594 3  497.5038121  71510 303601843      591544        syn-C2H3C(O)NH2, v=0
  954004.3292  0.0217 -3.8571 3 1030.2160171  71510 303852659      842560        syn-C2H3C(O)NH2, v=0
  954115.1879  0.0066 -5.4163 3  595.5745139  71510 303691158      69 861        syn-C2H3C(O)NH2, v=0
  954115.6407  0.0066 -5.4163 3  595.5745139  71510 303691258      69 961        syn-C2H3C(O)NH2, v=0
  954477.2328  0.0090 -5.3488 3  683.4979147  71510 303731360      731063        syn-C2H3C(O)NH2, v=0
  954483.3798  0.0090 -5.3488 3  683.4979147  71510 303731460      731163        syn-C2H3C(O)NH2, v=0
  954531.7057  0.0174 -3.7025 3  978.0605165  71510 303822756      812655        syn-C2H3C(O)NH2, v=0
  954554.4605  0.0174 -3.7024 3  978.0599165  71510 303822755      812656        syn-C2H3C(O)NH2, v=0
  954640.9451  0.0028 -4.4235 3  313.7318 95  71510 303471730      461433        syn-C2H3C(O)NH2, v=0
  954704.3161  0.0120 -3.4910 3  903.0489155  71510 303772949      762848        syn-C2H3C(O)NH2, v=0
  954704.3231  0.0120 -3.4910 3  903.0489155  71510 303772948      762849        syn-C2H3C(O)NH2, v=0
  954815.9791  0.0038 -3.8097 3  556.5854131  71510 303651551      641252        syn-C2H3C(O)NH2, v=0
  954867.7905  0.0076 -5.3757 3  638.9141143  71510 303711259      71 962        syn-C2H3C(O)NH2, v=0
  954869.5141  0.0076 -5.3757 3  638.9141143  71510 303711359      711062        syn-C2H3C(O)NH2, v=0
  955153.7892  0.0035 -5.1988 3  563.7616121  71510 303602535      602238        syn-C2H3C(O)NH2, v=0
  955154.0639  0.0035 -5.1988 3  563.7616121  71510 303602536      602239        syn-C2H3C(O)NH2, v=0
  955278.5934  0.0747 -4.4419 3 1259.7564191  71510 303952670      942569        syn-C2H3C(O)NH2, v=0
  955323.7191  0.0350 -2.8597 3  697.1955 91  71510 3034545 0      4444 1        syn-C2H3C(O)NH2, v=0
  955323.7191  0.0350 -2.8597 3  697.1955 91  71510 3034545 1      4444 0        syn-C2H3C(O)NH2, v=0
  955764.2681  0.0312 -4.0549 3 1086.2383177  71510 303882563      872464        syn-C2H3C(O)NH2, v=0
  955775.3952  0.0296 -2.8746 3  698.8167 95  71510 3034744 3      4643 4        syn-C2H3C(O)NH2, v=0
  955775.3952  0.0296 -2.8746 3  698.8167 95  71510 3034744 4      4643 3        syn-C2H3C(O)NH2, v=0
  956218.9459  0.0249 -2.8922 3  701.8994 99  71510 3034943 6      4842 7        syn-C2H3C(O)NH2, v=0
  956218.9459  0.0249 -2.8922 3  701.8994 99  71510 3034943 7      4842 6        syn-C2H3C(O)NH2, v=0
  956370.6088  0.0104 -3.4186 3  878.4011151  71510 303753046      742945        syn-C2H3C(O)NH2, v=0
  956370.6089  0.0104 -3.4186 3  878.4011151  71510 303753045      742946        syn-C2H3C(O)NH2, v=0
  956651.0541  0.0208 -2.9125 3  706.4477103  71510 3035142 9      504110        syn-C2H3C(O)NH2, v=0
  956651.0541  0.0208 -2.9125 3  706.4477103  71510 303514210      5041 9        syn-C2H3C(O)NH2, v=0
  957067.3000  0.0173 -2.9355 3  712.4662107  71510 303534112      524013        syn-C2H3C(O)NH2, v=0
  957067.3000  0.0173 -2.9355 3  712.4662107  71510 303534113      524012        syn-C2H3C(O)NH2, v=0
  957365.9986  0.0029 -4.3937 3  325.6123 97  71510 303481731      471434        syn-C2H3C(O)NH2, v=0
  957461.8468  0.0144 -2.9616 3  719.9604111  71510 303554015      543916        syn-C2H3C(O)NH2, v=0
  957461.8468  0.0144 -2.9616 3  719.9604111  71510 303554016      543915        syn-C2H3C(O)NH2, v=0
  957467.4083  0.0092 -3.3528 3  855.4557147  71510 303733142      723043        syn-C2H3C(O)NH2, v=0
  957467.4083  0.0092 -3.3528 3  855.4557147  71510 303733143      723042        syn-C2H3C(O)NH2, v=0
  957554.6356  0.0035 -4.9622 3  258.8467 89  71510 303441431      43 934        syn-C2H3C(O)NH2, v=0
  957673.4366  0.0074 -5.2180 3  773.0212145  71510 303722646      722349        syn-C2H3C(O)NH2, v=0
  957685.7965  0.0199 -5.3560 3  957.4449163  71510 303812754      812457        syn-C2H3C(O)NH2, v=0
  957687.5185  0.0131 -3.9120 3  680.7318143  71510 303711754      701655        syn-C2H3C(O)NH2, v=0
  957736.3267  0.0074 -5.2180 3  773.0191145  71510 303722647      722350        syn-C2H3C(O)NH2, v=0
  957827.0288  0.0120 -2.9906 3  728.9371115  71510 303573918      563819        syn-C2H3C(O)NH2, v=0
  957827.0288  0.0120 -2.9906 3  728.9371115  71510 303573919      563818        syn-C2H3C(O)NH2, v=0
  957932.9485  0.0230 -3.9049 3 1051.7645173  71510 303862661      852560        syn-C2H3C(O)NH2, v=0
  957980.0306  0.0607 -4.1422 3 1024.8594173  71510 303862363      852264        syn-C2H3C(O)NH2, v=0
  958058.9732  0.0042 -4.3129 3  348.5178113  71510 30356 551      55 452        syn-C2H3C(O)NH2, v=0
  958058.9732  0.0042 -4.3129 3  348.5178113  71510 30356 651      55 352        syn-C2H3C(O)NH2, v=0
  958088.5488  0.0035 -5.2124 3  548.8421119  71510 303592534      592237        syn-C2H3C(O)NH2, v=0
  958088.6817  0.0035 -5.2124 3  548.8421119  71510 303592535      592238        syn-C2H3C(O)NH2, v=0
  958152.8040  0.0101 -3.0229 3  739.4038119  71510 303593821      583722        syn-C2H3C(O)NH2, v=0
  958152.8040  0.0101 -3.0229 3  739.4038119  71510 303593822      583721        syn-C2H3C(O)NH2, v=0
  958158.0035  0.0082 -3.2926 3  834.1620143  71510 303713239      703140        syn-C2H3C(O)NH2, v=0
  958158.0035  0.0082 -3.2926 3  834.1620143  71510 303713240      703139        syn-C2H3C(O)NH2, v=0
  958175.6181  0.0023 -5.4712 3  166.6445 61  71510 303301911      291614        syn-C2H3C(O)NH2, v=0
  958175.6181  0.0023 -5.4712 3  166.6445 61  71510 303301912      291613        syn-C2H3C(O)NH2, v=0
  958281.6686  0.0020 -4.9153 3  216.3780 75  71510 303371820      361521        syn-C2H3C(O)NH2, v=0
  958282.0074  0.0020 -4.9153 3  216.3779 75  71510 303371819      361522        syn-C2H3C(O)NH2, v=0
  958426.0204  0.0087 -3.0584 3  751.3697123  71510 303613724      603625        syn-C2H3C(O)NH2, v=0
  958426.0204  0.0087 -3.0584 3  751.3697123  71510 303613725      603624        syn-C2H3C(O)NH2, v=0
  958552.5478  0.0076 -3.2373 3  814.4815139  71510 303693336      683237        syn-C2H3C(O)NH2, v=0
  958552.5478  0.0076 -3.2373 3  814.4815139  71510 303693337      683236        syn-C2H3C(O)NH2, v=0
  958615.7526  0.0151 -3.6090 3  949.1742161  71510 303802853      792752        syn-C2H3C(O)NH2, v=0
  958616.4189  0.0151 -3.6090 3  949.1742161  71510 303802852      792753        syn-C2H3C(O)NH2, v=0
  958629.4125  0.0078 -3.0974 3  764.8458127  71510 303633627      623528        syn-C2H3C(O)NH2, v=0
  958629.4125  0.0078 -3.0974 3  764.8458127  71510 303633628      623527        syn-C2H3C(O)NH2, v=0
  958728.1381  0.0072 -3.1866 3  796.3839135  71510 303673433      663334        syn-C2H3C(O)NH2, v=0
  958728.1381  0.0072 -3.1866 3  796.3839135  71510 303673434      663333        syn-C2H3C(O)NH2, v=0
  958740.2069  0.0073 -3.1401 3  779.8452131  71510 303653530      643431        syn-C2H3C(O)NH2, v=0
  958740.2069  0.0073 -3.1401 3  779.8452131  71510 303653531      643430        syn-C2H3C(O)NH2, v=0
