6020.1402 0.0040 -7.6305 3 37.6236 21 47517 30310 3 8 9 4 5 a-a-CH3DCH2OH
6129.9031 0.0045 -7.6041 3 56.1589 23 47517 30311 5 7 12 4 8 a-a-CH3DCH2OH
6360.6381 0.0045 -7.5721 3 56.1513 23 47517 30311 5 6 12 4 9 a-a-CH3DCH2OH
6394.5979 0.0442 -7.5846 3 204.3102 45 47517 30322 914 23 815 a-a-CH3DCH2OH
6394.9354 0.0442 -7.5845 3 204.3102 45 47517 30322 913 23 816 a-a-CH3DCH2OH
6539.8185 0.0165 -7.5115 3 167.2779 43 47517 30321 715 20 812 a-a-CH3DCH2OH
6542.8422 0.0165 -7.5111 3 167.2779 43 47517 30321 714 20 813 a-a-CH3DCH2OH
7625.6327 0.0041 -7.4233 3 37.6228 21 47517 30310 3 7 9 4 6 a-a-CH3DCH2OH
10058.0000 0.1000 -7.2695 3 32.2389 17 -47517 303 8 4 5 9 3 6 a-a-CH3DCH2OH
10647.9222 0.0146 -7.1086 3 155.7052 39 47517 30319 812 20 713 a-a-CH3DCH2OH
10649.4429 0.0146 -7.1085 3 155.7051 39 47517 30319 811 20 714 a-a-CH3DCH2OH
10786.6809 0.0478 -7.1195 3 217.4221 49 47517 30324 817 23 914 a-a-CH3DCH2OH
10787.3515 0.0478 -7.1195 3 217.4221 49 47517 30324 816 23 915 a-a-CH3DCH2OH
10827.8541 0.0012 -7.3360 3 1.3160 5 47517 303 2 0 2 1 1 1 a-a-CH3DCH2OH
10830.8000 0.1000 -7.0524 3 63.0960 27 -47517 30313 410 12 5 7 a-a-CH3DCH2OH
10930.0000 0.1000 -7.1982 3 32.2102 17 -47517 303 8 4 4 9 3 7 a-a-CH3DCH2OH
11263.9000 0.1000 -7.0181 3 63.0958 27 -47517 30313 4 9 12 5 8 a-a-CH3DCH2OH
13302.8063 0.0042 -7.2087 3 14.9361 11 47517 303 5 3 3 6 2 4 a-a-CH3DCH2OH
14907.1500 0.1000 -6.8097 3 113.6850 33 -47517 30316 710 17 611 a-a-CH3DCH2OH
14914.0000 0.1000 -6.8094 3 113.6848 33 -47517 30316 7 9 17 612 a-a-CH3DCH2OH
15016.0793 0.1090 -6.8963 3 274.1461 55 47517 30327 919 261016 a-a-CH3DCH2OH
15016.2252 0.1090 -6.8963 3 274.1461 55 47517 30327 918 261017 a-a-CH3DCH2OH
15241.2000 0.1000 -6.7286 3 95.1612 33 -47517 30316 512 15 6 9 a-a-CH3DCH2OH
15348.9000 0.1000 -6.7224 3 95.1611 33 -47517 30316 511 15 610 a-a-CH3DCH2OH
15869.3000 0.1000 -6.8246 3 22.6765 17 -47517 303 8 2 7 7 3 4 a-a-CH3DCH2OH
16032.9000 0.1000 -7.4699 3 4.2457 5 -47517 303 2 2 1 3 1 2 a-a-CH3DCH2OH
16171.6000 0.1000 -7.0464 3 14.8414 11 -47517 303 5 3 2 6 2 5 a-a-CH3DCH2OH
17048.9000 0.1000 -6.9211 3 11.5386 13 -47517 303 6 1 6 5 2 3 a-a-CH3DCH2OH
19160.6000 0.1000 -6.6173 3 78.2535 27 -47517 30313 6 8 14 5 9 a-a-CH3DCH2OH
19189.0000 0.1000 -6.6160 3 78.2526 27 -47517 30313 6 7 14 510 a-a-CH3DCH2OH
19282.5512 0.0971 -6.6884 3 244.9080 49 47517 303241015 25 916 a-a-CH3DCH2OH
19282.5871 0.0971 -6.6884 3 244.9080 49 47517 303241014 25 917 a-a-CH3DCH2OH
19533.7000 0.1000 -6.5166 3 133.8164 39 -47517 30319 614 18 711 a-a-CH3DCH2OH
19559.1833 0.0063 -6.5155 3 133.8164 39 47517 30319 613 18 712 a-a-CH3DCH2OH
20512.0783 0.0930 -7.6077 3 289.3701 63 47517 30331 328 30 625 a-a-CH3DCH2OH
22384.6000 0.1000 -6.5990 3 8.6961 11 -47517 303 5 1 4 4 2 3 a-a-CH3DCH2OH
22900.7000 0.1000 -7.2249 3 4.0180 5 -47517 303 2 2 0 3 1 3 a-a-CH3DCH2OH
22921.4000 0.1000 -6.4024 3 43.2365 23 -47517 30311 3 9 10 4 6 a-a-CH3DCH2OH
22932.5863 0.0099 -7.5820 3 73.5473 31 47517 30315 313 16 016 a-a-CH3DCH2OH
23374.4000 0.1000 -6.5133 3 49.4144 21 -47517 30310 5 6 11 4 7 a-a-CH3DCH2OH
23490.4000 0.1000 -6.5091 3 49.4106 21 -47517 30310 5 5 11 4 8 a-a-CH3DCH2OH
23530.0940 0.0410 -6.4685 3 191.4025 43 47517 30321 913 22 814 a-a-CH3DCH2OH
23530.2583 0.0410 -6.4685 3 191.4025 43 47517 30321 912 22 815 a-a-CH3DCH2OH
23787.1392 0.0186 -6.3745 3 179.0585 45 47517 30322 716 21 813 a-a-CH3DCH2OH
23792.9462 0.0186 -6.3743 3 179.0585 45 47517 30322 715 21 814 a-a-CH3DCH2OH
23817.2000 0.1000 -6.2041 3 0.5595 3 -47517 303 1 1 0 1 0 1 a-a-CH3DCH2OH
24186.7000 0.1000 -6.4342 3 22.6699 17 -47517 303 8 2 6 7 3 5 a-a-CH3DCH2OH
24772.2871 0.0329 -7.2820 3 216.7989 55 47517 30327 225 26 522 a-a-CH3DCH2OH
24996.9000 0.1000 -5.9536 3 1.6772 5 -47517 303 2 1 1 2 0 2 a-a-CH3DCH2OH
25696.5000 0.1000 -6.2998 3 43.2347 23 -47517 30311 3 8 10 4 7 a-a-CH3DCH2OH
25786.9582 0.0124 -7.4062 3 160.6705 45 47517 30322 518 23 221 a-a-CH3DCH2OH
26150.3388 0.0089 -7.4686 3 65.0242 29 47517 30314 312 15 015 a-a-CH3DCH2OH
26680.8443 0.0086 -7.3232 3 97.4505 35 47517 30317 414 18 117 a-a-CH3DCH2OH
26843.6000 0.1000 -5.7659 3 3.3502 7 -47517 303 3 1 2 3 0 3 a-a-CH3DCH2OH
27077.8564 0.0163 -7.4180 3 111.9389 41 47517 30320 120 19 217 a-a-CH3DCH2OH
27451.5000 0.1000 -6.5102 3 27.1731 15 -47517 303 7 4 4 8 3 5 a-a-CH3DCH2OH
27785.0007 0.0130 -6.3019 3 144.4788 37 47517 30318 811 19 712 a-a-CH3DCH2OH
27785.7367 0.0130 -6.3019 3 144.4788 37 47517 30318 810 19 713 a-a-CH3DCH2OH
27890.0000 0.1000 -6.4969 3 27.1586 15 -47517 303 7 4 3 8 3 6 a-a-CH3DCH2OH
27890.5991 0.1348 -7.5212 3 290.0543 65 47517 30332 231 31 328 a-a-CH3DCH2OH
28018.6120 0.0519 -6.2836 3 230.8836 51 47517 30325 818 24 915 a-a-CH3DCH2OH
28019.9045 0.0519 -6.2836 3 230.8836 51 47517 30325 817 24 916 a-a-CH3DCH2OH
28077.7000 0.1000 -6.1788 3 70.3924 29 -47517 30314 411 13 5 8 a-a-CH3DCH2OH
28134.3000 0.1000 -6.4511 3 14.9361 15 -47517 303 7 1 7 6 2 4 a-a-CH3DCH2OH
28572.9000 0.1000 -6.1756 3 2.3972 7 -47517 303 3 0 3 2 1 2 a-a-CH3DCH2OH
28850.3000 0.1000 -6.1548 3 70.3920 29 -47517 30314 410 13 5 9 a-a-CH3DCH2OH
29446.8000 0.1000 -5.6043 3 5.5745 9 -47517 303 4 1 3 4 0 4 a-a-CH3DCH2OH
30530.6415 0.0082 -7.3487 3 57.0199 27 47517 30313 311 14 014 a-a-CH3DCH2OH
31153.7000 0.1000 -6.6837 3 11.5386 9 -47517 303 4 3 2 5 2 3 a-a-CH3DCH2OH
31267.2000 0.1000 -6.1653 3 27.1731 19 -47517 303 9 2 8 8 3 5 a-a-CH3DCH2OH
32040.9000 0.1000 -6.1854 3 104.1409 31 -47517 30315 7 9 16 610 a-a-CH3DCH2OH
32044.2000 0.1000 -6.1853 3 104.1408 31 -47517 30315 7 8 16 611 a-a-CH3DCH2OH
32229.4652 0.1161 -6.2336 3 289.2871 57 47517 30328 920 271017 a-a-CH3DCH2OH
32229.7471 0.1161 -6.2336 3 289.2871 57 47517 30328 919 271018 a-a-CH3DCH2OH
32569.6000 0.1000 -6.0376 3 104.1409 35 -47517 30317 513 16 610 a-a-CH3DCH2OH
32600.7000 0.1000 -6.6478 3 11.4906 9 -47517 303 4 3 1 5 2 4 a-a-CH3DCH2OH
32765.2000 0.1000 -6.0323 3 104.1408 35 -47517 30317 512 16 611 a-a-CH3DCH2OH
32916.4000 0.1000 -5.4563 3 8.3448 11 -47517 303 5 1 4 5 0 5 a-a-CH3DCH2OH
33089.8148 0.0428 -7.0265 3 232.0317 57 47517 30328 226 27 523 a-a-CH3DCH2OH
34199.0324 0.3194 -7.3676 3 412.4531 75 47517 30337 433 36 730 a-a-CH3DCH2OH
34899.9814 0.0140 -7.1241 3 101.0792 39 47517 30319 119 18 216 a-a-CH3DCH2OH
35861.9371 0.1097 -7.0913 3 306.8688 65 47517 30332 329 31 626 a-a-CH3DCH2OH
36139.6561 0.0076 -7.2347 3 49.5339 25 47517 30312 310 13 013 a-a-CH3DCH2OH
36287.7000 0.1000 -6.1223 3 70.3924 25 -47517 30312 6 7 13 5 8 a-a-CH3DCH2OH
36301.1500 0.1000 -6.1220 3 70.3920 25 -47517 30312 6 6 13 5 9 a-a-CH3DCH2OH
36374.0487 0.0922 -6.1479 3 230.8836 47 47517 303231014 24 915 a-a-CH3DCH2OH
36374.0657 0.0922 -6.1479 3 230.8836 47 47517 303231013 24 916 a-a-CH3DCH2OH
36797.8957 0.0535 -7.2745 3 239.0644 55 47517 30327 622 28 325 a-a-CH3DCH2OH
36863.6000 0.1000 -5.9449 3 144.4788 41 -47517 30320 615 19 712 a-a-CH3DCH2OH
36910.4000 0.1000 -5.9438 3 144.4788 41 -47517 30320 614 19 713 a-a-CH3DCH2OH
37369.8260 0.0300 -5.3174 3 11.6550 13 -47517 303 6 1 5 6 0 6 a-a-CH3DCH2OH
37424.1448 0.1112 -7.2063 3 272.5483 63 47517 30331 230 30 327 a-a-CH3DCH2OH
37787.8270 0.0300 -6.1959 3 18.9142 17 -47517 303 8 1 8 7 2 5 a-a-CH3DCH2OH
37796.3253 0.4978 -7.3915 3 458.0599 81 47517 30340 238 39 535 a-a-CH3DCH2OH
38318.0986 0.0083 -7.0789 3 87.4925 33 47517 30316 413 17 116 a-a-CH3DCH2OH
39453.8160 0.0300 -5.9412 3 0.0000 3 -47517 303 1 1 1 0 0 0 a-a-CH3DCH2OH
39719.3650 0.0300 -5.8726 3 49.4144 25 -47517 30312 310 11 4 7 a-a-CH3DCH2OH
39803.9256 0.0551 -6.8733 3 247.8282 59 47517 30329 227 28 524 a-a-CH3DCH2OH
40503.4240 0.0300 -6.1266 3 43.2365 19 -47517 303 9 5 5 10 4 6 a-a-CH3DCH2OH
40557.7530 0.0300 -6.1255 3 43.2347 19 -47517 303 9 5 4 10 4 7 a-a-CH3DCH2OH
40623.0261 0.0382 -6.0148 3 179.0585 41 47517 30320 912 21 813 a-a-CH3DCH2OH
40623.1031 0.0382 -6.0148 3 179.0585 41 47517 30320 911 21 814 a-a-CH3DCH2OH
41097.8135 0.0210 -5.8887 3 191.4025 47 47517 30323 717 22 814 a-a-CH3DCH2OH
41108.6200 0.0210 -5.8884 3 191.4025 47 47517 30323 716 22 815 a-a-CH3DCH2OH
41809.1614 0.4247 -7.2455 3 436.2389 79 47517 30339 237 38 534 a-a-CH3DCH2OH
42033.5499 0.0122 -6.8834 3 90.7637 37 47517 30318 118 17 215 a-a-CH3DCH2OH
42299.3170 0.0300 -5.8889 3 11.4906 13 -47517 303 6 1 5 5 2 4 a-a-CH3DCH2OH
42758.6479 0.0111 -7.0482 3 147.7072 43 47517 30321 517 22 220 a-a-CH3DCH2OH
42913.2010 0.0300 -5.1864 3 15.4990 15 -47517 303 7 1 6 7 0 7 a-a-CH3DCH2OH
43033.7890 0.0071 -7.1376 3 42.5656 23 47517 30311 3 9 12 012 a-a-CH3DCH2OH
43998.8210 0.0300 -5.8282 3 27.1586 19 -47517 303 9 2 7 8 3 6 a-a-CH3DCH2OH
44266.4100 0.0300 -5.7727 3 49.4106 25 -47517 30312 3 9 11 4 8 a-a-CH3DCH2OH
44634.7720 0.0300 -6.2413 3 22.6765 13 -47517 303 6 4 3 7 3 4 a-a-CH3DCH2OH
44834.8480 0.0300 -6.2376 3 22.6699 13 -47517 303 6 4 2 7 3 5 a-a-CH3DCH2OH
44873.5778 0.0117 -5.9186 3 133.8164 35 47517 30317 810 18 711 a-a-CH3DCH2OH
44873.9190 0.0117 -5.9186 3 133.8164 35 47517 30317 8 9 18 712 a-a-CH3DCH2OH
45011.2100 0.0705 -6.7834 3 264.1861 61 47517 30330 228 29 525 a-a-CH3DCH2OH
45305.0890 0.0566 -5.8632 3 244.9080 53 47517 30326 819 25 916 a-a-CH3DCH2OH
45307.5110 0.0566 -5.8632 3 244.9080 53 47517 30326 818 25 917 a-a-CH3DCH2OH
45346.3792 0.3599 -7.1183 3 414.9507 77 47517 30338 236 37 533 a-a-CH3DCH2OH
45366.4510 0.0300 -5.7251 3 78.2535 31 -47517 30315 412 14 5 9 a-a-CH3DCH2OH
45839.4740 0.0300 -6.0578 3 23.4767 19 -47517 303 9 1 9 8 2 6 a-a-CH3DCH2OH
45876.1390 0.7176 -7.3369 3 502.7182 85 47517 30342 340 41 437 a-a-CH3DCH2OH
46071.1520 0.0300 -5.7804 3 32.2389 21 -47517 30310 2 9 9 3 6 a-a-CH3DCH2OH
46664.3940 0.0300 -5.5549 3 4.0180 9 -47517 303 4 0 4 3 1 3 a-a-CH3DCH2OH
46685.8260 0.0300 -5.6994 3 78.2526 31 -47517 30315 411 14 510 a-a-CH3DCH2OH
47305.8838 0.0908 -6.9414 3 255.5501 61 47517 30330 229 29 326 a-a-CH3DCH2OH
48259.3257 0.0109 -6.6788 3 81.0001 35 47517 30317 117 16 214 a-a-CH3DCH2OH
48321.1197 0.3026 -7.0083 3 394.1981 75 47517 30337 235 36 532 a-a-CH3DCH2OH
48570.0000 0.1000 -6.6719 3 8.7169 7 -47517 303 3 3 1 4 2 2 a-a-CH3DCH2OH
48816.3205 0.0893 -6.7380 3 281.1035 63 47517 30331 229 30 526 a-a-CH3DCH2OH
49118.5672 0.0055 -5.8639 3 95.1612 29 47517 30314 7 8 15 6 9 a-a-CH3DCH2OH
49120.0337 0.0055 -5.8639 3 95.1611 29 47517 30314 7 7 15 610 a-a-CH3DCH2OH
49193.4020 0.0043 -6.6623 3 8.6961 7 47517 303 3 3 0 4 2 3 a-a-CH3DCH2OH
49254.1694 0.1295 -6.7977 3 324.9362 67 47517 30333 330 32 627 a-a-CH3DCH2OH
49489.9527 0.1240 -5.8650 3 304.9906 59 47517 30329 921 281018 a-a-CH3DCH2OH
49490.4838 0.1240 -5.8650 3 304.9906 59 47517 30329 920 281019 a-a-CH3DCH2OH
49617.5310 0.0300 -5.0635 3 19.8709 17 -47517 303 8 1 7 8 0 8 a-a-CH3DCH2OH
49976.6000 0.1000 -5.6408 3 113.6850 37 -47517 30318 514 17 611 a-a-CH3DCH2OH
50319.8000 0.1000 -5.6347 3 113.6848 37 -47517 30318 513 17 612 a-a-CH3DCH2OH
50640.2344 0.2525 -6.9150 3 373.9843 73 47517 30336 234 35 531 a-a-CH3DCH2OH
51254.8983 0.0068 -7.0679 3 36.1147 21 47517 30310 3 8 11 011 a-a-CH3DCH2OH
51328.0468 0.1120 -6.7264 3 298.5776 65 47517 30332 230 31 527 a-a-CH3DCH2OH
51512.0236 0.0082 -6.9150 3 78.0485 31 47517 30315 412 16 115 a-a-CH3DCH2OH
52162.7960 0.0300 -5.9980 3 28.6263 21 -47517 30310 110 9 2 7 a-a-CH3DCH2OH
52205.1526 0.2089 -6.8387 3 354.3122 71 47517 30335 233 34 530 a-a-CH3DCH2OH
52656.7843 0.1392 -6.7420 3 316.6057 67 47517 30333 231 32 528 a-a-CH3DCH2OH
52912.8373 0.1713 -6.7804 3 335.1849 69 47517 30334 232 33 529 a-a-CH3DCH2OH
53347.5360 0.0300 -5.8619 3 63.0960 23 -47517 30311 6 6 12 5 7 a-a-CH3DCH2OH
53353.5830 0.0300 -5.8618 3 63.0958 23 -47517 30311 6 5 12 5 8 a-a-CH3DCH2OH
53373.5985 0.0099 -6.5018 3 71.7955 33 47517 30316 116 15 213 a-a-CH3DCH2OH
53430.8477 0.0878 -5.8293 3 217.4221 45 47517 303221013 23 914 a-a-CH3DCH2OH
53430.8555 0.0878 -5.8293 3 217.4221 45 47517 303221012 23 915 a-a-CH3DCH2OH
53475.3580 0.3501 -6.9494 3 433.3425 77 47517 30338 434 37 731 a-a-CH3DCH2OH
54271.5921 0.0079 -5.5939 3 155.7052 43 47517 30321 616 20 713 a-a-CH3DCH2OH
54355.2592 0.0079 -5.5925 3 155.7051 43 47517 30321 615 20 714 a-a-CH3DCH2OH
55090.3920 0.0300 -5.4769 3 0.5595 5 -47517 303 2 1 2 1 0 1 a-a-CH3DCH2OH
55132.1336 0.6299 -7.1134 3 479.6895 83 47517 30341 339 40 436 a-a-CH3DCH2OH
56342.2270 0.0300 -5.5287 3 56.1589 27 -47517 30313 311 12 4 8 a-a-CH3DCH2OH
56686.5000 0.1000 -5.9956 3 34.3639 23 -47517 30311 111 10 2 8 a-a-CH3DCH2OH
57192.8940 0.0300 -6.3488 3 63.1565 31 -47517 30315 115 14 212 a-a-CH3DCH2OH
57400.7615 0.0732 -6.7092 3 239.0644 59 47517 30329 228 28 325 a-a-CH3DCH2OH
57498.1280 0.0300 -4.9490 3 24.7661 19 -47517 303 9 1 8 9 0 9 a-a-CH3DCH2OH
57542.6580 0.0300 -5.9395 3 37.6236 17 -47517 303 8 5 4 9 4 5 a-a-CH3DCH2OH
57566.0240 0.0300 -5.9392 3 37.6228 17 -47517 303 8 5 3 9 4 6 a-a-CH3DCH2OH
57677.0512 0.0358 -5.7369 3 167.2779 39 47517 30319 911 20 812 a-a-CH3DCH2OH
57677.0859 0.0358 -5.7369 3 167.2779 39 47517 30319 910 20 813 a-a-CH3DCH2OH
58227.2160 0.0300 -4.7868 3 26.6840 19 -47517 303 9 2 7 9 1 8 a-a-CH3DCH2OH
58477.2815 0.0238 -5.5756 3 204.3102 49 47517 30324 718 23 815 a-a-CH3DCH2OH
58481.0550 0.0300 -4.8395 3 21.5259 17 -47517 303 8 2 6 8 1 7 a-a-CH3DCH2OH
58496.8209 0.0238 -5.5753 3 204.3102 49 47517 30324 717 23 816 a-a-CH3DCH2OH
58886.5060 0.0300 -4.7350 3 32.3996 21 -47517 30310 2 8 10 1 9 a-a-CH3DCH2OH
59210.0689 0.0429 -6.9445 3 223.0975 53 47517 30326 621 27 324 a-a-CH3DCH2OH
59395.9700 0.0300 -6.0373 3 40.6886 25 -47517 30312 112 11 2 9 a-a-CH3DCH2OH
59471.8390 0.0300 -4.8963 3 16.9304 15 -47517 303 7 2 5 7 1 6 a-a-CH3DCH2OH
59556.2060 0.0300 -6.2189 3 55.0889 29 -47517 30314 114 13 211 a-a-CH3DCH2OH
60117.1690 0.0300 -5.5197 3 37.8772 23 -47517 30311 210 10 3 7 a-a-CH3DCH2OH
60327.0120 0.0300 -6.1138 3 47.5982 27 -47517 30313 113 12 210 a-a-CH3DCH2OH
60607.1480 0.0300 -4.6817 3 38.6670 23 -47517 30311 2 9 11 110 a-a-CH3DCH2OH
60716.6834 0.1535 -6.6104 3 343.5710 69 47517 30334 331 33 628 a-a-CH3DCH2OH
60822.9982 0.0066 -7.0355 3 30.1813 19 47517 303 9 3 7 10 010 a-a-CH3DCH2OH
60996.1970 0.0300 -4.9611 3 12.9015 13 -47517 303 6 2 4 6 1 5 a-a-CH3DCH2OH
61232.0131 0.2070 -7.0835 3 332.5608 65 47517 30332 726 33 429 a-a-CH3DCH2OH
61296.0260 0.0107 -6.8339 3 135.2601 41 47517 30320 516 21 219 a-a-CH3DCH2OH
61670.1280 0.0300 -6.1857 3 18.7464 11 -47517 303 5 4 2 6 3 3 a-a-CH3DCH2OH
61750.3386 0.0048 -6.1847 3 18.7437 11 47517 303 5 4 1 6 3 4 a-a-CH3DCH2OH
61918.4456 0.0107 -5.6799 3 123.7177 33 47517 30316 8 9 17 710 a-a-CH3DCH2OH
61918.5963 0.0107 -5.6799 3 123.7177 33 47517 30316 8 8 17 711 a-a-CH3DCH2OH
62627.6670 0.0300 -5.4228 3 14.8414 15 -47517 303 7 1 6 6 2 5 a-a-CH3DCH2OH
62650.5505 0.0619 -5.5821 3 259.4957 55 47517 30327 820 26 917 a-a-CH3DCH2OH
62654.9733 0.0619 -5.5821 3 259.4957 55 47517 30327 819 26 918 a-a-CH3DCH2OH
62673.5889 0.0046 -5.4152 3 86.6801 33 47517 30316 413 15 510 a-a-CH3DCH2OH
62832.6390 0.0300 -5.0394 3 9.4428 11 -47517 303 5 2 3 5 1 4 a-a-CH3DCH2OH
63454.0524 0.0045 -5.4157 3 56.1513 27 47517 30313 310 12 4 9 a-a-CH3DCH2OH
63512.7540 0.0300 -4.6259 3 45.4796 25 -47517 30312 210 12 111 a-a-CH3DCH2OH
64566.5656 0.0047 -5.4234 3 32.2102 21 47517 30310 2 8 9 3 7 a-a-CH3DCH2OH
64757.7450 0.0300 -5.1396 3 6.5568 9 -47517 303 4 2 2 4 1 3 a-a-CH3DCH2OH
64841.2801 0.0047 -5.3842 3 86.6782 33 47517 30316 412 15 511 a-a-CH3DCH2OH
64970.1769 0.5505 -6.9066 3 457.1587 81 47517 30340 338 39 435 a-a-CH3DCH2OH
64974.6190 0.0300 -5.1230 3 6.1775 11 -47517 303 5 0 5 4 1 4 a-a-CH3DCH2OH
66146.7550 0.0058 -5.6667 3 86.7452 27 47517 30313 7 7 14 6 8 a-a-CH3DCH2OH
66147.3855 0.0058 -5.6666 3 86.7452 27 47517 30313 7 6 14 6 9 a-a-CH3DCH2OH
66169.5503 0.9284 -7.0458 3 581.4976 89 47517 30344 539 43 836 a-a-CH3DCH2OH
66200.4068 0.0080 -6.8153 3 69.1208 29 47517 30314 411 15 114 a-a-CH3DCH2OH
66503.0600 0.0048 -4.8429 3 30.1813 21 47517 30310 1 9 10 010 a-a-CH3DCH2OH
66564.5838 0.0032 -5.2801 3 4.2457 7 47517 303 3 2 1 3 1 2 a-a-CH3DCH2OH
66801.0552 0.1330 -5.6114 3 321.2569 61 47517 30330 922 291019 a-a-CH3DCH2OH
66802.0325 0.1330 -5.6114 3 321.2569 61 47517 30330 921 291020 a-a-CH3DCH2OH
67461.6235 0.0053 -5.3610 3 123.7941 39 47517 30319 515 18 612 a-a-CH3DCH2OH
67527.7381 0.0582 -6.5004 3 223.0975 57 47517 30328 227 27 324 a-a-CH3DCH2OH
67703.4937 0.0027 -4.5672 3 52.8306 27 47517 30313 211 13 112 a-a-CH3DCH2OH
68043.3799 0.0052 -5.3533 3 123.7937 39 47517 30319 514 18 613 a-a-CH3DCH2OH
68077.6920 0.0300 -5.5217 3 2.5110 5 -47517 303 2 2 0 2 1 1 a-a-CH3DCH2OH
70173.8855 0.0018 -5.1393 3 1.6772 7 47517 303 3 1 3 2 0 2 a-a-CH3DCH2OH
70314.5706 0.1829 -6.4885 3 362.7720 71 47517 30335 332 34 629 a-a-CH3DCH2OH
70350.4298 0.0065 -5.7155 3 56.3635 21 47517 30310 6 5 11 5 6 a-a-CH3DCH2OH
70352.9245 0.0065 -5.7155 3 56.3634 21 47517 30310 6 4 11 5 7 a-a-CH3DCH2OH
70455.6872 0.0840 -5.6097 3 204.5235 43 47517 303211012 22 913 a-a-CH3DCH2OH
70455.6907 0.0840 -5.6097 3 204.5235 43 47517 303211011 22 914 a-a-CH3DCH2OH
70657.2506 0.3854 -6.6891 3 454.8019 79 47517 30339 435 38 732 a-a-CH3DCH2OH
71449.5507 0.0032 -5.5107 3 2.3972 5 47517 303 2 2 1 2 1 2 a-a-CH3DCH2OH
71726.5102 0.0066 -7.0506 3 24.7661 17 47517 303 8 3 6 9 0 9 a-a-CH3DCH2OH
71762.9505 0.0090 -5.3407 3 167.4962 45 47517 30322 617 21 714 a-a-CH3DCH2OH
71907.9220 0.0300 -5.3389 3 167.4961 45 -47517 30322 616 21 715 a-a-CH3DCH2OH
72698.6130 0.0300 -5.2773 3 63.4715 29 -47517 30314 312 13 4 9 a-a-CH3DCH2OH
73182.2900 0.0300 -5.2582 3 4.0180 7 -47517 303 3 2 2 3 1 3 a-a-CH3DCH2OH
73219.1090 0.0300 -5.3359 3 44.0918 25 -47517 30312 211 11 3 8 a-a-CH3DCH2OH
73250.6860 0.0300 -4.5062 3 60.7131 29 -47517 30314 212 14 113 a-a-CH3DCH2OH
74512.0502 0.0056 -5.8748 3 32.5747 15 47517 303 7 5 3 8 4 4 a-a-CH3DCH2OH
74521.0610 0.0300 -5.8747 3 32.5744 15 -47517 303 7 5 2 8 4 5 a-a-CH3DCH2OH
74695.6166 0.0337 -5.5456 3 156.0604 37 47517 30318 910 19 811 a-a-CH3DCH2OH
74695.6315 0.0337 -5.5456 3 156.0604 37 47517 30318 9 9 19 812 a-a-CH3DCH2OH
75385.3167 0.4785 -6.7126 3 435.1263 79 47517 30339 337 38 434 a-a-CH3DCH2OH
75506.4070 0.0300 -5.1035 3 6.1775 9 -47517 303 4 2 3 4 1 4 a-a-CH3DCH2OH
75931.0348 0.0270 -5.3457 3 217.7820 51 47517 30325 719 24 816 a-a-CH3DCH2OH
75965.4407 0.0270 -5.3453 3 217.7819 51 47517 30325 718 24 817 a-a-CH3DCH2OH
76019.4200 1.4530 -7.0472 3 662.7734 97 47517 30348 345 47 642 a-a-CH3DCH2OH
76514.2970 0.0300 -4.7450 3 36.1147 23 -47517 30311 110 11 011 a-a-CH3DCH2OH
77470.1375 0.0457 -6.3093 3 207.6569 55 47517 30327 226 26 323 a-a-CH3DCH2OH
78138.9850 0.2188 -6.4125 3 382.5374 73 47517 30336 333 35 630 a-a-CH3DCH2OH
78431.0360 0.0300 -4.9861 3 8.8744 11 -47517 303 5 2 4 5 1 5 a-a-CH3DCH2OH
78604.5830 0.0300 -6.3656 3 15.3808 9 -47517 303 4 4 1 5 3 2 a-a-CH3DCH2OH