  958797.0108  0.0194 -5.3551 3  957.4077163  71510 303812755      812458        syn-C2H3C(O)NH2, v=0
  959507.1853  0.0235 -3.9036 3 1051.7224173  71510 303862660      852561        syn-C2H3C(O)NH2, v=0
  959740.2205  0.0299 -4.0169 3  788.1232153  71510 303761957      751858        syn-C2H3C(O)NH2, v=0
  959865.1785  0.0296 -5.3897 3  893.6293165  71510 303821765      821468        syn-C2H3C(O)NH2, v=0
  959885.0789  0.0054 -3.8357 3  596.8047135  71510 303671552      661453        syn-C2H3C(O)NH2, v=0
  959955.6489  0.0030 -4.3654 3  337.7635 99  71510 303491732      481435        syn-C2H3C(O)NH2, v=0
  960083.4935  0.0034 -3.8200 3  532.6523129  71510 303641351      631252        syn-C2H3C(O)NH2, v=0
  960204.8429  0.0294 -5.3894 3  893.6293165  71510 303821865      821568        syn-C2H3C(O)NH2, v=0
  960327.9874  0.0070 -4.5443 3  358.3369105  71510 303521438      511141        syn-C2H3C(O)NH2, v=0
  960510.7564  0.0189 -3.7436 3  998.6415167  71510 303832757      822656        syn-C2H3C(O)NH2, v=0
  960551.7182  0.0189 -3.7436 3  998.6404167  71510 303832756      822657        syn-C2H3C(O)NH2, v=0
  960733.8633  0.0527 -4.1477 3 1077.4808177  71510 303882464      872365        syn-C2H3C(O)NH2, v=0
  960816.1252  0.0034 -3.8195 3  532.6518129  71510 303641451      631152        syn-C2H3C(O)NH2, v=0
  960853.2695  0.0035 -5.2275 3  534.1848117  71510 303582533      582236        syn-C2H3C(O)NH2, v=0
  960853.3328  0.0035 -5.2275 3  534.1848117  71510 303582534      582237        syn-C2H3C(O)NH2, v=0
  961322.9634  0.0131 -3.5264 3  922.1796157  71510 303782950      772849        syn-C2H3C(O)NH2, v=0
  961322.9779  0.0131 -3.5264 3  922.1796157  71510 303782949      772850        syn-C2H3C(O)NH2, v=0
  961670.7047  0.0082 -5.1948 3  294.5609109  71510 30354 252      53 153        syn-C2H3C(O)NH2, v=0
  961670.7047  0.0082 -5.1948 3  294.5609109  71510 30354 352      53 053        syn-C2H3C(O)NH2, v=0
  961738.4933  0.0035 -4.1829 3  370.6755115  71510 30357 651      56 552        syn-C2H3C(O)NH2, v=0
  961738.4940  0.0035 -4.1829 3  370.6755115  71510 30357 751      56 452        syn-C2H3C(O)NH2, v=0
  961934.8435  0.0057 -3.8403 3  621.3691137  71510 303681752      671453        syn-C2H3C(O)NH2, v=0
  962208.1240  0.3250 -5.4225 3 1770.1648227  71510 303B32985      B22884        syn-C2H3C(O)NH2, v=0
  962416.7424  0.0246 -3.9536 3 1073.5809175  71510 303872662      862561        syn-C2H3C(O)NH2, v=0
  962531.4230  0.0030 -4.3388 3  350.1829101  71510 303501733      491436        syn-C2H3C(O)NH2, v=0
  962550.6987  0.0348 -2.8769 3  708.1188 93  71510 3034645 1      4544 2        syn-C2H3C(O)NH2, v=0
  962550.6987  0.0348 -2.8769 3  708.1188 93  71510 3034645 2      4544 1        syn-C2H3C(O)NH2, v=0
  962662.9889  0.0083 -3.8701 3  638.1903139  71510 303691653      681554        syn-C2H3C(O)NH2, v=0
  962776.4747  0.0067 -5.2161 3  754.9471143  71510 303712645      712348        syn-C2H3C(O)NH2, v=0
  962811.3395  0.0067 -5.2161 3  754.9459143  71510 303712646      712349        syn-C2H3C(O)NH2, v=0
  962920.1615  0.0063 -3.8720 3  645.9326139  71510 303691852      681553        syn-C2H3C(O)NH2, v=0
  963000.2438  0.0295 -2.8926 3  710.2318 97  71510 3034844 4      4743 5        syn-C2H3C(O)NH2, v=0
  963000.2438  0.0295 -2.8926 3  710.2318 97  71510 3034844 5      4743 4        syn-C2H3C(O)NH2, v=0
  963140.7343  0.0114 -3.4522 3  896.9726153  71510 303763047      752946        syn-C2H3C(O)NH2, v=0
  963140.7346  0.0114 -3.4522 3  896.9726153  71510 303763046      752947        syn-C2H3C(O)NH2, v=0
  963440.6971  0.0248 -2.9110 3  713.8074101  71510 3035043 7      4942 8        syn-C2H3C(O)NH2, v=0
  963440.6971  0.0248 -2.9110 3  713.8074101  71510 3035043 8      4942 7        syn-C2H3C(O)NH2, v=0
  963457.5767  0.0035 -5.2443 3  519.7888115  71510 303572532      572235        syn-C2H3C(O)NH2, v=0
  963457.6063  0.0035 -5.2443 3  519.7888115  71510 303572533      572236        syn-C2H3C(O)NH2, v=0
  963617.1973  0.0590 -4.3694 3 1235.2440189  71510 303942669      932568        syn-C2H3C(O)NH2, v=0
  963868.4744  0.0207 -2.9321 3  718.8499105  71510 303524210      514111        syn-C2H3C(O)NH2, v=0
  963868.4744  0.0207 -2.9321 3  718.8499105  71510 303524211      514110        syn-C2H3C(O)NH2, v=0
  963987.8921  0.0021 -4.8654 3  225.5422 77  71510 303381821      371522        syn-C2H3C(O)NH2, v=0
  963988.6673  0.0021 -4.8654 3  225.5421 77  71510 303381820      371523        syn-C2H3C(O)NH2, v=0
  964220.3788  0.0044 -4.2513 3  410.2116111  71510 303551639      541342        syn-C2H3C(O)NH2, v=0
  964278.8255  0.0173 -2.9561 3  725.3642109  71510 303544113      534014        syn-C2H3C(O)NH2, v=0
  964278.8255  0.0173 -2.9561 3  725.3642109  71510 303544114      534013        syn-C2H3C(O)NH2, v=0
  964347.8530  0.0100 -3.3848 3  873.4808149  71510 303743143      733044        syn-C2H3C(O)NH2, v=0
  964347.8530  0.0100 -3.3848 3  873.4808149  71510 303743144      733043        syn-C2H3C(O)NH2, v=0
  964357.8022  0.0369 -4.1127 3 1108.6912179  71510 303892564      882465        syn-C2H3C(O)NH2, v=0
  964613.3537  0.2497 -5.1038 3 1590.3561215  71510 303A72880      A62779        syn-C2H3C(O)NH2, v=0
  964665.5027  0.0144 -2.9831 3  733.3561113  71510 303564016      553917        syn-C2H3C(O)NH2, v=0
  964665.5027  0.0144 -2.9831 3  733.3561113  71510 303564017      553916        syn-C2H3C(O)NH2, v=0
  964726.4696  0.0031 -4.0837 3  393.1028117  71510 30358 751      57 652        syn-C2H3C(O)NH2, v=0
  964726.4768  0.0031 -4.0837 3  393.1028117  71510 30358 851      57 552        syn-C2H3C(O)NH2, v=0
  964822.5933  0.0023 -5.3911 3  174.0074 63  71510 303311912      301615        syn-C2H3C(O)NH2, v=0
  964822.5933  0.0023 -5.3911 3  174.0074 63  71510 303311913      301614        syn-C2H3C(O)NH2, v=0
  964847.5536  0.0061 -4.3811 3  390.5585109  71510 303541539      531242        syn-C2H3C(O)NH2, v=0
  964896.9094  0.0032 -3.8374 3  508.8757127  71510 303631251      621152        syn-C2H3C(O)NH2, v=0
  964961.3739  0.0164 -3.6473 3  969.1481163  71510 303812854      802753        syn-C2H3C(O)NH2, v=0
  964962.6487  0.0164 -3.6473 3  969.1481163  71510 303812853      802754        syn-C2H3C(O)NH2, v=0
  964999.7058  0.0255 -3.9516 3 1073.5121175  71510 303872661      862562        syn-C2H3C(O)NH2, v=0
  965020.3253  0.0121 -3.0131 3  742.8324117  71510 303583919      573820        syn-C2H3C(O)NH2, v=0
  965020.3253  0.0121 -3.0131 3  742.8324117  71510 303583920      573819        syn-C2H3C(O)NH2, v=0
  965043.2778  0.0032 -3.8373 3  508.8757127  71510 303631351      621052        syn-C2H3C(O)NH2, v=0
  965114.0388  0.1525 -4.7729 3 1420.0971203  71510 303A12775      A02674        syn-C2H3C(O)NH2, v=0
  965120.8654  0.0090 -3.3231 3  851.6508145  71510 303723240      713141        syn-C2H3C(O)NH2, v=0
  965120.8654  0.0090 -3.3231 3  851.6508145  71510 303723241      713140        syn-C2H3C(O)NH2, v=0