78631.3710 0.0300 -6.3654 3 15.3799 9 -47517 303 4 4 0 5 3 3 a-a-CH3DCH2OH
78924.0587 0.0100 -5.5195 3 114.1823 31 47517 30315 8 8 16 7 9 a-a-CH3DCH2OH
78924.1217 0.0100 -5.5195 3 114.1823 31 47517 30315 8 7 16 710 a-a-CH3DCH2OH
79964.3608 0.0048 -5.1812 3 95.6731 35 47517 30317 414 16 511 a-a-CH3DCH2OH
80059.6319 0.0679 -5.3728 3 274.6470 57 47517 30328 821 27 918 a-a-CH3DCH2OH
80067.5166 0.0679 -5.3727 3 274.6470 57 47517 30328 820 27 919 a-a-CH3DCH2OH
80185.6510 0.0300 -4.4440 3 69.1208 31 -47517 30315 213 15 114 a-a-CH3DCH2OH
80481.5125 1.2792 -6.9314 3 636.4522 95 47517 30347 344 46 641 a-a-CH3DCH2OH
81223.3607 0.0109 -6.7044 3 123.3351 39 47517 30319 515 20 218 a-a-CH3DCH2OH
81964.3590 0.0300 -4.8885 3 12.1073 13 -47517 303 6 2 5 6 1 6 a-a-CH3DCH2OH
82268.3927 0.0079 -6.7714 3 60.7131 27 47517 30313 410 14 113 a-a-CH3DCH2OH
82929.0846 0.0334 -6.7454 3 207.6569 51 47517 30325 620 26 323 a-a-CH3DCH2OH
83131.5560 0.0300 -5.5443 3 78.8926 25 -47517 30312 7 6 13 6 7 a-a-CH3DCH2OH
83131.8500 0.0300 -5.5443 3 78.8926 25 -47517 30312 7 5 13 6 8 a-a-CH3DCH2OH
83310.5650 0.0300 -5.0693 3 18.7470 17 -47517 303 8 1 7 7 2 6 a-a-CH3DCH2OH
83360.5300 0.0300 -4.7907 3 8.8744 13 -47517 303 6 0 6 5 1 5 a-a-CH3DCH2OH
83372.6480 0.0300 -5.1424 3 63.4573 29 -47517 30314 311 13 410 a-a-CH3DCH2OH
83403.5070 0.0300 -5.1422 3 95.6696 35 -47517 30317 413 16 512 a-a-CH3DCH2OH
84166.4650 0.1431 -5.4205 3 338.0862 63 47517 30331 923 301020 a-a-CH3DCH2OH
84168.2243 0.1431 -5.4205 3 338.0862 63 47517 30331 922 301021 a-a-CH3DCH2OH
84297.6721 0.2622 -6.3710 3 402.8651 75 47517 30337 334 36 631 a-a-CH3DCH2OH
84501.0080 1.1204 -6.8242 3 610.6604 93 47517 30346 343 45 640 a-a-CH3DCH2OH
84757.9480 0.0300 -4.8721 3 3.3502 9 -47517 303 4 1 4 3 0 3 a-a-CH3DCH2OH
85018.2660 0.0300 -5.1461 3 134.4688 41 -47517 30320 516 19 613 a-a-CH3DCH2OH
85173.6770 0.0300 -5.2083 3 50.8872 27 -47517 30313 212 12 3 9 a-a-CH3DCH2OH
85716.6414 0.4286 -6.5144 3 476.8303 81 47517 30340 436 39 733 a-a-CH3DCH2OH
85866.5610 0.0300 -5.1135 3 37.8244 23 -47517 30311 2 9 10 3 8 a-a-CH3DCH2OH
85975.0430 0.0300 -5.1359 3 134.4680 41 -47517 30320 515 19 614 a-a-CH3DCH2OH
86111.7470 0.0300 -4.8033 3 15.8746 15 -47517 303 7 2 6 7 1 7 a-a-CH3DCH2OH
86329.8812 0.4128 -6.5288 3 413.5939 77 47517 30338 336 37 433 a-a-CH3DCH2OH
86989.5911 0.0355 -6.1323 3 192.7508 53 47517 30326 225 25 322 a-a-CH3DCH2OH
87305.2961 0.0069 -5.6495 3 50.1942 19 47517 303 9 6 4 10 5 5 a-a-CH3DCH2OH
87306.2335 0.0069 -5.6495 3 50.1941 19 47517 303 9 6 3 10 5 6 a-a-CH3DCH2OH
87359.9050 0.0300 -4.6549 3 42.5656 25 -47517 30312 111 12 012 a-a-CH3DCH2OH
87451.1717 0.0807 -5.4485 3 192.1874 41 47517 303201011 21 912 a-a-CH3DCH2OH
87451.1731 0.0807 -5.4485 3 192.1874 41 47517 303201010 21 913 a-a-CH3DCH2OH
87465.2745 0.9702 -6.7862 3 606.3388 91 47517 30345 540 44 837 a-a-CH3DCH2OH
87990.8965 0.9759 -6.7260 3 585.4010 91 47517 30345 342 44 639 a-a-CH3DCH2OH
88486.4270 0.0300 -4.3820 3 78.0485 33 -47517 30316 214 16 115 a-a-CH3DCH2OH
88497.1700 0.0300 -4.2929 3 90.7637 35 -47517 30317 314 17 215 a-a-CH3DCH2OH
88573.5692 0.1793 -6.8376 3 313.6133 63 47517 30331 725 32 428 a-a-CH3DCH2OH
88676.2520 0.0300 -5.0843 3 71.3543 31 -47517 30315 313 14 410 a-a-CH3DCH2OH
88761.2800 0.0300 -4.3066 3 81.0001 33 -47517 30316 313 16 214 a-a-CH3DCH2OH
88907.8345 0.3141 -6.3568 3 423.7528 77 47517 30338 335 37 632 a-a-CH3DCH2OH
89341.3091 0.0104 -5.1439 3 179.8522 47 47517 30323 618 22 715 a-a-CH3DCH2OH
89509.6780 0.0300 -4.2757 3 101.0792 37 -47517 30318 315 18 216 a-a-CH3DCH2OH
89585.8570 0.0300 -5.1415 3 179.8520 47 -47517 30323 617 22 716 a-a-CH3DCH2OH
90129.0850 0.0300 -4.3180 3 71.7955 31 -47517 30315 312 15 213 a-a-CH3DCH2OH
90856.7527 0.8450 -6.6370 3 560.6768 89 47517 30344 341 43 638 a-a-CH3DCH2OH
90874.0010 0.0300 -4.7268 3 20.1746 17 -47517 303 8 2 7 8 1 8 a-a-CH3DCH2OH
91427.1880 0.0300 -5.9306 3 28.0889 13 -47517 303 6 5 2 7 4 3 a-a-CH3DCH2OH
91430.1780 0.0300 -5.9306 3 28.0888 13 -47517 303 6 5 1 7 4 4 a-a-CH3DCH2OH
91681.9757 0.0320 -5.4090 3 145.4056 35 47517 30317 9 9 18 810 a-a-CH3DCH2OH
91681.9818 0.0320 -5.4090 3 145.4056 35 47517 30317 9 8 18 811 a-a-CH3DCH2OH
91934.5110 0.0300 -4.2543 3 111.9389 39 -47517 30319 316 19 217 a-a-CH3DCH2OH
92091.2069 0.3754 -6.3649 3 445.1978 79 47517 30339 336 38 633 a-a-CH3DCH2OH
92390.3250 0.0300 -4.3285 3 63.1565 29 -47517 30314 311 14 212 a-a-CH3DCH2OH
92997.3804 0.7273 -6.5580 3 536.4911 87 47517 30343 340 42 637 a-a-CH3DCH2OH
93464.4710 0.0307 -5.1657 3 231.8182 53 47517 30326 720 25 817 a-a-CH3DCH2OH
93523.5902 0.0307 -5.1651 3 231.8182 53 47517 30326 719 25 818 a-a-CH3DCH2OH
93672.8704 1.8792 -6.9253 3 688.8767 99 47517 30349 446 48 543 a-a-CH3DCH2OH
93970.8290 0.4467 -6.3914 3 467.1972 81 47517 30340 337 39 634 a-a-CH3DCH2OH
94305.5729 0.6220 -6.4898 3 512.8471 85 47517 30342 339 41 636 a-a-CH3DCH2OH
94668.9470 0.5287 -6.4337 3 489.7480 83 47517 30341 338 40 635 a-a-CH3DCH2OH
95302.2950 0.0300 -4.3396 3 55.0889 27 -47517 30313 310 13 211 a-a-CH3DCH2OH
95770.4430 0.0300 -5.1262 3 58.2679 29 -47517 30314 213 13 310 a-a-CH3DCH2OH
95840.2186 0.0274 -5.9672 3 178.3879 51 47517 30325 224 24 321 a-a-CH3DCH2OH
95870.7819 0.0051 -4.2286 3 123.3351 41 47517 30320 317 20 218 a-a-CH3DCH2OH
95894.5724 0.0097 -5.4127 3 105.2097 29 47517 30314 8 7 15 7 8 a-a-CH3DCH2OH
95894.5971 0.0097 -5.4127 3 105.2097 29 47517 30314 8 6 15 7 9 a-a-CH3DCH2OH
96245.6930 0.0300 -4.6570 3 25.0057 19 -47517 303 9 2 8 9 1 9 a-a-CH3DCH2OH
97190.1690 0.0300 -4.9955 3 105.2337 37 -47517 30318 415 17 512 a-a-CH3DCH2OH
97537.1397 0.0749 -5.2080 3 290.3622 59 47517 30329 822 28 919 a-a-CH3DCH2OH
97550.8855 0.0749 -5.2079 3 290.3622 59 47517 30329 821 28 920 a-a-CH3DCH2OH
97705.9679 0.3527 -6.3534 3 392.5651 75 47517 30337 335 36 432 a-a-CH3DCH2OH
98068.8380 0.0300 -4.3211 3 87.4925 35 -47517 30317 215 17 116 a-a-CH3DCH2OH
98602.1020 0.0300 -4.3527 3 47.5982 25 -47517 30312 3 9 12 210 a-a-CH3DCH2OH
98677.8424 0.4833 -6.3962 3 499.4266 83 47517 30341 437 40 734 a-a-CH3DCH2OH
98833.8470 0.0300 -4.5724 3 49.5339 27 -47517 30313 112 13 013 a-a-CH3DCH2OH
98928.0217 0.0025 -4.6492 3 5.5745 11 47517 303 5 1 5 4 0 4 a-a-CH3DCH2OH
99551.7546 0.0078 -6.7782 3 52.8306 25 47517 30312 4 9 13 112 a-a-CH3DCH2OH
100078.5440 0.0300 -5.4791 3 71.6028 23 -47517 30311 7 5 12 6 6 a-a-CH3DCH2OH
100078.5440 0.0300 -5.4791 3 71.6028 23 -47517 30311 7 4 12 6 7 a-a-CH3DCH2OH
101378.2080 0.0300 -4.1990 3 135.2601 43 -47517 30321 318 21 219 a-a-CH3DCH2OH
101590.0579 0.1546 -5.2696 3 355.4787 65 47517 30332 924 311021 a-a-CH3DCH2OH
101593.1604 0.1546 -5.2696 3 355.4787 65 47517 30332 923 311022 a-a-CH3DCH2OH
101678.8190 0.0300 -4.5221 3 12.1073 15 -47517 303 7 0 7 6 1 6 a-a-CH3DCH2OH
102025.1630 0.0300 -4.3693 3 40.6886 23 -47517 30311 3 8 11 2 9 a-a-CH3DCH2OH
102213.9660 0.0040 -4.5927 3 30.3662 21 47517 30310 2 9 10 110 a-a-CH3DCH2OH
102324.4520 0.0300 -6.6344 3 111.9389 37 -47517 30318 514 19 217 a-a-CH3DCH2OH
102474.6840 0.0300 -4.9455 3 105.2273 37 -47517 30318 414 17 513 a-a-CH3DCH2OH
102634.4660 0.0300 -4.9731 3 145.7100 43 -47517 30321 517 20 614 a-a-CH3DCH2OH
102722.7810 0.0300 -4.9390 3 1.3540 5 -47517 303 2 2 1 1 1 0 a-a-CH3DCH2OH
103780.4945 0.0212 -5.8127 3 164.5766 49 47517 30324 223 23 320 a-a-CH3DCH2OH
103902.4360 0.0300 -4.9399 3 1.3160 5 -47517 303 2 2 0 1 1 1 a-a-CH3DCH2OH
104097.4997 1.7145 -6.7626 3 661.8437 97 47517 30348 445 47 542 a-a-CH3DCH2OH
104114.3630 0.0300 -4.9194 3 71.3290 31 -47517 30315 312 14 411 a-a-CH3DCH2OH
104140.4890 0.0300 -4.9332 3 79.8098 33 -47517 30316 314 15 411 a-a-CH3DCH2OH
104164.7980 0.0300 -4.9595 3 145.7084 43 -47517 30321 516 20 615 a-a-CH3DCH2OH
104219.8922 0.0074 -5.6600 3 44.5875 17 47517 303 8 6 3 9 5 4 a-a-CH3DCH2OH
104220.2051 0.0074 -5.6600 3 44.5875 17 47517 303 8 6 2 9 5 5 a-a-CH3DCH2OH
104272.3190 0.0300 -4.7820 3 23.2059 19 -47517 303 9 1 8 8 2 7 a-a-CH3DCH2OH
104419.7780 0.0778 -5.3279 3 180.4136 39 47517 303191010 20 911 a-a-CH3DCH2OH
104419.7785 0.0778 -5.3279 3 180.4136 39 47517 3031910 9 20 912 a-a-CH3DCH2OH
104806.9620 0.0300 -5.0829 3 66.2383 31 -47517 30315 214 14 311 a-a-CH3DCH2OH
105327.1620 0.0300 -4.3911 3 34.3639 21 -47517 30310 3 7 10 2 8 a-a-CH3DCH2OH
106532.5803 1.0206 -6.6076 3 631.7498 93 47517 30346 541 45 838 a-a-CH3DCH2OH
107008.4607 0.0122 -4.9846 3 192.7737 49 47517 30324 619 23 716 a-a-CH3DCH2OH
107410.6117 0.0121 -4.9812 3 192.7734 49 47517 30324 618 23 717 a-a-CH3DCH2OH
107696.3016 0.0255 -6.6210 3 192.7508 49 47517 30324 619 25 322 a-a-CH3DCH2OH
107838.9060 0.0300 -4.8595 3 44.0010 25 -47517 30312 210 11 3 9 a-a-CH3DCH2OH
108300.4440 0.0300 -6.1856 3 24.1654 11 -47517 303 5 5 1 6 4 2 a-a-CH3DCH2OH
108301.2110 0.0300 -6.1856 3 24.1654 11 -47517 303 5 5 0 6 4 3 a-a-CH3DCH2OH
108305.5960 0.0300 -4.4200 3 28.6263 19 -47517 303 9 3 6 9 2 7 a-a-CH3DCH2OH
108469.7090 0.0300 -4.1665 3 147.7072 45 -47517 30322 319 22 220 a-a-CH3DCH2OH
108639.2017 0.0307 -5.3126 3 135.3133 33 47517 30316 9 8 17 8 9 a-a-CH3DCH2OH
108639.2040 0.0307 -5.3126 3 135.3133 33 47517 30316 9 7 17 810 a-a-CH3DCH2OH
108757.8660 0.0300 -4.5333 3 36.2547 23 -47517 30311 210 11 111 a-a-CH3DCH2OH
108786.3220 0.0300 -4.2625 3 97.4505 37 -47517 30318 216 18 117 a-a-CH3DCH2OH
109363.7529 0.2978 -6.1851 3 372.0452 73 47517 30336 334 35 431 a-a-CH3DCH2OH
109606.8810 0.5524 -6.3192 3 522.5894 85 47517 30342 438 41 735 a-a-CH3DCH2OH
110581.7710 0.0300 -5.6686 3 151.3254 47 -47517 30323 222 22 319 a-a-CH3DCH2OH
110719.4470 0.0300 -4.4973 3 57.0199 29 -47517 30314 113 14 014 a-a-CH3DCH2OH
110817.9640 0.0300 -4.4585 3 23.4767 17 -47517 303 8 3 5 8 2 6 a-a-CH3DCH2OH
111082.6824 0.0352 -5.0193 3 246.4193 55 47517 30327 721 26 818 a-a-CH3DCH2OH
111181.9835 0.0352 -5.0185 3 246.4192 55 47517 30327 720 26 819 a-a-CH3DCH2OH
112107.1800 0.0300 -5.0741 3 74.8019 33 -47517 30316 215 15 312 a-a-CH3DCH2OH
112792.6360 0.0300 -4.5097 3 18.9142 15 -47517 303 7 3 4 7 2 5 a-a-CH3DCH2OH
112797.8730 0.0300 -4.4566 3 8.3448 13 -47517 303 6 1 6 5 0 5 a-a-CH3DCH2OH
112833.8990 0.0300 -5.3488 3 96.7996 27 -47517 30313 8 6 14 7 7 a-a-CH3DCH2OH
112833.8990 0.0300 -5.3488 3 96.7996 27 -47517 30313 8 5 14 7 8 a-a-CH3DCH2OH
114228.9050 0.0300 -4.5784 3 14.9361 13 -47517 303 6 3 3 6 2 4 a-a-CH3DCH2OH
114286.5550 0.0300 -4.8443 3 115.3633 39 -47517 30319 416 18 513 a-a-CH3DCH2OH
115088.0070 0.0829 -5.0738 3 306.6415 61 47517 30330 823 29 920 a-a-CH3DCH2OH
115111.4749 0.0829 -5.0737 3 306.6414 61 47517 30330 822 29 921 a-a-CH3DCH2OH
115184.6640 0.0300 -4.6729 3 11.5386 11 -47517 303 5 3 2 5 2 3 a-a-CH3DCH2OH
115206.9897 1.5618 -6.6031 3 635.3034 95 47517 30347 444 46 541 a-a-CH3DCH2OH
115755.1690 0.0300 -4.8127 3 8.7169 9 -47517 303 4 3 1 4 2 2 a-a-CH3DCH2OH
115848.3050 0.0300 -4.4783 3 42.6699 25 -47517 30312 211 12 112 a-a-CH3DCH2OH
116033.8997 0.0133 -5.5353 3 138.6417 45 47517 30322 221 21 318 a-a-CH3DCH2OH
116049.4410 0.0300 -5.0649 3 6.4660 7 -47517 303 3 3 0 3 2 1 a-a-CH3DCH2OH
116256.8460 0.0300 -5.0638 3 6.4591 7 -47517 303 3 3 1 3 2 2 a-a-CH3DCH2OH
116370.8710 0.0300 -4.8095 3 8.6961 9 -47517 303 4 3 2 4 2 3 a-a-CH3DCH2OH
116598.3380 0.0300 -4.6656 3 11.4906 11 -47517 303 5 3 3 5 2 4 a-a-CH3DCH2OH
116758.2372 0.1526 -6.6769 3 295.2081 61 47517 30330 724 31 427 a-a-CH3DCH2OH
116893.3850 0.0300 -4.0930 3 178.3879 49 -47517 30324 420 24 321 a-a-CH3DCH2OH
116990.7270 0.0300 -4.5643 3 14.8414 13 -47517 303 6 3 4 6 2 5 a-a-CH3DCH2OH
116992.5820 0.0078 -5.4678 3 64.8755 21 47517 30310 7 4 11 6 5 a-a-CH3DCH2OH
116992.6132 0.0078 -5.4678 3 64.8755 21 47517 30310 7 3 11 6 6 a-a-CH3DCH2OH
117102.1970 0.0300 -4.1320 3 160.6705 47 -47517 30323 320 23 221 a-a-CH3DCH2OH
117211.5630 0.0300 -4.0974 3 192.7508 51 -47517 30325 421 25 322 a-a-CH3DCH2OH
117539.0430 0.0300 -5.0957 3 83.9608 35 -47517 30317 216 16 313 a-a-CH3DCH2OH
117604.8890 0.0300 -4.4856 3 18.7470 15 -47517 303 7 3 5 7 2 6 a-a-CH3DCH2OH
118023.1120 0.0300 -4.0848 3 164.5766 47 -47517 30323 419 23 320 a-a-CH3DCH2OH
118359.2910 0.0300 -4.7731 3 2.5110 7 -47517 303 3 2 2 2 1 1 a-a-CH3DCH2OH
118500.7180 0.0300 -4.4209 3 23.2059 17 -47517 303 8 3 6 8 2 7 a-a-CH3DCH2OH
118599.9261 0.6383 -6.2741 3 546.3167 87 47517 30343 439 42 736 a-a-CH3DCH2OH
118933.6190 0.0300 -4.8154 3 88.8411 35 -47517 30317 315 16 412 a-a-CH3DCH2OH
119075.8926 0.1675 -5.1467 3 373.4347 67 47517 30333 925 321022 a-a-CH3DCH2OH
119081.2590 0.1676 -5.1467 3 373.4347 67 47517 30333 924 321023 a-a-CH3DCH2OH
119126.4130 0.0300 -4.0975 3 207.6569 53 -47517 30326 422 26 323 a-a-CH3DCH2OH
119738.6620 0.0300 -4.3656 3 28.2161 19 -47517 303 9 3 7 9 2 8 a-a-CH3DCH2OH
119804.7770 0.0300 -4.2989 3 15.8746 17 -47517 303 8 0 8 7 1 7 a-a-CH3DCH2OH
119949.1160 0.0300 -5.4140 3 126.5330 43 -47517 30321 220 20 317 a-a-CH3DCH2OH
120290.0540 0.0300 -4.8300 3 157.5182 45 -47517 30322 518 21 615 a-a-CH3DCH2OH
120407.0140 0.0300 -4.0739 3 151.3254 45 -47517 30322 418 22 319 a-a-CH3DCH2OH
120439.8400 0.0300 -4.2068 3 107.9215 39 -47517 30319 217 19 118 a-a-CH3DCH2OH
121026.8820 0.0300 -5.1441 3 93.7157 37 -47517 30318 217 17 314 a-a-CH3DCH2OH
121101.0691 0.0079 -5.7691 3 39.5430 15 47517 303 7 6 2 8 5 3 a-a-CH3DCH2OH
121101.1586 0.0079 -5.7691 3 39.5430 15 47517 303 7 6 1 8 5 4 a-a-CH3DCH2OH
121106.5549 0.2478 -6.0230 3 352.0411 71 47517 30335 333 34 430 a-a-CH3DCH2OH
121363.8617 0.0754 -5.2388 3 169.2018 37 47517 3031810 9 19 910 a-a-CH3DCH2OH
121363.8619 0.0754 -5.2388 3 169.2018 37 47517 3031810 8 19 911 a-a-CH3DCH2OH
121377.3160 0.0300 -4.3171 3 33.7757 21 -47517 30310 3 8 10 2 9 a-a-CH3DCH2OH
121981.2840 0.0300 -4.7802 3 2.3972 7 -47517 303 3 2 1 2 1 2 a-a-CH3DCH2OH
122166.1300 0.0300 -5.3065 3 115.0055 41 -47517 30320 219 19 316 a-a-CH3DCH2OH
122168.7717 0.0054 -4.7798 3 115.3521 39 47517 30319 415 18 514 a-a-CH3DCH2OH
122555.4090 0.0300 -5.2155 3 104.0649 39 -47517 30319 218 18 315 a-a-CH3DCH2OH
122675.3740 0.0300 -4.8119 3 157.5155 45 -47517 30322 517 21 616 a-a-CH3DCH2OH
122741.4820 0.0300 -4.0931 3 223.0975 55 -47517 30327 423 27 324 a-a-CH3DCH2OH
122812.9260 0.0300 -4.4296 3 65.0242 31 -47517 30315 114 15 015 a-a-CH3DCH2OH
123331.4824 1.0894 -6.4834 3 657.7299 95 47517 30347 542 46 839 a-a-CH3DCH2OH
123448.7570 0.0300 -4.4274 3 49.6105 27 -47517 30313 212 13 113 a-a-CH3DCH2OH
123471.1950 0.0300 -4.2735 3 39.8825 23 -47517 30311 3 9 11 210 a-a-CH3DCH2OH
123808.6470 0.0300 -4.0611 3 138.6417 43 -47517 30321 417 21 318 a-a-CH3DCH2OH
124358.1573 0.0113 -6.6098 3 101.0792 35 47517 30317 513 18 216 a-a-CH3DCH2OH
124763.4093 0.0146 -4.8521 3 206.2614 51 47517 30325 620 24 717 a-a-CH3DCH2OH
125409.7413 0.0144 -4.8474 3 206.2608 51 47517 30325 619 24 718 a-a-CH3DCH2OH
125418.7220 0.0300 -4.5389 3 28.2161 21 -47517 30310 1 9 9 2 8 a-a-CH3DCH2OH
125570.1970 0.0298 -5.2498 3 125.7831 31 47517 30315 9 7 16 8 8 a-a-CH3DCH2OH
125570.1979 0.0298 -5.2498 3 125.7831 31 47517 30315 9 6 16 8 9 a-a-CH3DCH2OH
125735.7220 0.0300 -4.7300 3 79.7668 33 -47517 30316 313 15 412 a-a-CH3DCH2OH
125772.8603 0.7426 -6.2548 3 570.6065 89 47517 30344 440 43 737 a-a-CH3DCH2OH
126068.7590 0.0300 -4.2339 3 46.5341 25 -47517 30312 310 12 211 a-a-CH3DCH2OH
126500.4110 0.0300 -4.2862 3 11.6550 15 -47517 303 7 1 7 6 0 6 a-a-CH3DCH2OH
126987.3861 1.4183 -6.4466 3 609.2563 93 47517 30346 443 45 540 a-a-CH3DCH2OH
127169.8940 0.0300 -4.0967 3 174.1459 49 -47517 30324 321 24 222 a-a-CH3DCH2OH
127956.5220 0.0300 -4.0477 3 126.5330 41 -47517 30320 416 20 317 a-a-CH3DCH2OH
128113.1047 0.0245 -4.0845 3 239.0644 57 47517 30328 424 28 325 a-a-CH3DCH2OH
128790.1566 0.0404 -4.8975 3 261.5857 57 47517 30328 722 27 819 a-a-CH3DCH2OH
128953.4498 0.0404 -4.8964 3 261.5855 57 47517 30328 721 27 820 a-a-CH3DCH2OH
129210.7140 0.0300 -4.1972 3 53.7283 27 -47517 30313 311 13 212 a-a-CH3DCH2OH
129745.5856 0.0103 -5.3251 3 88.9517 25 47517 30312 8 5 13 7 6 a-a-CH3DCH2OH
129745.5886 0.0103 -5.3251 3 88.9517 25 47517 30312 8 4 13 7 7 a-a-CH3DCH2OH
130397.6840 0.0055 -4.6425 3 50.7393 27 47517 30313 211 12 310 a-a-CH3DCH2OH
131171.2483 0.0057 -4.7195 3 126.0634 41 47517 30320 417 19 514 a-a-CH3DCH2OH
131253.0203 0.8662 -6.2567 3 595.4563 91 47517 30345 441 44 738 a-a-CH3DCH2OH
131516.5464 0.0064 -4.3805 3 57.0755 29 47517 30314 213 14 114 a-a-CH3DCH2OH
132558.7280 0.0050 -4.0347 3 115.0055 39 47517 30319 415 19 316 a-a-CH3DCH2OH
132701.5386 0.2028 -5.8663 3 332.5608 69 47517 30334 332 33 429 a-a-CH3DCH2OH
132717.2180 0.0921 -4.9623 3 323.4852 63 47517 30331 824 30 921 a-a-CH3DCH2OH
132756.5069 0.0921 -4.9620 3 323.4852 63 47517 30331 823 30 922 a-a-CH3DCH2OH
132796.0958 0.0074 -4.1547 3 118.9055 41 47517 30320 218 20 119 a-a-CH3DCH2OH
132875.3693 0.0059 -4.7260 3 98.4516 37 47517 30318 316 17 413 a-a-CH3DCH2OH
132928.6906 0.0033 -4.1631 3 61.4624 29 47517 30314 312 14 213 a-a-CH3DCH2OH
133240.0960 0.0192 -6.5459 3 178.3879 47 47517 30323 618 24 321 a-a-CH3DCH2OH
133297.3130 2.2981 -6.6487 3 784.8342105 47517 30352 448 51 745 a-a-CH3DCH2OH
133420.5915 0.0037 -4.6193 3 4.2457 9 47517 303 4 2 3 3 1 2 a-a-CH3DCH2OH
133878.4741 0.0086 -5.5184 3 58.7101 19 47517 303 9 7 3 10 6 4 a-a-CH3DCH2OH
133878.4833 0.0086 -5.5184 3 58.7101 19 47517 303 9 7 2 10 6 5 a-a-CH3DCH2OH
134943.2130 0.0085 -4.3692 3 73.5473 33 47517 30316 115 16 016 a-a-CH3DCH2OH
135173.2472 1.0096 -6.2763 3 620.8634 93 47517 30346 442 45 739 a-a-CH3DCH2OH
135245.3889 0.0336 -4.0724 3 255.5501 59 47517 30329 425 29 326 a-a-CH3DCH2OH
136005.5186 2.0317 -6.5636 3 756.1498103 47517 30351 447 50 744 a-a-CH3DCH2OH
136628.2033 0.1822 -5.0448 3 391.9542 69 47517 30334 926 331023 a-a-CH3DCH2OH
136637.3178 0.1822 -5.0447 3 391.9542 69 47517 30334 925 331024 a-a-CH3DCH2OH
137244.1935 0.0035 -4.1311 3 69.7343 31 47517 30315 313 15 214 a-a-CH3DCH2OH
137323.1448 0.0050 -4.0233 3 104.0649 37 47517 30318 414 18 315 a-a-CH3DCH2OH
137648.1875 0.0027 -4.1105 3 20.1746 19 47517 303 9 0 9 8 1 8 a-a-CH3DCH2OH
137667.8780 1.1732 -6.3110 3 646.8248 95 47517 30347 443 46 740 a-a-CH3DCH2OH
137878.3298 1.1864 -6.3994 3 684.2775 97 47517 30348 543 47 840 a-a-CH3DCH2OH
137915.0849 1.7862 -6.4862 3 728.0033101 47517 30350 446 49 743 a-a-CH3DCH2OH
137954.9250 0.0084 -6.0659 3 35.0602 13 47517 303 6 6 1 7 5 2 a-a-CH3DCH2OH
137954.9457 0.0084 -6.0659 3 35.0602 13 47517 303 6 6 0 7 5 3 a-a-CH3DCH2OH
137954.9594 0.0069 -4.7098 3 169.8947 47 47517 30323 519 22 616 a-a-CH3DCH2OH
138285.6620 0.0734 -5.1768 3 158.5520 35 47517 3031710 8 18 9 9 a-a-CH3DCH2OH
138285.6621 0.0734 -5.1768 3 158.5520 35 47517 3031710 7 18 910 a-a-CH3DCH2OH
138504.6694 0.0124 -4.0617 3 188.1308 51 47517 30325 322 25 223 a-a-CH3DCH2OH
138870.1369 1.3570 -6.3586 3 673.3375 97 47517 30348 444 47 741 a-a-CH3DCH2OH
138910.4190 1.5613 -6.4175 3 700.3981 99 47517 30349 445 48 742 a-a-CH3DCH2OH