  965259.0672  0.0031 -4.3141 3  362.8668103  71510 303511734      501437        syn-C2H3C(O)NH2, v=0
  965332.3391  0.0177 -5.3443 3  936.9481161  71510 303802753      802456        syn-C2H3C(O)NH2, v=0
  965332.6020  0.0103 -3.0464 3  753.8012121  71510 303603822      593723        syn-C2H3C(O)NH2, v=0
  965332.6020  0.0103 -3.0464 3  753.8012121  71510 303603823      593722        syn-C2H3C(O)NH2, v=0
  965578.0410  0.0082 -3.2666 3  831.4419141  71510 303703337      693238        syn-C2H3C(O)NH2, v=0
  965578.0410  0.0082 -3.2666 3  831.4419141  71510 303703338      693237        syn-C2H3C(O)NH2, v=0
  965588.3523  0.0089 -3.0830 3  766.2719125  71510 303623725      613626        syn-C2H3C(O)NH2, v=0
  965588.3523  0.0089 -3.0830 3  766.2719125  71510 303623726      613625        syn-C2H3C(O)NH2, v=0
  965730.2539  0.0221 -5.3752 3  843.5397161  71510 303801664      801367        syn-C2H3C(O)NH2, v=0
  965769.2411  0.0081 -3.1231 3  780.2561129  71510 303643628      633529        syn-C2H3C(O)NH2, v=0
  965769.2411  0.0081 -3.1231 3  780.2561129  71510 303643629      633528        syn-C2H3C(O)NH2, v=0
  965786.6353  0.0059 -4.2086 3  481.9447119  71510 303591842      581543        syn-C2H3C(O)NH2, v=0
  965801.7673  0.0078 -3.2146 3  812.8226137  71510 303683434      673335        syn-C2H3C(O)NH2, v=0
  965801.7673  0.0078 -3.2146 3  812.8226137  71510 303683435      673334        syn-C2H3C(O)NH2, v=0
  965847.8698  0.0221 -5.3752 3  843.5397161  71510 303801764      801467        syn-C2H3C(O)NH2, v=0
  965851.0927  0.0077 -3.1669 3  795.7674133  71510 303663531      653432        syn-C2H3C(O)NH2, v=0
  965851.0927  0.0077 -3.1669 3  795.7674133  71510 303663532      653431        syn-C2H3C(O)NH2, v=0
  965910.3701  0.0036 -5.2628 3  505.6533113  71510 303562531      562234        syn-C2H3C(O)NH2, v=0
  965910.3837  0.0036 -5.2628 3  505.6533113  71510 303562532      562235        syn-C2H3C(O)NH2, v=0
  965999.3464  0.0175 -5.3438 3  936.9258161  71510 303802754      802457        syn-C2H3C(O)NH2, v=0
  966175.1348  0.0074 -4.7538 3  327.2975101  71510 303501337      491040        syn-C2H3C(O)NH2, v=0
  966373.4852  0.0262 -4.0043 3 1095.6965177  71510 303882663      872562        syn-C2H3C(O)NH2, v=0
  966389.0730  0.0204 -3.7858 3 1019.4969169  71510 303842758      832657        syn-C2H3C(O)NH2, v=0
  966461.9240  0.0204 -3.7858 3 1019.4949169  71510 303842757      832658        syn-C2H3C(O)NH2, v=0
  966932.1427  0.0029 -4.0066 3  415.7892119  71510 30359 851      58 752        syn-C2H3C(O)NH2, v=0
  966932.2108  0.0029 -4.0066 3  415.7892119  71510 30359 951      58 652        syn-C2H3C(O)NH2, v=0
  967049.5758  0.0067 -4.7620 3  316.2605111  71510 30355 352      54 253        syn-C2H3C(O)NH2, v=0
  967049.5758  0.0067 -4.7620 3  316.2605111  71510 30355 452      54 153        syn-C2H3C(O)NH2, v=0
  967493.4995  0.0031 -3.8637 3  485.2825125  71510 303621151      611052        syn-C2H3C(O)NH2, v=0
  967519.3541  0.0031 -3.8637 3  485.2825125  71510 303621251      61 952        syn-C2H3C(O)NH2, v=0
  967574.0938  0.0061 -5.2153 3  737.1457141  71510 303702644      702347        syn-C2H3C(O)NH2, v=0
  967589.5543  0.0637 -4.1508 3  973.4918169  71510 303842262      832163        syn-C2H3C(O)NH2, v=0
  967593.1534  0.0061 -5.2153 3  737.1451141  71510 303702645      702348        syn-C2H3C(O)NH2, v=0
  967609.7147  0.0044 -4.9601 3  264.2768 91  71510 303451333      44 836        syn-C2H3C(O)NH2, v=0
  967901.2748  0.0143 -3.5625 3  941.5729159  71510 303792951      782850        syn-C2H3C(O)NH2, v=0
  967901.3042  0.0143 -3.5625 3  941.5729159  71510 303792950      782851        syn-C2H3C(O)NH2, v=0
  967914.6375  0.0047 -3.8310 3  596.7959135  71510 303671652      661353        syn-C2H3C(O)NH2, v=0
  967969.3783  0.0049 -5.1059 3  247.7460 89  71510 303441233      43 736        syn-C2H3C(O)NH2, v=0
  968219.9081  0.0036 -5.2831 3  491.7776111  71510 303552530      552233        syn-C2H3C(O)NH2, v=0
  968219.9142  0.0036 -5.2831 3  491.7776111  71510 303552531      552234        syn-C2H3C(O)NH2, v=0
  968239.9392  0.0030 -3.9464 3  438.7235121  71510 30360 951      59 852        syn-C2H3C(O)NH2, v=0
  968240.4987  0.0030 -3.9464 3  438.7235121  71510 303601051      59 752        syn-C2H3C(O)NH2, v=0
  968350.9215  0.0032 -4.2917 3  375.8102105  71510 303521735      511438        syn-C2H3C(O)NH2, v=0
  968497.7217  0.0030 -3.8995 3  461.8928123  71510 303611051      60 952        syn-C2H3C(O)NH2, v=0
  968501.7671  0.0030 -3.8995 3  461.8928123  71510 303611151      60 852        syn-C2H3C(O)NH2, v=0
  969126.2227  0.0469 -4.2997 3 1211.1065187  71510 303932668      922567        syn-C2H3C(O)NH2, v=0
  969284.6467  0.0037 -4.9239 3  269.7915 91  71510 303451432      44 935        syn-C2H3C(O)NH2, v=0
  969536.4579  0.0021 -4.8181 3  234.9656 79  71510 303391822      381523        syn-C2H3C(O)NH2, v=0
  969538.1824  0.0021 -4.8181 3  234.9656 79  71510 303391821      381524        syn-C2H3C(O)NH2, v=0
  969613.1569  0.0281 -4.0572 3 1118.1191179  71510 303892664      882563        syn-C2H3C(O)NH2, v=0
  969775.9760  0.0346 -2.8946 3  719.2863 95  71510 3034745 2      4644 3        syn-C2H3C(O)NH2, v=0
  969775.9760  0.0346 -2.8946 3  719.2863 95  71510 3034745 3      4644 2        syn-C2H3C(O)NH2, v=0
  969870.3298  0.0166 -5.3693 3  794.6611157  71510 303781563      781266        syn-C2H3C(O)NH2, v=0
  969880.6329  0.0125 -3.4865 3  915.8035155  71510 303773048      762947        syn-C2H3C(O)NH2, v=0
  969880.6334  0.0125 -3.4865 3  915.8035155  71510 303773047      762948        syn-C2H3C(O)NH2, v=0
  969908.9007  0.0166 -5.3693 3  794.6611157  71510 303781663      781366        syn-C2H3C(O)NH2, v=0
  970223.0980  0.0293 -2.9111 3  721.8913 99  71510 3034944 5      4843 6        syn-C2H3C(O)NH2, v=0
  970223.0980  0.0293 -2.9111 3  721.8913 99  71510 3034944 6      4843 5        syn-C2H3C(O)NH2, v=0
  970393.8788  0.0036 -5.3052 3  478.1607109  71510 303542529      542232        syn-C2H3C(O)NH2, v=0
  970393.8816  0.0036 -5.3052 3  478.1607109  71510 303542530      542233        syn-C2H3C(O)NH2, v=0
  970551.9166  0.0276 -4.0010 3 1095.5861177  71510 303882662      872563        syn-C2H3C(O)NH2, v=0
  970660.0974  0.0246 -2.9304 3  725.9603103  71510 3035143 8      5042 9        syn-C2H3C(O)NH2, v=0
  970660.0974  0.0246 -2.9304 3  725.9603103  71510 3035143 9      5042 8        syn-C2H3C(O)NH2, v=0
  971083.1109  0.0207 -2.9524 3  731.4975107  71510 303534211      524112        syn-C2H3C(O)NH2, v=0
  971083.1109  0.0207 -2.9524 3  731.4975107  71510 303534212      524111        syn-C2H3C(O)NH2, v=0
  971204.9016  0.0109 -3.4174 3  891.7628151  71510 303753144      743045        syn-C2H3C(O)NH2, v=0
  971204.9016  0.0109 -3.4174 3  891.7628151  71510 303753145      743044        syn-C2H3C(O)NH2, v=0
  971246.1506  0.0178 -3.6865 3  989.3898165  71510 303822855      812754        syn-C2H3C(O)NH2, v=0