139377.9824 1.2816 -6.2925 3 583.7047 91 47517 30345 442 44 539 a-a-CH3DCH2OH
140004.4226 0.0073 -4.3373 3 65.0642 31 47517 30315 214 15 115 a-a-CH3DCH2OH
140172.8535 0.0032 -4.1335 3 15.4990 17 47517 303 8 1 8 7 0 7 a-a-CH3DCH2OH
140869.0357 0.0036 -4.6405 3 4.0180 9 47517 303 4 2 2 3 1 3 a-a-CH3DCH2OH
141584.1007 0.0061 -4.6855 3 169.8899 47 47517 30323 518 22 617 a-a-CH3DCH2OH
141980.3367 0.0049 -4.0144 3 93.7157 35 47517 30317 413 17 314 a-a-CH3DCH2OH
142168.0097 0.0038 -4.1010 3 78.5414 33 47517 30316 314 16 215 a-a-CH3DCH2OH
142477.7018 0.0292 -5.2184 3 116.8149 29 47517 30314 9 6 15 8 7 a-a-CH3DCH2OH
142477.7021 0.0292 -5.2184 3 116.8149 29 47517 30314 9 5 15 8 8 a-a-CH3DCH2OH
142601.3043 0.0176 -4.7401 3 220.3159 53 47517 30326 621 25 718 a-a-CH3DCH2OH
142603.9438 0.0057 -4.6366 3 126.0444 41 47517 30320 416 19 515 a-a-CH3DCH2OH
143617.7962 0.0176 -4.7337 3 220.3148 53 47517 30326 620 25 719 a-a-CH3DCH2OH
143893.3941 0.1629 -5.7148 3 313.6133 67 47517 30333 331 32 428 a-a-CH3DCH2OH
144083.1528 0.0462 -4.0576 3 272.5483 61 47517 30330 426 30 327 a-a-CH3DCH2OH
144168.2668 0.0500 -4.0671 3 313.6133 65 47517 30332 527 32 428 a-a-CH3DCH2OH
144581.0679 0.0408 -4.0463 3 295.2081 63 47517 30331 526 31 427 a-a-CH3DCH2OH
145491.8594 0.1276 -6.5685 3 277.3544 59 47517 30329 723 30 426 a-a-CH3DCH2OH
145503.3792 0.0644 -4.0838 3 332.5608 67 47517 30333 528 33 429 a-a-CH3DCH2OH
145610.4579 0.0093 -4.1067 3 130.4031 43 47517 30321 219 21 120 a-a-CH3DCH2OH
145765.6764 0.0066 -4.6622 3 108.6455 39 47517 30319 317 18 414 a-a-CH3DCH2OH
146305.3583 0.0047 -4.0091 3 83.9608 33 47517 30316 412 16 313 a-a-CH3DCH2OH
146577.9402 0.0344 -4.0218 3 277.3544 61 47517 30330 525 30 426 a-a-CH3DCH2OH
146590.3699 0.0466 -4.7946 3 277.3178 59 47517 30329 723 28 820 a-a-CH3DCH2OH
146633.1122 0.0109 -5.3451 3 81.6656 23 47517 30311 8 4 12 7 5 a-a-CH3DCH2OH
146633.1131 0.0109 -5.3451 3 81.6656 23 47517 30311 8 3 12 7 6 a-a-CH3DCH2OH
146636.7049 0.0042 -4.3281 3 33.7757 23 47517 30311 110 10 2 9 a-a-CH3DCH2OH
146853.6043 0.0468 -4.7930 3 277.3175 59 47517 30329 722 28 821 a-a-CH3DCH2OH
146984.1829 0.0096 -4.3160 3 82.5896 35 47517 30317 116 17 017 a-a-CH3DCH2OH
147699.9135 0.0042 -4.0728 3 87.8815 35 47517 30317 315 17 216 a-a-CH3DCH2OH
147742.3759 0.0064 -4.6167 3 137.3358 43 47517 30321 418 20 515 a-a-CH3DCH2OH
147912.1197 0.0038 -4.4803 3 6.5568 11 47517 303 5 2 4 4 1 3 a-a-CH3DCH2OH
148247.9047 0.0063 -4.5644 3 88.7706 35 47517 30317 314 16 413 a-a-CH3DCH2OH
148698.5867 0.0863 -4.0961 3 352.0411 69 47517 30334 529 34 430 a-a-CH3DCH2OH
148862.6657 0.0083 -4.2977 3 73.5758 33 47517 30316 215 16 116 a-a-CH3DCH2OH
149944.6470 0.0293 -3.9946 3 260.0614 59 47517 30329 524 29 425 a-a-CH3DCH2OH
150134.7111 0.0044 -4.0086 3 74.8019 31 47517 30315 411 15 312 a-a-CH3DCH2OH
150235.7764 1.3196 -6.3471 3 711.3913 99 47517 30349 544 48 841 a-a-CH3DCH2OH
150429.6953 0.1027 -4.8682 3 340.8938 65 47517 30332 825 31 922 a-a-CH3DCH2OH
150494.2680 0.1028 -4.8679 3 340.8937 65 47517 30332 824 31 923 a-a-CH3DCH2OH
150740.4349 0.0093 -5.6592 3 53.1064 17 47517 303 8 7 2 9 6 3 a-a-CH3DCH2OH
150740.4372 0.0093 -5.6592 3 53.1064 17 47517 303 8 7 1 9 6 4 a-a-CH3DCH2OH
150885.4403 0.0173 -4.0279 3 202.6239 53 47517 30326 323 26 224 a-a-CH3DCH2OH
152265.1349 1.1498 -6.1407 3 558.6528 89 47517 30344 441 43 538 a-a-CH3DCH2OH
153374.9166 0.0040 -4.0136 3 66.2383 29 47517 30314 410 14 311 a-a-CH3DCH2OH
153439.4881 0.0057 -4.4518 3 58.0383 29 47517 30314 212 13 311 a-a-CH3DCH2OH
153812.8643 0.1172 -4.1041 3 372.0452 71 47517 30335 530 35 431 a-a-CH3DCH2OH
153828.8264 0.0048 -4.0463 3 97.7527 37 47517 30318 316 18 217 a-a-CH3DCH2OH
153938.0563 0.0033 -3.9955 3 19.8709 19 47517 303 9 1 9 8 0 8 a-a-CH3DCH2OH
154251.3810 0.1988 -4.9592 3 411.0377 71 47517 30335 927 341024 a-a-CH3DCH2OH
154266.5968 0.1988 -4.9591 3 411.0377 71 47517 30335 926 341025 a-a-CH3DCH2OH
154418.0111 0.1281 -5.5683 3 295.2081 65 47517 30332 330 31 427 a-a-CH3DCH2OH
154420.8224 0.0246 -3.9654 3 243.3378 57 47517 30328 523 28 424 a-a-CH3DCH2OH
154506.9557 0.0623 -4.0411 3 290.0543 63 47517 30331 427 31 328 a-a-CH3DCH2OH
155161.3421 0.0029 -3.9497 3 25.0057 21 47517 30310 010 9 1 9 a-a-CH3DCH2OH
155187.3062 0.0718 -5.1401 3 148.4638 33 47517 3031610 6 17 9 9 a-a-CH3DCH2OH
155187.3062 0.0718 -5.1401 3 148.4638 33 47517 3031610 7 17 9 8 a-a-CH3DCH2OH
155587.3126 0.0084 -4.6081 3 182.8402 49 47517 30324 520 23 617 a-a-CH3DCH2OH
156000.5239 0.0037 -4.0249 3 58.2679 27 47517 30313 4 9 13 310 a-a-CH3DCH2OH
157390.5276 0.0075 -4.6224 3 119.4272 41 47517 30320 318 19 415 a-a-CH3DCH2OH
158041.0091 0.0094 -4.2618 3 82.6098 35 47517 30317 216 17 117 a-a-CH3DCH2OH
158042.1775 0.0034 -4.0432 3 50.8872 25 47517 30312 4 8 12 3 9 a-a-CH3DCH2OH
158650.7551 0.0118 -4.0634 3 142.4152 45 47517 30322 220 22 121 a-a-CH3DCH2OH
158857.2503 0.0107 -4.2697 3 92.1515 37 47517 30318 117 18 018 a-a-CH3DCH2OH
159288.1311 0.0149 -6.5067 3 164.5766 45 47517 30322 617 23 320 a-a-CH3DCH2OH
159364.2997 0.0288 -5.2199 3 108.4084 27 47517 30313 9 4 14 8 7 a-a-CH3DCH2OH
159364.2997 0.0288 -5.2199 3 108.4084 27 47517 30313 9 5 14 8 6 a-a-CH3DCH2OH
159568.4965 0.0033 -4.0690 3 44.0918 23 47517 30311 4 7 11 3 8 a-a-CH3DCH2OH
159710.0160 0.0202 -3.9354 3 227.1917 55 47517 30327 522 27 423 a-a-CH3DCH2OH
160501.0772 1.4938 -6.3206 3 739.0694101 47517 30350 545 49 842 a-a-CH3DCH2OH
160512.1652 0.0215 -4.6446 3 234.9378 55 47517 30327 622 26 719 a-a-CH3DCH2OH
160533.4131 0.0059 -4.0216 3 108.1529 39 47517 30319 317 19 218 a-a-CH3DCH2OH
160666.9953 0.0033 -4.1032 3 37.8772 21 47517 30310 4 6 10 3 7 a-a-CH3DCH2OH
160723.6214 0.0037 -4.5254 3 6.1775 11 47517 303 5 2 3 4 1 4 a-a-CH3DCH2OH
160848.2744 0.1582 -4.1084 3 392.5651 73 47517 30336 531 36 432 a-a-CH3DCH2OH
160983.6682 0.0077 -4.5757 3 182.8323 49 47517 30324 519 23 618 a-a-CH3DCH2OH
161428.3232 0.0034 -4.1471 3 32.2389 19 47517 303 9 4 5 9 3 6 a-a-CH3DCH2OH
161845.8138 0.0040 -4.3543 3 9.4428 13 47517 303 6 2 5 5 1 4 a-a-CH3DCH2OH
161935.7766 0.0036 -4.2030 3 27.1731 17 47517 303 8 4 4 8 3 5 a-a-CH3DCH2OH
162078.4833 0.0217 -4.6357 3 234.9358 55 47517 30327 621 26 720 a-a-CH3DCH2OH
162174.6031 0.0031 -4.0577 3 44.0010 23 47517 30311 4 8 11 3 9 a-a-CH3DCH2OH
162195.2440 0.0032 -4.0966 3 37.8244 21 47517 30310 4 7 10 3 8 a-a-CH3DCH2OH
162245.9449 0.0032 -4.0251 3 50.7393 25 47517 30312 4 9 12 310 a-a-CH3DCH2OH
162259.9095 0.0039 -4.2752 3 22.6765 15 47517 303 7 4 3 7 3 4 a-a-CH3DCH2OH
162268.0962 0.0033 -4.1435 3 32.2102 19 47517 303 9 4 6 9 3 7 a-a-CH3DCH2OH
162362.3383 0.0036 -4.2011 3 27.1586 17 47517 303 8 4 5 8 3 6 a-a-CH3DCH2OH
162456.1698 0.0039 -4.2743 3 22.6699 15 47517 303 7 4 4 7 3 5 a-a-CH3DCH2OH
162456.9582 0.0042 -4.3724 3 18.7464 13 47517 303 6 4 2 6 3 3 a-a-CH3DCH2OH
162457.1979 0.0033 -3.9974 3 58.0383 27 47517 30313 410 13 311 a-a-CH3DCH2OH
162536.1912 0.0042 -4.3721 3 18.7437 13 47517 303 6 4 3 6 3 4 a-a-CH3DCH2OH
162569.6074 0.0046 -4.5156 3 15.3808 11 47517 303 5 4 1 5 3 2 a-a-CH3DCH2OH
162596.2021 0.0046 -4.5155 3 15.3799 11 47517 303 5 4 2 5 3 3 a-a-CH3DCH2OH
162628.9073 0.0049 -4.7749 3 12.5780 9 47517 303 4 4 0 4 3 1 a-a-CH3DCH2OH
162635.5899 0.0049 -4.7748 3 12.5778 9 47517 303 4 4 1 4 3 2 a-a-CH3DCH2OH
162862.9899 0.0035 -3.9737 3 65.8965 29 47517 30314 411 14 312 a-a-CH3DCH2OH
163499.6178 0.0117 -5.4208 3 74.9411 21 47517 30310 8 3 11 7 4 a-a-CH3DCH2OH
163499.6181 0.0117 -5.4208 3 74.9411 21 47517 30310 8 2 11 7 5 a-a-CH3DCH2OH
163522.6502 0.0038 -3.9532 3 74.3122 31 47517 30315 412 15 313 a-a-CH3DCH2OH
163876.7654 0.0075 -4.5327 3 149.1830 45 47517 30322 419 21 516 a-a-CH3DCH2OH
163890.8101 0.0060 -4.5103 3 137.3048 43 47517 30321 417 20 516 a-a-CH3DCH2OH
164014.0295 0.0986 -5.4272 3 277.3544 63 47517 30331 329 30 426 a-a-CH3DCH2OH
164055.4232 0.0240 -3.9961 3 217.6252 55 47517 30327 324 27 225 a-a-CH3DCH2OH
164485.2482 0.0539 -4.7069 3 293.6161 61 47517 30330 724 29 821 a-a-CH3DCH2OH
164497.8448 0.0040 -3.9354 3 83.2836 33 47517 30316 413 16 314 a-a-CH3DCH2OH
164901.7110 0.0543 -4.7046 3 293.6156 61 47517 30330 723 29 822 a-a-CH3DCH2OH
165482.0706 1.0222 -5.9911 3 534.1064 87 47517 30343 440 42 537 a-a-CH3DCH2OH
165496.2857 0.0162 -3.9054 3 211.6305 53 47517 30326 521 26 422 a-a-CH3DCH2OH
165850.0380 0.0042 -3.9198 3 92.8083 35 47517 30317 414 17 315 a-a-CH3DCH2OH
166333.8217 0.0822 -4.0240 3 308.0650 65 47517 30332 428 32 329 a-a-CH3DCH2OH
166538.4077 0.0046 -4.3095 3 4.7818 7 47517 303 3 3 1 2 2 0 a-a-CH3DCH2OH
166581.1164 0.0046 -4.3093 3 4.7805 7 47517 303 3 3 0 2 2 1 a-a-CH3DCH2OH
167490.5109 0.0106 -4.2293 3 92.1658 37 47517 30318 217 18 118 a-a-CH3DCH2OH
167532.2337 0.0085 -4.6058 3 130.8011 43 47517 30321 319 20 416 a-a-CH3DCH2OH
167582.3802 0.0100 -5.9830 3 48.0639 15 47517 303 7 7 1 8 6 2 a-a-CH3DCH2OH
167582.3807 0.0100 -5.9830 3 48.0639 15 47517 303 7 7 0 8 6 3 a-a-CH3DCH2OH
167637.9622 0.0044 -3.9060 3 102.8838 37 47517 30318 415 18 316 a-a-CH3DCH2OH
167783.1211 0.0073 -3.9987 3 119.0805 41 47517 30320 318 20 219 a-a-CH3DCH2OH
167797.3034 0.0043 -4.1426 3 39.8825 25 47517 30312 111 11 210 a-a-CH3DCH2OH
167888.1182 0.0034 -3.8705 3 24.7661 21 47517 30310 110 9 0 9 a-a-CH3DCH2OH
168230.1327 0.1149 -4.7883 3 358.8675 67 47517 30333 826 32 923 a-a-CH3DCH2OH
168334.4259 0.1151 -4.7878 3 358.8674 67 47517 30333 825 32 924 a-a-CH3DCH2OH