  971248.5606  0.0178 -3.6865 3  989.3898165  71510 303822854      812755        syn-C2H3C(O)NH2, v=0
  971397.4761  0.0022 -5.3166 3  181.6220 65  71510 303321914      311615        syn-C2H3C(O)NH2, v=0
  971397.4762  0.0022 -5.3166 3  181.6220 65  71510 303321913      311616        syn-C2H3C(O)NH2, v=0
  971487.0426  0.0173 -2.9773 3  738.5081111  71510 303554114      544015        syn-C2H3C(O)NH2, v=0
  971487.0426  0.0173 -2.9773 3  738.5081111  71510 303554115      544014        syn-C2H3C(O)NH2, v=0
  971865.2150  0.0145 -3.0052 3  746.9982115  71510 303574017      563918        syn-C2H3C(O)NH2, v=0
  971865.2150  0.0145 -3.0052 3  746.9982115  71510 303574018      563917        syn-C2H3C(O)NH2, v=0
  971877.2731  0.0303 -4.1127 3 1140.8587181  71510 303902665      892564        syn-C2H3C(O)NH2, v=0
  971931.2815  0.0054 -4.5062 3  338.2554113  71510 30356 452      55 353        syn-C2H3C(O)NH2, v=0
  971931.2815  0.0054 -4.5062 3  338.2554113  71510 30356 552      55 253        syn-C2H3C(O)NH2, v=0
  972061.2243  0.0386 -4.2336 3 1187.3383185  71510 303922667      912566        syn-C2H3C(O)NH2, v=0
  972065.2120  0.0097 -3.3543 3  869.3944147  71510 303733241      723142        syn-C2H3C(O)NH2, v=0
  972065.2120  0.0097 -3.3543 3  869.3944147  71510 303733242      723141        syn-C2H3C(O)NH2, v=0
  972065.5123  0.0033 -4.2722 3  389.0070107  71510 303531736      521439        syn-C2H3C(O)NH2, v=0
  972090.4657  0.0055 -5.2158 3  719.6155139  71510 303692643      692346        syn-C2H3C(O)NH2, v=0
  972100.7395  0.0055 -5.2158 3  719.6151139  71510 303692644      692347        syn-C2H3C(O)NH2, v=0
  972152.7236  0.0220 -3.8290 3 1040.6285171  71510 303852759      842658        syn-C2H3C(O)NH2, v=0
  972208.9088  0.0122 -3.0362 3  756.9748119  71510 303593920      583821        syn-C2H3C(O)NH2, v=0
  972208.9088  0.0122 -3.0362 3  756.9748119  71510 303593921      583820        syn-C2H3C(O)NH2, v=0
  972280.7311  0.0221 -3.8289 3 1040.6249171  71510 303852758      842659        syn-C2H3C(O)NH2, v=0
  972409.9243  0.0158 -5.3338 3  916.7381159  71510 303792752      792455        syn-C2H3C(O)NH2, v=0
  972439.4604  0.0036 -5.3293 3  464.8022107  71510 303532528      532231        syn-C2H3C(O)NH2, v=0
  972439.4616  0.0036 -5.3293 3  464.8022107  71510 303532529      532232        syn-C2H3C(O)NH2, v=0
  972506.7524  0.0104 -3.0705 3  768.4463123  71510 303613823      603724        syn-C2H3C(O)NH2, v=0
  972506.7524  0.0104 -3.0705 3  768.4463123  71510 303613824      603723        syn-C2H3C(O)NH2, v=0
  972521.4408  0.0127 -5.3726 3  747.0024153  71510 303761462      761165        syn-C2H3C(O)NH2, v=0
  972533.4055  0.0127 -5.3726 3  747.0024153  71510 303761562      761265        syn-C2H3C(O)NH2, v=0
  972588.6495  0.0089 -3.2964 3  848.6555143  71510 303713338      703239        syn-C2H3C(O)NH2, v=0
  972588.6495  0.0089 -3.2964 3  848.6555143  71510 303713339      703238        syn-C2H3C(O)NH2, v=0
  972743.8962  0.0092 -3.1081 3  781.4227127  71510 303633726      623627        syn-C2H3C(O)NH2, v=0
  972743.8962  0.0092 -3.1081 3  781.4227127  71510 303633727      623626        syn-C2H3C(O)NH2, v=0
  972804.6974  0.0157 -5.3335 3  916.7249159  71510 303792753      792456        syn-C2H3C(O)NH2, v=0
  972829.5146  0.0335 -4.1714 3 1163.9271183  71510 303912666      902565        syn-C2H3C(O)NH2, v=0
  972863.2932  0.0083 -3.2432 3  829.5129139  71510 303693435      683336        syn-C2H3C(O)NH2, v=0
  972863.2932  0.0083 -3.2432 3  829.5129139  71510 303693436      683335        syn-C2H3C(O)NH2, v=0
  972881.2102  0.0041 -3.8340 3  572.3071133  71510 303661452      651353        syn-C2H3C(O)NH2, v=0
  972900.8813  0.0085 -3.1493 3  795.9159131  71510 303653629      643530        syn-C2H3C(O)NH2, v=0
  972900.8813  0.0085 -3.1493 3  795.9159131  71510 303653630      643529        syn-C2H3C(O)NH2, v=0
  972952.0544  0.0082 -3.1943 3  811.9401135  71510 303673532      663433        syn-C2H3C(O)NH2, v=0
  972952.0544  0.0082 -3.1943 3  811.9401135  71510 303673533      663432        syn-C2H3C(O)NH2, v=0
  973010.2238  0.0073 -5.4511 3  611.4318141  71510 303701159      70 862        syn-C2H3C(O)NH2, v=0
  973010.4730  0.0073 -5.4511 3  611.4318141  71510 303701259      70 962        syn-C2H3C(O)NH2, v=0
  973612.3684  0.0426 -5.4567 3  965.2596171  71510 303851867      851570        syn-C2H3C(O)NH2, v=0
  973617.0803  0.0431 -4.0850 3  854.4255159  71510 303792059      781960        syn-C2H3C(O)NH2, v=0
  973849.4832  0.0101 -5.3864 3  700.5724149  71510 303741361      741064        syn-C2H3C(O)NH2, v=0
  973852.9864  0.0101 -5.3864 3  700.5724149  71510 303741461      741164        syn-C2H3C(O)NH2, v=0
  973979.4474  0.0084 -5.4120 3  655.3796145  71510 303721260      72 963        syn-C2H3C(O)NH2, v=0
  973980.4126  0.0084 -5.4120 3  655.3796145  71510 303721360      721063        syn-C2H3C(O)NH2, v=0
  974190.8853  0.0420 -5.4563 3  965.2596171  71510 303851967      851670        syn-C2H3C(O)NH2, v=0
  974363.3729  0.0036 -5.3554 3  451.7012105  71510 303522527      522230        syn-C2H3C(O)NH2, v=0
  974363.3734  0.0036 -5.3554 3  451.7012105  71510 303522528      522231        syn-C2H3C(O)NH2, v=0
  974436.8052  0.0155 -3.5994 3  961.2295161  71510 303802952      792851        syn-C2H3C(O)NH2, v=0
  974436.8640  0.0155 -3.5994 3  961.2295161  71510 303802951      792852        syn-C2H3C(O)NH2, v=0
  974677.1970  0.0455 -4.1739 3 1131.4154181  71510 303902565      892466        syn-C2H3C(O)NH2, v=0
  974911.0791  0.0039 -3.8326 3  572.3054133  71510 303661552      651253        syn-C2H3C(O)NH2, v=0
  974913.3162  0.0022 -4.7733 3  244.6495 81  71510 303401823      391524        syn-C2H3C(O)NH2, v=0
  974917.0498  0.0022 -4.7733 3  244.6494 81  71510 303401822      391525        syn-C2H3C(O)NH2, v=0
  976171.9234  0.0036 -5.3836 3  438.8571103  71510 303512526      512229        syn-C2H3C(O)NH2, v=0
  976171.9236  0.0036 -5.3836 3  438.8571103  71510 303512527      512230        syn-C2H3C(O)NH2, v=0
  976268.4613  0.0043 -4.3303 3  360.5380115  71510 30357 552      56 453        syn-C2H3C(O)NH2, v=0
  976268.4614  0.0043 -4.3303 3  360.5380115  71510 30357 652      56 353        syn-C2H3C(O)NH2, v=0
  976272.6803  0.0301 -4.0522 3 1117.9446179  71510 303892663      882564        syn-C2H3C(O)NH2, v=0
  976346.3014  0.0051 -5.2175 3  702.3550137  71510 303682642      682345        syn-C2H3C(O)NH2, v=0
  976351.7614  0.0051 -5.2175 3  702.3548137  71510 303682643      682346        syn-C2H3C(O)NH2, v=0
  976546.9763  0.0404 -2.8981 3  729.0617 93  71510 3034646 0      4545 1        syn-C2H3C(O)NH2, v=0
  976546.9763  0.0404 -2.8981 3  729.0617 93  71510 3034646 1      4545 0        syn-C2H3C(O)NH2, v=0
  976588.6738  0.0136 -3.5215 3  934.8944157  71510 303783049      772948        syn-C2H3C(O)NH2, v=0
  976588.6748  0.0136 -3.5215 3  934.8944157  71510 303783048      772949        syn-C2H3C(O)NH2, v=0
  976604.9420  0.0060 -4.0093 3  635.0629137  71510 303681950      671651        syn-C2H3C(O)NH2, v=0
  976704.8908  0.0034 -4.2565 3  402.4502109  71510 303541737      531440        syn-C2H3C(O)NH2, v=0
  976943.2857  0.0073 -4.9694 3  297.4524 97  71510 303481236      47 939        syn-C2H3C(O)NH2, v=0
  976999.4511  0.0344 -2.9128 3  730.6980 97  71510 3034845 3      4744 4        syn-C2H3C(O)NH2, v=0
  976999.4511  0.0344 -2.9128 3  730.6980 97  71510 3034845 4      4744 3        syn-C2H3C(O)NH2, v=0
  977224.3516  0.0211 -3.9818 3  742.6602149  71510 303741856      731757        syn-C2H3C(O)NH2, v=0
  977256.9182  0.0060 -3.9771 3  652.6132139  71510 303691951      681652        syn-C2H3C(O)NH2, v=0
  977443.8427  0.0291 -2.9301 3  733.7955101  71510 3035044 6      4943 7        syn-C2H3C(O)NH2, v=0
  977443.8427  0.0291 -2.9301 3  733.7955101  71510 3035044 7      4943 6        syn-C2H3C(O)NH2, v=0
  977465.3794  0.0193 -3.7265 3 1009.9004167  71510 303832856      822755        syn-C2H3C(O)NH2, v=0
  977469.8815  0.0193 -3.7265 3 1009.9003167  71510 303832855      822756        syn-C2H3C(O)NH2, v=0
  977523.7851  0.0056 -4.2492 3  466.6646117  71510 303581841      571542        syn-C2H3C(O)NH2, v=0
  977783.1702  0.0238 -3.8734 3 1062.0381173  71510 303862760      852659        syn-C2H3C(O)NH2, v=0
  977871.0450  0.0036 -5.4141 3  426.2692101  71510 303502525      502228        syn-C2H3C(O)NH2, v=0
  977871.0451  0.0036 -5.4141 3  426.2692101  71510 303502526      502229        syn-C2H3C(O)NH2, v=0
  977877.0145  0.0245 -2.9502 3  738.3581105  71510 3035243 9      514210        syn-C2H3C(O)NH2, v=0
  977877.0145  0.0245 -2.9502 3  738.3581105  71510 303524310      5142 9        syn-C2H3C(O)NH2, v=0
  977894.3145  0.0022 -5.2471 3  189.4888 67  71510 303331915      321616        syn-C2H3C(O)NH2, v=0
  977894.3149  0.0022 -5.2471 3  189.4888 67  71510 303331914      321617        syn-C2H3C(O)NH2, v=0
  978005.3781  0.0238 -3.8732 3 1062.0320173  71510 303862759      852660        syn-C2H3C(O)NH2, v=0
  978037.3861  0.0119 -3.4508 3  910.3022153  71510 303763146      753045        syn-C2H3C(O)NH2, v=0
  978037.3862  0.0119 -3.4508 3  910.3022153  71510 303763145      753046        syn-C2H3C(O)NH2, v=0
  978294.8112  0.0206 -2.9731 3  744.3905109  71510 303544212      534113        syn-C2H3C(O)NH2, v=0
  978294.8112  0.0206 -2.9731 3  744.3905109  71510 303544213      534112        syn-C2H3C(O)NH2, v=0
  978563.3541  0.0073 -3.8857 3  663.2101141  71510 303701853      691554        syn-C2H3C(O)NH2, v=0
  978631.8638  0.0052 -5.3087 3  231.3853 87  71510 303431133      42 636        syn-C2H3C(O)NH2, v=0
  978691.7757  0.0173 -2.9989 3  751.8979113  71510 303564115      554016        syn-C2H3C(O)NH2, v=0
  978691.7757  0.0173 -2.9989 3  751.8979113  71510 303564116      554015        syn-C2H3C(O)NH2, v=0
  978990.1640  0.0106 -3.3862 3  887.3933149  71510 303743242      733143        syn-C2H3C(O)NH2, v=0
  978990.1640  0.0106 -3.3862 3  887.3933149  71510 303743243      733142        syn-C2H3C(O)NH2, v=0
  978996.8871  0.0142 -5.3244 3  896.8112157  71510 303782751      782454        syn-C2H3C(O)NH2, v=0
  979060.7811  0.0145 -3.0278 3  760.8867117  71510 303584018      573919        syn-C2H3C(O)NH2, v=0
  979060.7811  0.0145 -3.0278 3  760.8867117  71510 303584019      573918        syn-C2H3C(O)NH2, v=0
  979154.2408  0.3331 -5.3727 3 1740.7387225  71510 303B22984      B12883        syn-C2H3C(O)NH2, v=0
  979227.3388  0.0142 -5.3242 3  896.8035157  71510 303782752      782455        syn-C2H3C(O)NH2, v=0
  979268.5538  0.0686 -4.2205 3 1099.9483179  71510 303892465      882366        syn-C2H3C(O)NH2, v=0
  979392.5446  0.0123 -3.0598 3  771.3643121  71510 303603921      593822        syn-C2H3C(O)NH2, v=0
  979392.5446  0.0123 -3.0598 3  771.3643121  71510 303603922      593821        syn-C2H3C(O)NH2, v=0
  979466.3314  0.0036 -5.4470 3  413.9371 99  71510 303492524      492227        syn-C2H3C(O)NH2, v=0
  979466.3315  0.0036 -5.4470 3  413.9371 99  71510 303492525      492228        syn-C2H3C(O)NH2, v=0
  979583.6857  0.0096 -3.3269 3  866.1227145  71510 303723339      713240        syn-C2H3C(O)NH2, v=0
  979583.6857  0.0096 -3.3269 3  866.1227145  71510 303723340      713239        syn-C2H3C(O)NH2, v=0
  979592.8650  0.1285 -4.6996 3 1393.8044201  71510 303A02774      992673        syn-C2H3C(O)NH2, v=0
  979674.9818  0.0107 -3.0951 3  783.3393125  71510 303623824      613725        syn-C2H3C(O)NH2, v=0
  979674.9818  0.0107 -3.0951 3  783.3393125  71510 303623825      613724        syn-C2H3C(O)NH2, v=0
  979801.3422  0.0085 -5.2102 3  305.5727111  71510 30355 253      54 154        syn-C2H3C(O)NH2, v=0
  979801.3422  0.0085 -5.2102 3  305.5727111  71510 30355 353      54 054        syn-C2H3C(O)NH2, v=0
  979809.8411  0.0063 -4.0527 3  617.6548135  71510 303671949      661650        syn-C2H3C(O)NH2, v=0
  979892.3319  0.0095 -3.1338 3  796.8222129  71510 303643727      633628        syn-C2H3C(O)NH2, v=0
  979892.3319  0.0095 -3.1338 3  796.8222129  71510 303643728      633627        syn-C2H3C(O)NH2, v=0
  979912.1632  0.0090 -3.2724 3  846.4554141  71510 303703436      693337        syn-C2H3C(O)NH2, v=0
  979912.1632  0.0090 -3.2724 3  846.4554141  71510 303703437      693336        syn-C2H3C(O)NH2, v=0
  980004.4861  0.0036 -4.2011 3  383.0998117  71510 30358 652      57 553        syn-C2H3C(O)NH2, v=0
  980004.4865  0.0036 -4.2011 3  383.0998117  71510 30358 752      57 453        syn-C2H3C(O)NH2, v=0
  980023.9545  0.0089 -3.1761 3  811.8253133  71510 303663630      653531        syn-C2H3C(O)NH2, v=0
  980023.9545  0.0089 -3.1761 3  811.8253133  71510 303663631      653530        syn-C2H3C(O)NH2, v=0
  980042.6379  0.0087 -3.2222 3  828.3637137  71510 303683533      673434        syn-C2H3C(O)NH2, v=0
  980042.6379  0.0087 -3.2222 3  828.3637137  71510 303683534      673433        syn-C2H3C(O)NH2, v=0
  980102.6402  0.0023 -4.7308 3  254.5951 83  71510 303411824      401525        syn-C2H3C(O)NH2, v=0
  980110.5163  0.0023 -4.7308 3  254.5948 83  71510 303411823      401526        syn-C2H3C(O)NH2, v=0
  980129.1111  0.0035 -3.8425 3  547.9472131  71510 303651352      641253        syn-C2H3C(O)NH2, v=0
  980359.6607  0.0047 -5.2204 3  685.3629135  71510 303672641      672344        syn-C2H3C(O)NH2, v=0
  980362.5212  0.0047 -5.2204 3  685.3628135  71510 303672642      672345        syn-C2H3C(O)NH2, v=0
  980574.3715  0.0035 -3.8422 3  547.9469131  71510 303651452      641153        syn-C2H3C(O)NH2, v=0
  980811.2387  0.0322 -5.4331 3  913.3524167  71510 303831766      831469        syn-C2H3C(O)NH2, v=0
  980926.9021  0.0169 -3.6371 3  981.1502163  71510 303812953      802852        syn-C2H3C(O)NH2, v=0
  980927.0188  0.0169 -3.6371 3  981.1502163  71510 303812952      802853        syn-C2H3C(O)NH2, v=0