168794.9185 1.7105 -6.3156 3 767.3095103 47517 30351 546 50 843 a-a-CH3DCH2OH
169744.7274 0.2094 -4.1097 3 413.5939 75 47517 30337 532 37 433 a-a-CH3DCH2OH
169915.2549 0.0046 -3.8936 3 113.5077 39 47517 30319 416 19 317 a-a-CH3DCH2OH
170525.6021 0.0119 -4.2299 3 102.2333 39 47517 30319 118 19 019 a-a-CH3DCH2OH
170665.9742 0.1608 -4.1509 3 463.5815 79 47517 30339 633 39 534 a-a-CH3DCH2OH
171323.3550 0.1979 -4.1818 3 486.5616 81 47517 30340 634 40 535 a-a-CH3DCH2OH
171465.8065 0.0127 -3.8764 3 196.6605 51 47517 30325 520 25 421 a-a-CH3DCH2OH
171615.1330 0.0067 -4.4164 3 98.3404 37 47517 30318 315 17 414 a-a-CH3DCH2OH
171717.9648 0.0149 -4.0251 3 154.9426 47 47517 30323 221 23 122 a-a-CH3DCH2OH
171877.6940 0.1438 -4.1161 3 441.1430 77 47517 30338 632 38 533 a-a-CH3DCH2OH
171949.9392 0.2175 -4.8869 3 430.6853 73 47517 30336 928 351025 a-a-CH3DCH2OH
171974.9286 0.2176 -4.8868 3 430.6853 73 47517 30336 927 351026 a-a-CH3DCH2OH
172070.8126 0.0706 -5.1293 3 138.9371 31 47517 3031510 5 16 9 8 a-a-CH3DCH2OH
172070.8126 0.0706 -5.1293 3 138.9371 31 47517 3031510 6 16 9 7 a-a-CH3DCH2OH
172336.3764 0.0030 -3.8113 3 30.3662 23 47517 30311 011 10 110 a-a-CH3DCH2OH
172431.5208 0.0741 -5.2920 3 260.0614 61 47517 30330 328 29 425 a-a-CH3DCH2OH
172728.3814 0.0049 -3.8825 3 124.6772 41 47517 30320 417 20 318 a-a-CH3DCH2OH
173131.2621 0.0108 -4.5217 3 196.3562 51 47517 30325 521 24 618 a-a-CH3DCH2OH
173974.6627 0.2622 -4.2085 3 510.0731 83 47517 30341 635 41 536 a-a-CH3DCH2OH
174777.1948 0.1365 -4.0779 3 419.2560 75 47517 30337 631 37 532 a-a-CH3DCH2OH
175242.3231 0.0042 -4.2392 3 12.9015 15 47517 303 7 2 6 6 1 5 a-a-CH3DCH2OH
175252.1138 1.9691 -6.3286 3 796.1092105 47517 30352 547 51 844 a-a-CH3DCH2OH
175539.6265 0.0092 -3.9777 3 130.5341 43 47517 30321 319 21 220 a-a-CH3DCH2OH
175983.8603 0.0096 -4.6117 3 142.7716 45 47517 30322 320 21 417 a-a-CH3DCH2OH
176114.9239 0.0055 -3.8725 3 136.3894 43 47517 30321 418 21 319 a-a-CH3DCH2OH
176232.4228 0.0288 -5.2603 3 100.5633 25 47517 30312 9 3 13 8 6 a-a-CH3DCH2OH
176232.4228 0.0288 -5.2603 3 100.5633 25 47517 30312 9 4 13 8 5 a-a-CH3DCH2OH
176848.2287 0.0059 -4.2809 3 65.8965 31 47517 30315 213 14 312 a-a-CH3DCH2OH
177165.1097 0.0118 -4.2001 3 102.2433 39 47517 30319 218 19 119 a-a-CH3DCH2OH
177330.3858 0.0099 -3.8493 3 182.2870 49 47517 30324 519 24 420 a-a-CH3DCH2OH
177744.8964 0.0324 -3.9670 3 233.1355 57 47517 30328 325 28 226 a-a-CH3DCH2OH
178479.4003 0.0263 -4.5628 3 250.1278 57 47517 30328 623 27 720 a-a-CH3DCH2OH
178686.7344 0.3554 -4.2311 3 534.1064 85 47517 30342 636 42 537 a-a-CH3DCH2OH
178815.0736 0.8987 -5.8435 3 510.0731 85 47517 30342 439 41 536 a-a-CH3DCH2OH
179129.0527 0.1310 -4.0371 3 397.9304 73 47517 30336 630 36 531 a-a-CH3DCH2OH
179326.0595 0.1055 -4.0071 3 326.5791 67 47517 30333 429 33 330 a-a-CH3DCH2OH
179428.8758 0.0091 -4.4658 3 161.6075 47 47517 30323 420 22 517 a-a-CH3DCH2OH
179438.3024 0.0544 -5.1637 3 243.3378 59 47517 30329 327 28 424 a-a-CH3DCH2OH
180014.6005 2.2680 -6.3571 3 825.4657107 47517 30353 548 52 845 a-a-CH3DCH2OH
180102.2878 0.0067 -3.8635 3 148.6417 45 47517 30322 419 22 320 a-a-CH3DCH2OH
180348.0505 0.0126 -5.5827 3 68.7779 19 47517 303 9 8 2 10 7 3 a-a-CH3DCH2OH
180348.0506 0.0126 -5.5827 3 68.7779 19 47517 303 9 8 1 10 7 4 a-a-CH3DCH2OH
180376.0364 0.2702 -4.1089 3 435.1263 77 47517 30338 533 38 434 a-a-CH3DCH2OH
180846.6038 0.0271 -4.5505 3 250.1246 57 47517 30328 622 27 721 a-a-CH3DCH2OH
180981.0580 0.0104 -4.4788 3 196.3431 51 47517 30325 520 24 619 a-a-CH3DCH2OH
181726.5267 0.0039 -4.4348 3 8.8744 13 47517 303 6 2 4 5 1 5 a-a-CH3DCH2OH
181983.5700 0.0131 -4.1958 3 112.8352 41 47517 30320 119 20 020 a-a-CH3DCH2OH
182076.0274 0.0034 -3.7571 3 30.1813 23 47517 30311 111 10 010 a-a-CH3DCH2OH
182474.4763 0.0625 -4.6316 3 310.4811 63 47517 30331 725 30 822 a-a-CH3DCH2OH
182566.4684 0.0110 -4.6390 3 155.3417 47 47517 30323 321 22 418 a-a-CH3DCH2OH
182849.1245 0.0079 -3.8250 3 168.5135 47 47517 30323 518 23 419 a-a-CH3DCH2OH
183121.7700 0.0633 -4.6284 3 310.4804 63 47517 30331 724 30 823 a-a-CH3DCH2OH
183226.5557 2.6052 -6.3988 3 855.3760109 47517 30354 549 53 846 a-a-CH3DCH2OH
183226.8535 0.0046 -4.2148 3 6.4660 9 47517 303 4 3 2 3 2 1 a-a-CH3DCH2OH
183441.9175 0.0046 -4.2142 3 6.4591 9 47517 303 4 3 1 3 2 2 a-a-CH3DCH2OH
183758.6046 0.0116 -3.9587 3 142.5122 45 47517 30322 320 22 221 a-a-CH3DCH2OH
184649.9757 0.1234 -3.9946 3 377.1759 71 47517 30335 629 35 530 a-a-CH3DCH2OH
184659.9463 0.0185 -3.9921 3 167.9863 49 47517 30324 222 24 123 a-a-CH3DCH2OH
184706.8524 0.0086 -3.8553 3 161.4315 47 47517 30323 420 23 321 a-a-CH3DCH2OH
184825.1441 0.0393 -5.0438 3 227.1917 57 47517 30328 326 27 423 a-a-CH3DCH2OH
185465.7114 0.4766 -4.2498 3 558.6528 87 47517 30343 637 43 538 a-a-CH3DCH2OH
186118.0527 0.0066 -4.3972 3 149.1335 45 47517 30322 418 21 517 a-a-CH3DCH2OH
186122.7617 0.1288 -4.7202 3 377.4068 69 47517 30334 827 33 924 a-a-CH3DCH2OH
186288.4465 0.1293 -4.7194 3 377.4066 69 47517 30334 826 33 925 a-a-CH3DCH2OH
187022.7881 0.0129 -4.1743 3 112.8421 41 47517 30320 219 20 120 a-a-CH3DCH2OH
187145.9654 0.0128 -4.6868 3 168.5135 49 47517 30324 322 23 419 a-a-CH3DCH2OH
187844.4450 0.0065 -3.8043 3 155.3417 45 47517 30322 517 22 418 a-a-CH3DCH2OH
188133.6495 0.0044 -4.1330 3 16.9304 17 47517 303 8 2 7 7 1 6 a-a-CH3DCH2OH
188411.3384 0.0281 -4.9340 3 211.6305 55 47517 30327 325 26 422 a-a-CH3DCH2OH
188762.9513 0.0042 -3.9783 3 46.5341 27 47517 30313 112 12 211 a-a-CH3DCH2OH
188938.0935 0.0697 -5.1478 3 129.9717 29 47517 3031410 4 15 9 7 a-a-CH3DCH2OH
188938.0935 0.0697 -5.1478 3 129.9717 29 47517 3031410 5 15 9 6 a-a-CH3DCH2OH
189195.2686 0.0031 -3.6910 3 36.2547 25 47517 30312 012 11 111 a-a-CH3DCH2OH
189645.6699 0.0156 -4.7532 3 182.2870 51 47517 30325 323 24 420 a-a-CH3DCH2OH
189728.4565 0.2386 -4.8257 3 450.8974 75 47517 30337 929 361026 a-a-CH3DCH2OH
189768.8653 0.2388 -4.8255 3 450.8973 75 47517 30337 928 361027 a-a-CH3DCH2OH
189933.5807 0.0113 -3.8480 3 174.7560 49 47517 30324 421 24 322 a-a-CH3DCH2OH
190051.7658 0.0205 -4.8364 3 196.6605 53 47517 30326 324 25 421 a-a-CH3DCH2OH
190514.9990 0.0141 -4.4488 3 210.4440 53 47517 30326 522 25 619 a-a-CH3DCH2OH
191021.0237 0.1129 -3.9511 3 357.0011 69 47517 30334 628 34 529 a-a-CH3DCH2OH
191695.2873 0.0425 -3.9412 3 249.1559 59 47517 30329 326 29 227 a-a-CH3DCH2OH
192014.6212 0.7803 -5.6980 3 486.5616 83 47517 30341 438 40 535 a-a-CH3DCH2OH
192209.3828 0.0056 -3.7878 3 142.7716 43 47517 30321 516 21 417 a-a-CH3DCH2OH
192391.7037 0.0146 -3.9417 3 155.0140 47 47517 30323 321 23 222 a-a-CH3DCH2OH
192550.7933 0.3393 -4.1068 3 457.1587 79 47517 30339 534 39 435 a-a-CH3DCH2OH
193084.3558 0.0290 -5.3532 3 93.2795 23 47517 30311 9 2 12 8 5 a-a-CH3DCH2OH
193084.3558 0.0290 -5.3532 3 93.2795 23 47517 30311 9 3 12 8 4 a-a-CH3DCH2OH
193207.9628 0.1318 -3.9913 3 345.5963 69 47517 30334 430 34 331 a-a-CH3DCH2OH
193245.1346 0.0141 -4.1670 3 123.9571 43 47517 30321 120 21 021 a-a-CH3DCH2OH
194230.4216 0.0115 -4.4152 3 174.6127 49 47517 30324 421 23 518 a-a-CH3DCH2OH
194253.0751 0.6231 -4.2654 3 583.7047 89 47517 30344 638 44 539 a-a-CH3DCH2OH
195759.8582 0.0070 -4.2818 3 108.4757 39 47517 30319 316 18 415 a-a-CH3DCH2OH
195776.0958 0.0149 -3.8417 3 188.6129 51 47517 30325 422 25 323 a-a-CH3DCH2OH
195904.7817 0.0050 -3.7758 3 130.8011 41 47517 30320 515 20 416 a-a-CH3DCH2OH
196313.4135 3.3305 -6.2741 3 782.7603105 47517 30352 548 51 645 a-a-CH3DCH2OH
196478.1409 0.0321 -4.4925 3 265.8870 59 47517 30329 624 28 721 a-a-CH3DCH2OH
196517.4133 0.0033 -3.6542 3 36.1147 25 47517 30312 112 11 011 a-a-CH3DCH2OH
196794.4571 0.4693 -4.3750 3 669.5516 95 47517 30347 740 47 641 a-a-CH3DCH2OH
196936.3825 0.4059 -4.3312 3 642.5511 93 47517 30346 739 46 640 a-a-CH3DCH2OH
197026.3075 0.0139 -4.1516 3 123.9620 43 47517 30321 220 21 121 a-a-CH3DCH2OH
197181.1436 0.0134 -5.9253 3 63.1758 17 47517 303 8 8 0 9 7 3 a-a-CH3DCH2OH
197181.1436 0.0134 -5.9253 3 63.1758 17 47517 303 8 8 1 9 7 2 a-a-CH3DCH2OH
197376.1762 0.0227 -3.9644 3 181.5470 51 47517 30325 223 25 124 a-a-CH3DCH2OH
197906.0019 0.1002 -3.9077 3 337.4142 67 47517 30333 627 33 528 a-a-CH3DCH2OH
198754.2758 0.6112 -4.4149 3 697.0825 97 47517 30348 741 48 642 a-a-CH3DCH2OH
198947.6607 0.0047 -3.7687 3 119.4272 39 47517 30319 514 19 415 a-a-CH3DCH2OH
199038.5132 0.3971 -4.2837 3 616.0918 91 47517 30345 738 45 639 a-a-CH3DCH2OH
199752.7199 0.0046 -4.1232 3 8.7169 11 47517 303 5 3 3 4 2 2 a-a-CH3DCH2OH
199989.9889 0.0341 -4.4759 3 265.8816 59 47517 30329 623 28 722 a-a-CH3DCH2OH
200401.8807 0.0046 -4.1219 3 8.6961 11 47517 303 5 3 2 4 2 3 a-a-CH3DCH2OH
200497.0467 0.0059 -4.1260 3 74.3122 33 47517 30316 214 15 313 a-a-CH3DCH2OH
200554.6338 0.0725 -4.5670 3 327.9135 65 47517 30332 726 31 823 a-a-CH3DCH2OH
200566.2142 0.0046 -4.0338 3 21.5259 19 47517 303 9 2 8 8 1 7 a-a-CH3DCH2OH
201388.5781 0.0180 -3.9269 3 168.0384 49 47517 30324 322 24 223 a-a-CH3DCH2OH
201394.3944 0.0045 -3.7664 3 108.6455 37 47517 30318 513 18 414 a-a-CH3DCH2OH
201543.8486 0.0741 -4.5625 3 327.9122 65 47517 30332 725 31 824 a-a-CH3DCH2OH
201693.6037 0.0146 -4.3925 3 210.4231 53 47517 30326 521 25 620 a-a-CH3DCH2OH
202217.2173 0.0197 -3.8363 3 203.0000 53 47517 30326 423 26 324 a-a-CH3DCH2OH
202895.6829 0.8313 -4.4507 3 725.1337 99 47517 30349 742 49 643 a-a-CH3DCH2OH
202899.3824 0.4079 -4.2332 3 590.1843 89 47517 30344 737 44 638 a-a-CH3DCH2OH
203323.1762 0.0044 -3.7689 3 98.4516 35 47517 30317 512 17 413 a-a-CH3DCH2OH
204063.8539 0.0043 -4.3672 3 12.1073 15 47517 303 7 2 5 6 1 6 a-a-CH3DCH2OH
204111.0315 0.1447 -4.6619 3 396.5120 71 47517 30335 828 34 925 a-a-CH3DCH2OH
204334.2581 0.0148 -4.1429 3 135.5993 45 47517 30322 121 22 022 a-a-CH3DCH2OH
204370.1373 0.1456 -4.6608 3 396.5117 71 47517 30335 827 34 926 a-a-CH3DCH2OH
204808.8752 0.6682 -5.5548 3 463.5815 81 47517 30340 437 39 534 a-a-CH3DCH2OH
204819.2734 0.0042 -3.7762 3 88.8411 33 47517 30316 511 16 412 a-a-CH3DCH2OH
204922.5001 0.7914 -4.2785 3 609.2563 91 47517 30345 639 45 540 a-a-CH3DCH2OH
204974.1788 0.0865 -3.8651 3 318.4223 65 47517 30332 626 32 527 a-a-CH3DCH2OH
205680.6870 0.0541 -3.9193 3 265.6876 61 47517 30330 327 30 228 a-a-CH3DCH2OH
205777.4124 0.0031 -3.5857 3 42.6699 27 47517 30313 013 12 112 a-a-CH3DCH2OH
205790.9576 0.0691 -5.2025 3 121.5674 27 47517 3031310 3 14 9 6 a-a-CH3DCH2OH
205790.9576 0.0691 -5.2025 3 121.5674 27 47517 3031310 4 14 9 5 a-a-CH3DCH2OH
205837.1942 0.0044 -3.7403 3 130.4388 41 47517 30320 516 20 417 a-a-CH3DCH2OH
205924.7701 0.0042 -3.7436 3 119.1755 39 47517 30319 515 19 416 a-a-CH3DCH2OH
205941.9500 0.0048 -3.7391 3 142.2640 43 47517 30321 517 21 418 a-a-CH3DCH2OH
205964.7209 0.0041 -3.7883 3 79.8098 31 47517 30315 510 15 411 a-a-CH3DCH2OH
206020.5261 0.4145 -4.1045 3 479.6895 81 47517 30340 535 40 436 a-a-CH3DCH2OH
206149.8146 0.0042 -3.7492 3 108.4757 37 47517 30318 514 18 415 a-a-CH3DCH2OH
206298.3760 0.0058 -3.7396 3 154.6493 45 47517 30322 518 22 419 a-a-CH3DCH2OH
206463.6073 0.0042 -3.7575 3 98.3404 35 47517 30317 513 17 414 a-a-CH3DCH2OH
206824.7457 0.0042 -3.7689 3 88.7706 33 47517 30316 512 16 413 a-a-CH3DCH2OH
206832.4363 0.0040 -3.8053 3 71.3543 29 47517 30314 5 9 14 410 a-a-CH3DCH2OH
206968.2355 0.0074 -3.7417 3 167.5926 47 47517 30323 519 23 420 a-a-CH3DCH2OH
207143.5345 0.0146 -4.1320 3 135.6027 45 47517 30322 221 22 122 a-a-CH3DCH2OH
207199.7686 0.0041 -3.7838 3 79.7668 31 47517 30315 511 15 412 a-a-CH3DCH2OH
207483.8075 0.0039 -3.8277 3 63.4715 27 47517 30313 5 8 13 4 9 a-a-CH3DCH2OH
207563.2280 0.0040 -3.8027 3 71.3290 29 47517 30314 510 14 411 a-a-CH3DCH2OH
207591.4899 0.2623 -4.7739 3 471.6741 77 47517 30338 930 371027 a-a-CH3DCH2OH
207648.7829 0.0184 -4.3881 3 225.1053 55 47517 30327 523 26 620 a-a-CH3DCH2OH
207655.8725 0.2627 -4.7737 3 471.6740 77 47517 30338 929 371028 a-a-CH3DCH2OH
207688.0750 0.1604 -3.9774 3 365.1175 71 47517 30335 431 35 332 a-a-CH3DCH2OH
207897.2669 0.0039 -3.8262 3 63.4573 27 47517 30313 5 9 13 410 a-a-CH3DCH2OH
207968.5694 0.0038 -3.8561 3 56.1589 25 47517 30312 5 7 12 4 8 a-a-CH3DCH2OH
208013.4276 0.0097 -3.7450 3 181.0915 49 47517 30324 520 24 421 a-a-CH3DCH2OH
208091.3799 0.0148 -4.3804 3 188.2021 51 47517 30325 422 24 519 a-a-CH3DCH2OH
208190.8068 0.0038 -3.8553 3 56.1513 25 47517 30312 5 8 12 4 9 a-a-CH3DCH2OH
208261.3214 0.4150 -4.1803 3 564.8393 87 47517 30343 736 43 637 a-a-CH3DCH2OH
208325.9484 0.0039 -3.8916 3 49.4144 23 47517 30311 5 6 11 4 7 a-a-CH3DCH2OH
208438.4751 0.0039 -3.8911 3 49.4106 23 47517 30311 5 7 11 4 8 a-a-CH3DCH2OH
208586.3476 0.0040 -3.9356 3 43.2365 21 47517 30310 5 5 10 4 6 a-a-CH3DCH2OH
208639.4088 0.0040 -3.9354 3 43.2347 21 47517 30310 5 6 10 4 7 a-a-CH3DCH2OH
208773.1203 0.0043 -3.9911 3 37.6236 19 47517 303 9 5 4 9 4 5 a-a-CH3DCH2OH
208796.0555 0.0043 -3.9911 3 37.6228 19 47517 303 9 5 5 9 4 6 a-a-CH3DCH2OH
208904.1862 0.0046 -4.0628 3 32.5747 17 47517 303 8 5 3 8 4 4 a-a-CH3DCH2OH
208913.0688 0.0046 -4.0628 3 32.5744 17 47517 303 8 5 4 8 4 5 a-a-CH3DCH2OH
208993.3794 0.0050 -4.1601 3 28.0889 15 47517 303 7 5 2 7 4 3 a-a-CH3DCH2OH
208996.3569 0.0050 -4.1601 3 28.0888 15 47517 303 7 5 3 7 4 4 a-a-CH3DCH2OH
209051.5016 0.0054 -4.3046 3 24.1654 13 47517 303 6 5 1 6 4 2 a-a-CH3DCH2OH
209052.3172 0.0054 -4.3046 3 24.1654 13 47517 303 6 5 2 6 4 3 a-a-CH3DCH2OH
209087.0939 0.0058 -4.5678 3 20.8035 11 47517 303 5 5 0 5 4 1 a-a-CH3DCH2OH
209087.2576 0.0058 -4.5678 3 20.8035 11 47517 303 5 5 1 5 4 2 a-a-CH3DCH2OH
209229.9361 0.0255 -3.8320 3 217.9152 55 47517 30327 424 27 325 a-a-CH3DCH2OH
209234.7808 1.1192 -4.4828 3 753.6957101 47517 30350 743 50 644 a-a-CH3DCH2OH
209338.3211 0.0076 -4.2943 3 161.5307 47 47517 30323 419 22 518 a-a-CH3DCH2OH
209399.5258 0.0041 -3.8326 3 53.7283 29 47517 30314 113 13 212 a-a-CH3DCH2OH
209493.6154 0.0127 -3.7494 3 195.1433 51 47517 30325 521 25 422 a-a-CH3DCH2OH
209813.9031 0.0275 -3.9418 3 195.6252 53 47517 30326 224 26 125 a-a-CH3DCH2OH
209922.2385 0.0293 -5.5302 3 86.5568 21 47517 30310 9 1 11 8 4 a-a-CH3DCH2OH
209922.2385 0.0293 -5.5302 3 86.5568 21 47517 30310 9 2 11 8 3 a-a-CH3DCH2OH
210698.8298 0.0221 -3.9143 3 181.5847 51 47517 30325 323 25 224 a-a-CH3DCH2OH
210713.1612 3.0725 -6.1301 3 753.6957103 47517 30351 547 50 644 a-a-CH3DCH2OH
211199.6788 0.0033 -3.5608 3 42.5656 27 47517 30313 113 12 012 a-a-CH3DCH2OH
211463.9243 0.0165 -3.7547 3 209.7452 53 47517 30326 522 26 423 a-a-CH3DCH2OH
211924.1250 0.0728 -3.8243 3 300.0308 63 47517 30331 625 31 526 a-a-CH3DCH2OH
212594.8840 0.0073 -6.2155 3 11.6550 13 47517 303 6 3 3 6 0 6 a-a-CH3DCH2OH
212603.9647 0.0047 -3.9403 3 26.6840 21 47517 30310 2 9 9 1 8 a-a-CH3DCH2OH
213972.8442 0.0211 -3.7607 3 224.8944 55 47517 30327 523 27 424 a-a-CH3DCH2OH
214473.4203 0.0391 -4.4325 3 282.2160 61 47517 30330 625 29 722 a-a-CH3DCH2OH
214818.7284 0.4097 -4.1258 3 540.0668 85 47517 30342 735 42 636 a-a-CH3DCH2OH
215177.6436 0.0069 -5.9205 3 15.4990 15 47517 303 7 3 4 7 0 7 a-a-CH3DCH2OH
215278.0760 0.0151 -4.1231 3 147.7617 47 47517 30323 122 23 023 a-a-CH3DCH2OH
216003.9094 0.0046 -4.0386 3 11.5386 13 47517 303 6 3 4 5 2 3 a-a-CH3DCH2OH
216778.7792 0.0328 -3.8289 3 233.3568 57 47517 30328 425 28 326 a-a-CH3DCH2OH
216916.9012 0.5638 -5.4143 3 441.1430 79 47517 30339 436 38 533 a-a-CH3DCH2OH
217060.4383 0.0268 -3.7674 3 240.5878 57 47517 30328 524 28 425 a-a-CH3DCH2OH
217280.6255 0.9761 -4.2900 3 635.3034 93 47517 30346 640 46 541 a-a-CH3DCH2OH
217347.4185 0.0149 -4.1153 3 147.7640 47 47517 30323 222 23 123 a-a-CH3DCH2OH
217524.3914 0.0045 -4.0362 3 11.4906 13 47517 303 6 3 3 5 2 4 a-a-CH3DCH2OH
217720.9654 1.4636 -4.5116 3 782.7603103 47517 30351 744 51 645 a-a-CH3DCH2OH
218504.9106 0.0600 -3.7859 3 282.2437 61 47517 30330 624 30 525 a-a-CH3DCH2OH
218718.1444 0.0841 -4.5116 3 345.9137 67 47517 30333 727 32 824 a-a-CH3DCH2OH
218916.5317 0.0066 -5.6868 3 19.8709 17 47517 303 8 3 5 8 0 8 a-a-CH3DCH2OH
219523.1085 0.0673 -3.9017 3 282.7318 63 47517 30331 328 31 229 a-a-CH3DCH2OH
219590.9915 0.0433 -4.4101 3 282.2075 61 47517 30330 624 29 723 a-a-CH3DCH2OH
220205.6602 0.0871 -4.5053 3 345.9116 67 47517 30333 726 32 825 a-a-CH3DCH2OH
220273.7277 0.0267 -3.9039 3 195.6524 53 47517 30326 324 26 225 a-a-CH3DCH2OH
220495.4702 0.4934 -4.1027 3 502.7182 83 47517 30341 536 41 437 a-a-CH3DCH2OH
220572.1913 0.0072 -4.1578 3 119.1755 41 47517 30320 317 19 416 a-a-CH3DCH2OH
220756.9360 0.0337 -3.7747 3 256.8225 59 47517 30329 525 29 426 a-a-CH3DCH2OH
220803.1765 0.0191 -4.3613 3 202.3800 53 47517 30326 423 25 520 a-a-CH3DCH2OH
221958.4753 0.0329 -3.9241 3 210.2215 55 47517 30327 225 27 126 a-a-CH3DCH2OH
222122.4411 0.9568 -4.6534 3 881.4030109 47517 30354 846 54 747 a-a-CH3DCH2OH
222128.8525 0.0032 -3.4927 3 49.6105 29 47517 30314 014 13 113 a-a-CH3DCH2OH
222197.1846 0.1628 -4.6123 3 416.1835 73 47517 30336 829 35 926 a-a-CH3DCH2OH
222232.3930 0.3908 -4.0707 3 515.8763 83 47517 30341 734 41 635 a-a-CH3DCH2OH
222483.4869 0.1907 -3.9661 3 385.1439 73 47517 30336 432 36 333 a-a-CH3DCH2OH
222596.3451 0.1645 -4.6107 3 416.1830 73 47517 30336 828 35 927 a-a-CH3DCH2OH
222631.1116 0.0687 -5.3078 3 113.7242 25 47517 3031210 2 13 9 5 a-a-CH3DCH2OH
222631.1116 0.0687 -5.3078 3 113.7242 25 47517 3031210 3 13 9 4 a-a-CH3DCH2OH
223204.9504 0.9035 -4.5974 3 850.3978107 47517 30353 845 53 746 a-a-CH3DCH2OH
223221.5843 1.1991 -4.7057 3 912.9382111 47517 30355 847 55 748 a-a-CH3DCH2OH
223241.4105 0.0207 -4.3148 3 225.0725 55 47517 30327 522 26 621 a-a-CH3DCH2OH
224030.9296 0.0064 -5.5031 3 24.7661 19 47517 303 9 3 6 9 0 9 a-a-CH3DCH2OH
224248.5684 0.0059 -3.9842 3 83.2836 35 47517 30317 215 16 314 a-a-CH3DCH2OH
224330.8315 0.0047 -3.8515 3 32.3996 23 47517 30311 210 10 1 9 a-a-CH3DCH2OH
224423.1429 0.0239 -4.3388 3 240.3422 57 47517 30328 524 27 621 a-a-CH3DCH2OH
224531.0506 0.0487 -3.7507 3 265.0630 59 47517 30329 623 29 524 a-a-CH3DCH2OH
224821.4888 0.0414 -3.8271 3 249.3232 59 47517 30329 426 29 327 a-a-CH3DCH2OH
225081.7581 0.0421 -3.7826 3 273.5955 61 47517 30330 526 30 427 a-a-CH3DCH2OH
225467.5379 2.8096 -5.9865 3 725.1337101 47517 30350 546 49 643 a-a-CH3DCH2OH
225543.4469 0.2890 -4.7303 3 493.0158 79 47517 30339 931 381028 a-a-CH3DCH2OH
225644.5853 0.2897 -4.7299 3 493.0157 79 47517 30339 930 381029 a-a-CH3DCH2OH
226093.5357 0.0033 -3.4760 3 49.5339 29 47517 30314 114 13 013 a-a-CH3DCH2OH
226102.7959 0.0151 -4.1070 3 160.4444 49 47517 30324 123 24 024 a-a-CH3DCH2OH
226306.6750 0.9574 -4.5381 3 819.9340105 47517 30352 844 52 745 a-a-CH3DCH2OH
226600.4531 1.6342 -4.7541 3 944.9927113 47517 30356 848 56 749 a-a-CH3DCH2OH
226748.0681 0.0298 -5.8866 3 80.3949 19 47517 303 9 9 0 10 8 3 a-a-CH3DCH2OH