  981018.3976  0.0321 -5.4329 3  913.3524167  71510 303831866      831569        syn-C2H3C(O)NH2, v=0
  981066.5458  0.0063 -3.8618 3  638.1648139  71510 303691753      681454        syn-C2H3C(O)NH2, v=0
  981744.9017  0.0065 -3.9574 3  670.3013141  71510 303701952      691653        syn-C2H3C(O)NH2, v=0
  982235.7729  0.0051 -4.2881 3  423.9561113  71510 303561640      551343        syn-C2H3C(O)NH2, v=0
  982324.0200  0.0332 -4.1051 3 1140.5872181  71510 303902664      892565        syn-C2H3C(O)NH2, v=0
  982508.9083  0.2318 -5.0406 3 1562.4038213  71510 303A62879      A52778        syn-C2H3C(O)NH2, v=0
  982610.9390  0.0035 -4.2458 3  416.1321111  71510 303551738      541441        syn-C2H3C(O)NH2, v=0
  982819.6855  0.0056 -3.8577 3  613.1492137  71510 303681553      671454        syn-C2H3C(O)NH2, v=0
  983070.6190  0.0031 -4.1027 3  405.9318119  71510 30359 752      58 653        syn-C2H3C(O)NH2, v=0
  983070.6228  0.0031 -4.1027 3  405.9318119  71510 30359 852      58 553        syn-C2H3C(O)NH2, v=0
  983255.0667  0.0255 -3.9189 3 1083.7281175  71510 303872761      862660        syn-C2H3C(O)NH2, v=0
  983263.1163  0.0148 -3.5572 3  954.2458159  71510 303793050      782949        syn-C2H3C(O)NH2, v=0
  983263.1185  0.0148 -3.5572 3  954.2458159  71510 303793049      782950        syn-C2H3C(O)NH2, v=0
  983613.6791  0.0209 -3.7674 3 1030.6809169  71510 303842857      832756        syn-C2H3C(O)NH2, v=0
  983621.9908  0.0209 -3.7674 3 1030.6807169  71510 303842856      832757        syn-C2H3C(O)NH2, v=0
  983636.1030  0.0257 -3.9186 3 1083.7177175  71510 303872760      862661        syn-C2H3C(O)NH2, v=0
  983644.3967  0.0767 -4.2204 3 1046.7726175  71510 303872364      862265        syn-C2H3C(O)NH2, v=0
  983770.6810  0.0402 -2.9159 3  740.2260 95  71510 3034746 1      4645 2        syn-C2H3C(O)NH2, v=0
  983770.6810  0.0402 -2.9159 3  740.2260 95  71510 3034746 2      4645 1        syn-C2H3C(O)NH2, v=0
  983821.1817  0.0040 -4.9037 3  280.9151 93  71510 303461433      45 936        syn-C2H3C(O)NH2, v=0
  984146.5182  0.0044 -5.2247 3  668.6381133  71510 303662640      662343        syn-C2H3C(O)NH2, v=0
  984147.9952  0.0044 -5.2247 3  668.6381133  71510 303662641      662344        syn-C2H3C(O)NH2, v=0
  984221.0209  0.0342 -2.9314 3  742.3540 99  71510 3034945 4      4844 5        syn-C2H3C(O)NH2, v=0
  984221.0209  0.0342 -2.9314 3  742.3540 99  71510 3034945 5      4844 4        syn-C2H3C(O)NH2, v=0
  984306.7622  0.0021 -5.1820 3  197.6086 69  71510 303341916      331617        syn-C2H3C(O)NH2, v=0
  984306.7632  0.0021 -5.1820 3  197.6086 69  71510 303341915      331618        syn-C2H3C(O)NH2, v=0
  984318.1545  0.0033 -3.8598 3  523.7521129  71510 303641252      631153        syn-C2H3C(O)NH2, v=0
  984404.2962  0.0033 -3.8597 3  523.7521129  71510 303641352      631053        syn-C2H3C(O)NH2, v=0
  984662.3592  0.0290 -2.9496 3  745.9443103  71510 3035144 7      5043 8        syn-C2H3C(O)NH2, v=0
  984662.3592  0.0290 -2.9496 3  745.9443103  71510 3035144 8      5043 7        syn-C2H3C(O)NH2, v=0
  984844.0734  0.0130 -3.4848 3  929.0995155  71510 303773146      763047        syn-C2H3C(O)NH2, v=0
  984844.0734  0.0130 -3.4848 3  929.0995155  71510 303773147      763046        syn-C2H3C(O)NH2, v=0
  985086.3174  0.0023 -4.6905 3  264.8036 85  71510 303421825      411526        syn-C2H3C(O)NH2, v=0
  985091.3118  0.0245 -2.9705 3  751.0011107  71510 303534310      524211        syn-C2H3C(O)NH2, v=0
  985091.3118  0.0245 -2.9705 3  751.0011107  71510 303534311      524210        syn-C2H3C(O)NH2, v=0
  985102.5224  0.0023 -4.6905 3  264.8030 85  71510 303421824      411527        syn-C2H3C(O)NH2, v=0
  985153.0342  0.0128 -5.3161 3  877.1646155  71510 303772750      772453        syn-C2H3C(O)NH2, v=0
  985192.3022  0.0069 -4.7783 3  327.6755113  71510 30356 353      55 254        syn-C2H3C(O)NH2, v=0
  985192.3022  0.0069 -4.7783 3  327.6755113  71510 30356 453      55 154        syn-C2H3C(O)NH2, v=0
  985285.7483  0.0127 -5.3160 3  877.1602155  71510 303772751      772454        syn-C2H3C(O)NH2, v=0
  985381.9360  0.0030 -4.0264 3  429.0240121  71510 30360 852      59 753        syn-C2H3C(O)NH2, v=0
  985381.9721  0.0030 -4.0264 3  429.0240121  71510 30360 952      59 653        syn-C2H3C(O)NH2, v=0
  985503.4182  0.0206 -2.9943 3  757.5291111  71510 303554213      544114        syn-C2H3C(O)NH2, v=0
  985503.4182  0.0206 -2.9943 3  757.5291111  71510 303554214      544113        syn-C2H3C(O)NH2, v=0
  985892.8441  0.0173 -3.0211 3  765.5339115  71510 303574116      564017        syn-C2H3C(O)NH2, v=0
  985892.8441  0.0173 -3.0211 3  765.5339115  71510 303574117      564016        syn-C2H3C(O)NH2, v=0
  985894.7998  0.0115 -3.4187 3  905.6479151  71510 303753243      743144        syn-C2H3C(O)NH2, v=0
  985894.7998  0.0115 -3.4187 3  905.6479151  71510 303753244      743143        syn-C2H3C(O)NH2, v=0
  986114.6484  0.0244 -5.4173 3  862.6483163  71510 303811665      811368        syn-C2H3C(O)NH2, v=0
  986185.0031  0.0244 -5.4173 3  862.6483163  71510 303811765      811468        syn-C2H3C(O)NH2, v=0
  986251.9924  0.0146 -3.0510 3  775.0220119  71510 303594019      583920        syn-C2H3C(O)NH2, v=0
  986251.9924  0.0146 -3.0510 3  775.0220119  71510 303594020      583919        syn-C2H3C(O)NH2, v=0
  986364.0994  0.0068 -5.1670 3  268.8163 93  71510 303461135      45 838        syn-C2H3C(O)NH2, v=0
  986535.6378  0.0032 -3.8855 3  499.7446127  71510 303631152      621053        syn-C2H3C(O)NH2, v=0
  986550.4230  0.0032 -3.8855 3  499.7445127  71510 303631252      62 953        syn-C2H3C(O)NH2, v=0
  986556.2877  0.0066 -4.1037 3  600.4030133  71510 303661948      651649        syn-C2H3C(O)NH2, v=0
  986562.4336  0.0104 -3.3580 3  883.8437147  71510 303733340      723241        syn-C2H3C(O)NH2, v=0
  986562.4336  0.0104 -3.3580 3  883.8437147  71510 303733341      723240        syn-C2H3C(O)NH2, v=0
  986570.9911  0.0125 -3.0840 3  786.0012123  71510 303613922      603823        syn-C2H3C(O)NH2, v=0
  986570.9911  0.0125 -3.0840 3  786.0012123  71510 303613923      603822        syn-C2H3C(O)NH2, v=0
  986617.1878  0.0588 -4.1541 3  923.3246165  71510 303822161      812062        syn-C2H3C(O)NH2, v=0
  986831.2116  0.0031 -3.9669 3  452.3654123  71510 30361 952      60 853        syn-C2H3C(O)NH2, v=0
  986831.5156  0.0031 -3.9669 3  452.3654123  71510 303611052      60 753        syn-C2H3C(O)NH2, v=0
  986837.0091  0.0109 -3.1203 3  798.4805127  71510 303633825      623726        syn-C2H3C(O)NH2, v=0
  986837.0091  0.0109 -3.1203 3  798.4805127  71510 303633826      623725        syn-C2H3C(O)NH2, v=0
  986947.8041  0.0097 -3.3022 3  863.6501143  71510 303713437      703338        syn-C2H3C(O)NH2, v=0
  986947.8041  0.0097 -3.3022 3  863.6501143  71510 303713438      703337        syn-C2H3C(O)NH2, v=0
  987033.3296  0.0099 -3.1601 3  812.4707131  71510 303653728      643629        syn-C2H3C(O)NH2, v=0
  987033.3296  0.0099 -3.1601 3  812.4707131  71510 303653729      643628        syn-C2H3C(O)NH2, v=0
  987035.7857  0.0136 -3.9351 3  698.3388145  71510 303721755      711656        syn-C2H3C(O)NH2, v=0
  987122.3741  0.0093 -3.2508 3  845.0382139  71510 303693534      683435        syn-C2H3C(O)NH2, v=0
  987122.3741  0.0093 -3.2508 3  845.0382139  71510 303693535      683434        syn-C2H3C(O)NH2, v=0
  987138.0694  0.0094 -3.2035 3  827.9847135  71510 303673631      663532        syn-C2H3C(O)NH2, v=0
  987138.0694  0.0094 -3.2035 3  827.9847135  71510 303673632      663531        syn-C2H3C(O)NH2, v=0
  987279.0611  0.0031 -3.9207 3  475.9436125  71510 303621052      61 953        syn-C2H3C(O)NH2, v=0
  987281.3142  0.0031 -3.9207 3  475.9436125  71510 303621152      61 853        syn-C2H3C(O)NH2, v=0
  987327.5516  0.0578 -4.2394 3 1154.4046183  71510 303912566      902467        syn-C2H3C(O)NH2, v=0
  987368.6770  0.0183 -3.6755 3 1001.3358165  71510 303822954      812853        syn-C2H3C(O)NH2, v=0
  987368.9054  0.0183 -3.6755 3 1001.3358165  71510 303822953      812854        syn-C2H3C(O)NH2, v=0
  987721.1665  0.0042 -5.2302 3  652.1795131  71510 303652639      652342        syn-C2H3C(O)NH2, v=0
  987721.9180  0.0042 -5.2302 3  652.1795131  71510 303652640      652343        syn-C2H3C(O)NH2, v=0
  988055.4149  0.0051 -3.8545 3  613.1440137  71510 303681653      671354        syn-C2H3C(O)NH2, v=0
  988294.1068  0.0085 -3.8917 3  655.1645141  71510 303701654      691555        syn-C2H3C(O)NH2, v=0
  988331.3773  0.0052 -4.2811 3  451.6916115  71510 303571840      561541        syn-C2H3C(O)NH2, v=0
  988532.9947  0.0274 -3.9656 3 1105.7011177  71510 303882762      872661        syn-C2H3C(O)NH2, v=0
  988937.8662  0.0372 -4.1601 3 1163.5126183  71510 303912665      902566        syn-C2H3C(O)NH2, v=0
  989178.3418  0.0277 -3.9651 3 1105.6836177  71510 303882761      872662        syn-C2H3C(O)NH2, v=0
  989541.9096  0.0063 -5.3529 3  241.4041 89  71510 303441034      43 737        syn-C2H3C(O)NH2, v=0
  989684.7819  0.0226 -3.8092 3 1051.7326171  71510 303852858      842757        syn-C2H3C(O)NH2, v=0
  989699.9485  0.0226 -3.8092 3 1051.7322171  71510 303852857      842758        syn-C2H3C(O)NH2, v=0
  989777.7010  0.0074 -3.9497 3  688.1304143  71510 303711953      701654        syn-C2H3C(O)NH2, v=0
  989815.4006  0.0185 -5.4100 3  813.1569159  71510 303791564      791267        syn-C2H3C(O)NH2, v=0
  989838.0496  0.0185 -5.4100 3  813.1569159  71510 303791664      791367        syn-C2H3C(O)NH2, v=0
  989843.1933  0.0024 -4.6523 3  275.2766 87  71510 303431826      421527        syn-C2H3C(O)NH2, v=0
  989875.7397  0.0024 -4.6523 3  275.2755 87  71510 303431825      421528        syn-C2H3C(O)NH2, v=0
  989902.0979  0.0160 -3.5936 3  973.8586161  71510 303803051      792950        syn-C2H3C(O)NH2, v=0
  989902.1026  0.0160 -3.5936 3  973.8586161  71510 303803050      792951        syn-C2H3C(O)NH2, v=0
  990097.3818  0.0055 -4.5233 3  350.0737115  71510 30357 453      56 354        syn-C2H3C(O)NH2, v=0
  990097.3818  0.0055 -4.5233 3  350.0737115  71510 30357 553      56 254        syn-C2H3C(O)NH2, v=0
  990162.2199  0.0037 -4.2416 3  430.0451113  71510 303561739      551442        syn-C2H3C(O)NH2, v=0
  990628.0384  0.0021 -5.1210 3  205.9819 71  71510 303351917      341618        syn-C2H3C(O)NH2, v=0
  990628.0411  0.0021 -5.1210 3  205.9819 71  71510 303351916      341619        syn-C2H3C(O)NH2, v=0
  990924.9360  0.0115 -5.3090 3  857.7957153  71510 303762749      762452        syn-C2H3C(O)NH2, v=0
  990992.6525  0.0400 -2.9342 3  751.6345 97  71510 3034846 2      4745 3        syn-C2H3C(O)NH2, v=0
  990992.6525  0.0400 -2.9342 3  751.6345 97  71510 3034846 3      4745 2        syn-C2H3C(O)NH2, v=0
  991000.3437  0.0115 -5.3089 3  857.7932153  71510 303762750      762453        syn-C2H3C(O)NH2, v=0
  991096.5112  0.0040 -5.2371 3  635.9860129  71510 303642638      642341        syn-C2H3C(O)NH2, v=0
  991096.8878  0.0040 -5.2371 3  635.9860129  71510 303642639      642342        syn-C2H3C(O)NH2, v=0
  991392.8729  0.0047 -4.9849 3  275.1378 93  71510 303461334      45 837        syn-C2H3C(O)NH2, v=0
  991440.5785  0.0341 -2.9505 3  754.2545101  71510 3035045 5      4944 6        syn-C2H3C(O)NH2, v=0
  991440.5785  0.0341 -2.9505 3  754.2545101  71510 3035045 6      4944 5        syn-C2H3C(O)NH2, v=0
  991585.0270  0.1041 -4.6242 3 1367.8656199  71510 303992773      982672        syn-C2H3C(O)NH2, v=0
  991623.6584  0.0141 -3.5195 3  948.1552157  71510 303783148      773047        syn-C2H3C(O)NH2, v=0
  991623.6585  0.0141 -3.5195 3  948.1552157  71510 303783147      773048        syn-C2H3C(O)NH2, v=0
  991878.5248  0.0289 -2.9696 3  758.3380105  71510 3035244 8      5143 9        syn-C2H3C(O)NH2, v=0
  991878.5248  0.0289 -2.9696 3  758.3380105  71510 3035244 9      5143 8        syn-C2H3C(O)NH2, v=0
  992111.2331  0.0143 -5.4120 3  764.8870155  71510 303771463      771166        syn-C2H3C(O)NH2, v=0
  992118.1344  0.0143 -5.4120 3  764.8870155  71510 303771563      771266        syn-C2H3C(O)NH2, v=0
  992302.8484  0.0244 -2.9914 3  763.8893109  71510 303544311      534212        syn-C2H3C(O)NH2, v=0
  992302.8484  0.0244 -2.9914 3  763.8893109  71510 303544312      534211        syn-C2H3C(O)NH2, v=0
  992708.7703  0.0206 -3.0161 3  770.9134113  71510 303564214      554115        syn-C2H3C(O)NH2, v=0
  992708.7703  0.0206 -3.0161 3  770.9134113  71510 303564215      554114        syn-C2H3C(O)NH2, v=0
  992778.1522  0.0125 -3.4518 3  924.1587153  71510 303763244      753145        syn-C2H3C(O)NH2, v=0
  992778.1522  0.0125 -3.4518 3  924.1587153  71510 303763245      753144        syn-C2H3C(O)NH2, v=0
  993032.7242  0.0094 -5.4486 3  672.0455147  71510 303731261      73 964        syn-C2H3C(O)NH2, v=0
  993033.2620  0.0094 -5.4486 3  672.0455147  71510 303731361      731064        syn-C2H3C(O)NH2, v=0
  993090.0617  0.0174 -3.0438 3  779.4161117  71510 303584117      574018        syn-C2H3C(O)NH2, v=0
  993090.0617  0.0174 -3.0438 3  779.4161117  71510 303584118      574017        syn-C2H3C(O)NH2, v=0
  993146.4393  0.0114 -5.4244 3  717.8472151  71510 303751362      751065        syn-C2H3C(O)NH2, v=0
  993148.4250  0.0114 -5.4244 3  717.8472151  71510 303751462      751165        syn-C2H3C(O)NH2, v=0
  993438.6345  0.0148 -3.0747 3  789.4042121  71510 303604020      593921        syn-C2H3C(O)NH2, v=0
  993438.6345  0.0148 -3.0747 3  789.4042121  71510 303604021      593920        syn-C2H3C(O)NH2, v=0
  993524.1460  0.0113 -3.3897 3  901.8190149  71510 303743341      733242        syn-C2H3C(O)NH2, v=0
  993524.1460  0.0113 -3.3897 3  901.8190149  71510 303743342      733241        syn-C2H3C(O)NH2, v=0
  993566.7137  0.0293 -4.0138 3 1127.9602179  71510 303892763      882662        syn-C2H3C(O)NH2, v=0
  993700.7529  0.0043 -3.8572 3  588.2228135  71510 303671453      661354        syn-C2H3C(O)NH2, v=0
  993743.9998  0.0127 -3.1087 3  800.8856125  71510 303623923      613824        syn-C2H3C(O)NH2, v=0
  993743.9998  0.0127 -3.1087 3  800.8856125  71510 303623924      613823        syn-C2H3C(O)NH2, v=0
  993758.9686  0.0198 -3.7147 3 1021.7871167  71510 303832955      822854        syn-C2H3C(O)NH2, v=0
  993759.4107  0.0198 -3.7147 3 1021.7871167  71510 303832954      822855        syn-C2H3C(O)NH2, v=0
  993969.6206  0.0104 -3.3326 3  881.0976145  71510 303723438      713339        syn-C2H3C(O)NH2, v=0
  993969.6206  0.0104 -3.3326 3  881.0976145  71510 303723439      713338        syn-C2H3C(O)NH2, v=0
  993992.5448  0.0112 -3.1461 3  813.8699129  71510 303643826      633727        syn-C2H3C(O)NH2, v=0
  993992.5448  0.0112 -3.1461 3  813.8699129  71510 303643827      633726        syn-C2H3C(O)NH2, v=0
  994166.5492  0.0103 -3.1870 3  828.3683133  71510 303663729      653630        syn-C2H3C(O)NH2, v=0
  994166.5492  0.0103 -3.1870 3  828.3683133  71510 303663730      653629        syn-C2H3C(O)NH2, v=0
  994174.5843  0.0325 -4.0566 3  807.1906155  71510 303771958      761859        syn-C2H3C(O)NH2, v=0
  994190.7771  0.0099 -3.2800 3  861.9642141  71510 303703535      693436        syn-C2H3C(O)NH2, v=0
  994190.7771  0.0099 -3.2800 3  861.9642141  71510 303703536      693435        syn-C2H3C(O)NH2, v=0
  994242.8228  0.0099 -3.2315 3  844.3943137  71510 303683632      673533        syn-C2H3C(O)NH2, v=0
  994242.8228  0.0099 -3.2315 3  844.3943137  71510 303683633      673532        syn-C2H3C(O)NH2, v=0
  994279.6684  0.0070 -4.4660 3  403.8813111  71510 303551540      541243        syn-C2H3C(O)NH2, v=0
  994284.2901  0.0039 -5.2455 3  620.0565127  71510 303632637      632340        syn-C2H3C(O)NH2, v=0
  994284.4760  0.0039 -5.2455 3  620.0565127  71510 303632638      632341        syn-C2H3C(O)NH2, v=0
  994347.9311  0.0025 -4.6161 3  286.0157 89  71510 303441827      431528        syn-C2H3C(O)NH2, v=0
  994411.7825  0.0025 -4.6160 3  286.0135 89  71510 303441826      431529        syn-C2H3C(O)NH2, v=0
  994471.4631  0.0044 -4.3483 3  372.7598117  71510 30358 553      57 454        syn-C2H3C(O)NH2, v=0
  994471.4631  0.0044 -4.3483 3  372.7598117  71510 30358 653      57 354        syn-C2H3C(O)NH2, v=0
  994646.0299  0.0298 -4.0129 3 1127.9312179  71510 303892762      882663        syn-C2H3C(O)NH2, v=0
  994966.8623  0.0042 -3.8563 3  588.2219135  71510 303671553      661254        syn-C2H3C(O)NH2, v=0
  995671.2247  0.0244 -3.8520 3 1073.0567173  71510 303862859      852758        syn-C2H3C(O)NH2, v=0
  995698.5789  0.0244 -3.8519 3 1073.0560173  71510 303862858      852759        syn-C2H3C(O)NH2, v=0
  995797.2943  0.0083 -3.9041 3  680.6626143  71510 303711854      701555        syn-C2H3C(O)NH2, v=0
  996208.0023  0.0069 -4.1575 3  583.3314131  71510 303651947      641648        syn-C2H3C(O)NH2, v=0
  996349.7040  0.0103 -5.3029 3  838.7026151  71510 303752748      752451        syn-C2H3C(O)NH2, v=0
  996391.9813  0.0103 -5.3029 3  838.7012151  71510 303752749      752452        syn-C2H3C(O)NH2, v=0
  996429.6902  0.0050 -5.1463 3  258.1812 91  71510 303451234      44 737        syn-C2H3C(O)NH2, v=0
  996433.7112  0.0427 -4.2176 3 1186.7183185  71510 303922666      912567        syn-C2H3C(O)NH2, v=0
  996503.6212  0.0174 -3.6308 3  993.7332163  71510 303813052      802951        syn-C2H3C(O)NH2, v=0
  996503.6308  0.0174 -3.6308 3  993.7332163  71510 303813051      802952        syn-C2H3C(O)NH2, v=0
  996763.2725  0.0078 -4.6496 3  371.0335107  71510 303531439      521142        syn-C2H3C(O)NH2, v=0
  996850.8810  0.0021 -5.0635 3  214.6096 73  71510 303361918      351619        syn-C2H3C(O)NH2, v=0
  996850.8881  0.0021 -5.0635 3  214.6096 73  71510 303361917      351620        syn-C2H3C(O)NH2, v=0
  997295.2432  0.0039 -5.2552 3  604.3903125  71510 303622636      622339        syn-C2H3C(O)NH2, v=0
  997295.3336  0.0039 -5.2552 3  604.3903125  71510 303622637      622340        syn-C2H3C(O)NH2, v=0
  997439.0540  0.3261 -5.3155 3 1711.5034223  71510 303B12983      B02882        syn-C2H3C(O)NH2, v=0
  997534.8987  0.0048 -4.3063 3  437.0469113  71510 303561839      551540        syn-C2H3C(O)NH2, v=0
  997759.5259  0.0464 -2.9385 3  761.6358 95  71510 3034747 0      4646 1        syn-C2H3C(O)NH2, v=0
  997759.5259  0.0464 -2.9385 3  761.6358 95  71510 3034747 1      4646 0        syn-C2H3C(O)NH2, v=0
  997930.0665  0.0089 -5.2262 3  316.7863113  71510 30356 254      55 155        syn-C2H3C(O)NH2, v=0
  997930.0665  0.0089 -5.2262 3  316.7863113  71510 30356 354      55 055        syn-C2H3C(O)NH2, v=0
  998212.7947  0.0398 -2.9530 3  763.2872 99  71510 3034946 3      4845 4        syn-C2H3C(O)NH2, v=0
  998212.7947  0.0398 -2.9530 3  763.2872 99  71510 3034946 4      4845 3        syn-C2H3C(O)NH2, v=0
  998260.8347  0.0036 -4.2199 3  395.7256119  71510 30359 653      58 554        syn-C2H3C(O)NH2, v=0
  998260.8349  0.0036 -4.2199 3  395.7256119  71510 30359 753      58 454        syn-C2H3C(O)NH2, v=0
  998284.4201  0.0312 -4.0634 3 1150.5095181  71510 303902764      892663        syn-C2H3C(O)NH2, v=0
  998374.7585  0.0153 -3.5549 3  967.4699159  71510 303793149      783048        syn-C2H3C(O)NH2, v=0
  998374.7586  0.0153 -3.5549 3  967.4699159  71510 303793148      783049        syn-C2H3C(O)NH2, v=0
  998569.2824  0.0026 -4.5817 3  297.0228 91  71510 303451828      441529        syn-C2H3C(O)NH2, v=0
  998658.0138  0.0339 -2.9702 3  766.3995103  71510 3035145 6      5044 7        syn-C2H3C(O)NH2, v=0
  998658.0138  0.0339 -2.9702 3  766.3995103  71510 3035145 7      5044 6        syn-C2H3C(O)NH2, v=0
  998691.7146  0.0026 -4.5816 3  297.0187 91  71510 303451827      441530        syn-C2H3C(O)NH2, v=0
  999092.2131  0.0288 -2.9901 3  770.9766107  71510 3035344 9      524310        syn-C2H3C(O)NH2, v=0
  999092.2131  0.0288 -2.9901 3  770.9766107  71510 303534410      5243 9        syn-C2H3C(O)NH2, v=0
  999511.4793  0.0244 -3.0128 3  777.0229111  71510 303554312      544213        syn-C2H3C(O)NH2, v=0
  999511.4793  0.0244 -3.0128 3  777.0229111  71510 303554313      544212        syn-C2H3C(O)NH2, v=0
  999534.8449  0.0762 -4.2250 3  994.8195171  71510 303852263      842164        syn-C2H3C(O)NH2, v=0
  999579.6564  0.2057 -4.9703 3 1534.7343211  71510 303A52878      A42777        syn-C2H3C(O)NH2, v=0
  999639.2054  0.0136 -3.4856 3  942.9260155  71510 303773245      763146        syn-C2H3C(O)NH2, v=0
  999639.2054  0.0136 -3.4856 3  942.9260155  71510 303773246      763145        syn-C2H3C(O)NH2, v=0
  999772.6297  0.0040 -4.2456 3  444.1816115  71510 303571740      561443        syn-C2H3C(O)NH2, v=0
  999910.7010  0.0206 -3.0384 3  784.5436115  71510 303574215      564116        syn-C2H3C(O)NH2, v=0
  999910.7010  0.0206 -3.0384 3  784.5436115  71510 303574216      564115        syn-C2H3C(O)NH2, v=0
  999971.3249  0.0037 -3.8659 3  563.4404133  71510 303661353      651254        syn-C2H3C(O)NH2, v=0