226748.0681 0.0298 -5.8866 3 80.3949 19 47517 303 9 9 1 10 8 2 a-a-CH3DCH2OH
227615.7024 0.0149 -4.1016 3 160.4459 49 47517 30324 223 24 124 a-a-CH3DCH2OH
227903.3510 0.0048 -4.3206 3 15.8746 17 47517 303 8 2 6 7 1 7 a-a-CH3DCH2OH
228059.8921 0.4684 -5.2771 3 419.2560 77 47517 30338 435 37 532 a-a-CH3DCH2OH
228234.3836 1.8527 -4.5378 3 812.3209105 47517 30352 745 52 646 a-a-CH3DCH2OH
229591.2737 0.0040 -3.7036 3 61.4624 31 47517 30315 114 14 213 a-a-CH3DCH2OH
229813.0337 0.0052 -3.8965 3 10.3370 9 47517 303 4 4 1 3 3 0 a-a-CH3DCH2OH
229814.0101 0.0052 -3.8965 3 10.3370 9 47517 303 4 4 0 3 3 1 a-a-CH3DCH2OH
229888.5378 0.0389 -3.7191 3 248.4888 57 47517 30328 622 28 523 a-a-CH3DCH2OH
230043.0021 0.0522 -3.7910 3 290.9042 63 47517 30331 527 31 428 a-a-CH3DCH2OH
230067.6035 0.0321 -3.8958 3 210.2410 55 47517 30327 325 27 226 a-a-CH3DCH2OH
230149.5077 0.3609 -4.0156 3 492.2763 81 47517 30340 733 40 634 a-a-CH3DCH2OH
230716.7271 0.0064 -5.3617 3 30.1813 21 47517 30310 3 7 10 010 a-a-CH3DCH2OH
231074.2938 1.1705 -4.3009 3 661.8437 95 47517 30347 641 47 542 a-a-CH3DCH2OH
231203.2198 1.0304 -4.4760 3 790.0227103 47517 30351 843 51 744 a-a-CH3DCH2OH
231851.0123 0.0047 -3.9623 3 14.9361 15 47517 303 7 3 5 6 2 4 a-a-CH3DCH2OH
232144.9888 0.0250 -4.3584 3 217.1509 55 47517 30327 424 26 521 a-a-CH3DCH2OH
232291.0269 2.2239 -4.7989 3 977.5563115 47517 30357 849 57 750 a-a-CH3DCH2OH
232418.2437 0.0473 -4.3817 3 299.1162 63 47517 30331 626 30 723 a-a-CH3DCH2OH
233099.1728 0.0821 -3.8886 3 300.2897 65 47517 30332 329 32 230 a-a-CH3DCH2OH
233310.9108 0.0517 -3.8267 3 265.8131 61 47517 30330 427 30 328 a-a-CH3DCH2OH
233558.2243 0.0095 -4.1995 3 174.4963 49 47517 30324 420 23 519 a-a-CH3DCH2OH
233821.4952 0.0390 -3.9109 3 225.3361 57 47517 30328 226 28 127 a-a-CH3DCH2OH
234531.2027 0.0308 -3.6915 3 232.5191 55 47517 30327 621 27 522 a-a-CH3DCH2OH
234892.1358 0.0045 -3.9586 3 14.8414 15 47517 303 7 3 4 6 2 5 a-a-CH3DCH2OH
235637.3976 0.0643 -3.8000 3 308.7457 65 47517 30332 528 32 429 a-a-CH3DCH2OH
235666.1792 0.5732 -4.1021 3 526.2455 85 47517 30342 537 42 438 a-a-CH3DCH2OH
235851.4263 0.0047 -3.7666 3 38.6670 25 47517 30312 211 11 110 a-a-CH3DCH2OH
236831.6389 0.0147 -4.0943 3 173.6471 51 47517 30325 124 25 025 a-a-CH3DCH2OH
236952.0331 0.0973 -4.4643 3 364.4825 69 47517 30334 728 33 825 a-a-CH3DCH2OH
237342.2191 0.2224 -3.9580 3 405.6770 75 47517 30337 433 37 334 a-a-CH3DCH2OH
237613.5771 1.0774 -4.4119 3 760.6750101 47517 30350 842 50 743 a-a-CH3DCH2OH
237930.4576 0.0146 -4.0906 3 173.6482 51 47517 30325 224 25 125 a-a-CH3DCH2OH
237969.9263 0.3829 -5.1439 3 397.9304 75 47517 30337 434 36 531 a-a-CH3DCH2OH
238227.2123 0.3241 -3.9614 3 469.2743 79 47517 30339 732 39 633 a-a-CH3DCH2OH
238294.8981 0.0032 -3.4101 3 57.0755 31 47517 30315 015 14 114 a-a-CH3DCH2OH
238469.0500 0.0241 -3.6680 3 217.1509 53 47517 30326 620 26 521 a-a-CH3DCH2OH
239146.6199 0.0067 -5.2564 3 36.1147 23 47517 30311 3 8 11 011 a-a-CH3DCH2OH
239154.3498 0.1029 -4.4557 3 364.4791 69 47517 30334 727 33 826 a-a-CH3DCH2OH
239460.1613 0.0685 -5.4961 3 106.4418 23 47517 3031110 1 12 9 4 a-a-CH3DCH2OH
239460.1613 0.0685 -5.4961 3 106.4418 23 47517 3031110 2 12 9 3 a-a-CH3DCH2OH
239746.9557 0.0553 -4.3518 3 299.1027 63 47517 30331 625 30 724 a-a-CH3DCH2OH
240038.8694 0.0383 -3.8900 3 225.3500 57 47517 30328 326 28 227 a-a-CH3DCH2OH
240256.9982 2.9323 -4.8403 3 1010.6201117 47517 30358 850 58 751 a-a-CH3DCH2OH
240344.6039 2.5428 -5.8435 3 697.0825 99 47517 30349 545 48 642 a-a-CH3DCH2OH
240381.7082 0.1833 -4.5702 3 436.4218 75 47517 30337 830 36 927 a-a-CH3DCH2OH
240586.4279 2.2725 -4.5620 3 842.3727107 47517 30353 746 53 647 a-a-CH3DCH2OH
240707.3671 0.0308 -4.3004 3 256.1570 59 47517 30329 525 28 622 a-a-CH3DCH2OH
240987.8372 0.1863 -4.5679 3 436.4210 75 47517 30337 829 36 928 a-a-CH3DCH2OH
241162.9955 0.0033 -3.3989 3 57.0199 31 47517 30315 115 14 014 a-a-CH3DCH2OH
241752.1018 0.0185 -3.6484 3 202.3800 51 47517 30325 619 25 520 a-a-CH3DCH2OH
241850.7238 0.0788 -3.8097 3 327.1176 67 47517 30333 529 33 430 a-a-CH3DCH2OH
241893.9073 0.0331 -4.3718 3 232.5191 57 47517 30328 425 27 522 a-a-CH3DCH2OH
242196.9696 0.0638 -3.8278 3 282.8253 63 47517 30331 428 31 329 a-a-CH3DCH2OH
243588.4045 0.3189 -4.6939 3 514.9228 81 47517 30340 932 391029 a-a-CH3DCH2OH
243745.1437 0.3202 -4.6933 3 514.9226 81 47517 30340 931 391030 a-a-CH3DCH2OH
244453.7331 0.0141 -3.6328 3 188.2021 49 47517 30324 618 24 519 a-a-CH3DCH2OH
245210.5523 1.0844 -4.3465 3 731.9016 99 47517 30349 841 49 742 a-a-CH3DCH2OH
245429.8092 0.0461 -3.9018 3 240.9692 59 47517 30329 227 29 128 a-a-CH3DCH2OH
245736.0315 0.0292 -4.2442 3 240.2919 57 47517 30328 523 27 622 a-a-CH3DCH2OH
245919.3605 0.0072 -4.0423 3 130.4388 43 47517 30321 318 20 417 a-a-CH3DCH2OH
246005.0664 1.3674 -4.3117 3 688.8767 97 47517 30348 642 48 543 a-a-CH3DCH2OH
246156.3724 0.2842 -3.9089 3 446.8762 77 47517 30338 731 38 632 a-a-CH3DCH2OH
246338.1297 0.0987 -3.8799 3 318.3621 67 47517 30333 330 33 231 a-a-CH3DCH2OH
246396.8638 0.3077 -5.0161 3 377.1759 73 47517 30336 433 35 530 a-a-CH3DCH2OH
246593.7774 0.0050 -3.8319 3 12.5780 11 47517 303 5 4 2 4 3 1 a-a-CH3DCH2OH
246600.6423 0.0050 -3.8319 3 12.5778 11 47517 303 5 4 1 4 3 2 a-a-CH3DCH2OH
246656.5366 0.0106 -3.6208 3 174.6127 47 47517 30323 617 23 518 a-a-CH3DCH2OH
247162.5328 0.0047 -3.8940 3 18.9142 17 47517 303 8 3 6 7 2 5 a-a-CH3DCH2OH
247288.5157 0.0300 -3.6852 3 45.4796 27 -47517 30313 212 12 111 a-a-CH3DCH2OH
247422.6630 0.0337 -3.6654 3 247.8282 57 47517 30328 623 28 524 a-a-CH3DCH2OH
247467.0757 0.0412 -3.6809 3 264.1861 59 47517 30329 624 29 525 a-a-CH3DCH2OH
247484.1141 0.0300 -4.0848 3 187.3701 53 -47517 30326 125 26 026 a-a-CH3DCH2OH
247632.6069 0.0272 -3.6511 3 232.0317 55 47517 30327 622 27 523 a-a-CH3DCH2OH
247827.3506 0.0497 -3.6977 3 281.1035 61 47517 30330 625 30 526 a-a-CH3DCH2OH
247955.4958 0.0300 -3.8542 3 92.8083 37 -47517 30318 216 17 315 a-a-CH3DCH2OH
248037.7791 0.0216 -3.6383 3 216.7989 53 47517 30326 621 26 522 a-a-CH3DCH2OH
248277.5354 0.0300 -4.0822 3 187.3708 53 -47517 30326 225 26 126 a-a-CH3DCH2OH
248442.1104 0.0300 -3.6125 3 161.6075 45 -47517 30322 616 22 517 a-a-CH3DCH2OH
248565.2825 0.0595 -3.7154 3 298.5776 63 47517 30331 626 31 527 a-a-CH3DCH2OH
248583.2637 0.0169 -3.6272 3 202.1312 51 47517 30325 620 25 521 a-a-CH3DCH2OH
248658.6629 0.0960 -3.8202 3 346.0178 69 47517 30334 530 34 431 a-a-CH3DCH2OH
249219.8264 0.0130 -3.6180 3 188.0301 49 47517 30324 619 24 520 a-a-CH3DCH2OH
249254.8242 0.0300 -3.5900 3 69.7343 33 -47517 30316 115 15 214 a-a-CH3DCH2OH
249474.7866 0.0072 -5.1827 3 42.5656 25 47517 30312 3 9 12 012 a-a-CH3DCH2OH
249717.3055 1.8899 -4.9426 3 1086.9773121 47517 30360 951 60 852 a-a-CH3DCH2OH
249740.7447 0.0706 -3.7339 3 316.6057 65 47517 30332 627 32 528 a-a-CH3DCH2OH
249838.9688 0.0443 -4.4018 3 248.4888 59 47517 30329 426 28 523 a-a-CH3DCH2OH
249885.0855 0.0300 -3.6075 3 149.1830 43 -47517 30321 615 21 516 a-a-CH3DCH2OH
249904.8705 0.0300 -3.6107 3 174.4963 47 -47517 30323 618 23 519 a-a-CH3DCH2OH
250150.6456 0.0454 -3.8865 3 240.9791 59 47517 30329 327 29 228 a-a-CH3DCH2OH
250251.6002 0.0569 -4.3393 3 316.5887 65 47517 30332 627 31 724 a-a-CH3DCH2OH
250391.7210 3.7287 -4.8789 3 1044.1767119 47517 30359 851 59 752 a-a-CH3DCH2OH
250603.3053 0.0300 -3.6057 3 161.5307 45 -47517 30322 617 22 518 a-a-CH3DCH2OH
251049.8635 0.0300 -3.6059 3 137.3358 41 -47517 30320 614 20 515 a-a-CH3DCH2OH
251227.7935 0.6517 -4.1036 3 550.2728 87 47517 30343 538 43 439 a-a-CH3DCH2OH
251287.0958 0.0300 -3.6031 3 149.1335 43 -47517 30321 616 21 517 a-a-CH3DCH2OH
251409.4944 0.0834 -3.7531 3 335.1849 67 47517 30333 628 33 529 a-a-CH3DCH2OH
251428.6002 0.0778 -3.8306 3 300.3589 65 47517 30332 429 32 330 a-a-CH3DCH2OH
251935.4051 0.0300 -3.6032 3 137.3048 41 -47517 30320 615 20 516 a-a-CH3DCH2OH
251990.1729 0.0300 -3.6077 3 126.0634 39 -47517 30319 613 19 514 a-a-CH3DCH2OH
252060.0289 0.2553 -3.9535 3 426.7185 77 47517 30338 434 38 335 a-a-CH3DCH2OH
252533.6693 0.0300 -3.6060 3 126.0444 39 -47517 30319 614 19 515 a-a-CH3DCH2OH
252609.5810 0.0300 -3.8896 3 18.7470 17 -47517 303 8 3 5 7 2 6 a-a-CH3DCH2OH
252749.6967 0.0300 -3.6129 3 115.3633 37 -47517 30318 612 18 513 a-a-CH3DCH2OH
253073.0583 0.0300 -3.6119 3 115.3521 37 -47517 30318 613 18 514 a-a-CH3DCH2OH
253114.5864 0.2430 -4.8948 3 357.0011 71 47517 30335 432 34 529 a-a-CH3DCH2OH
253363.2823 0.0300 -3.6216 3 105.2337 35 -47517 30317 611 17 512 a-a-CH3DCH2OH
253373.5082 0.0300 -4.2923 3 20.1746 19 -47517 303 9 2 7 8 1 8 a-a-CH3DCH2OH
253549.1953 0.0045 -3.6211 3 105.2273 35 47517 30317 612 17 513 a-a-CH3DCH2OH
253621.1228 0.0981 -3.7729 3 354.3122 69 47517 30334 629 34 530 a-a-CH3DCH2OH
253637.1371 1.0524 -4.2805 3 703.7122 97 47517 30348 840 48 741 a-a-CH3DCH2OH
253681.9038 0.2447 -3.8588 3 425.0859 75 47517 30337 730 37 631 a-a-CH3DCH2OH
253858.4533 0.0046 -3.6343 3 95.6731 33 47517 30316 610 16 511 a-a-CH3DCH2OH
253938.7585 2.1165 -4.8720 3 1052.5289119 47517 30359 950 59 851 a-a-CH3DCH2OH
253961.3998 0.0046 -3.6340 3 95.6696 33 47517 30316 611 16 512 a-a-CH3DCH2OH
254257.0413 0.0047 -3.6512 3 86.6801 31 47517 30315 6 9 15 510 a-a-CH3DCH2OH
254311.6668 0.0047 -3.6510 3 86.6782 31 47517 30315 610 15 511 a-a-CH3DCH2OH
254316.0298 0.0032 -3.3363 3 65.0642 33 47517 30316 016 15 115 a-a-CH3DCH2OH
254525.8140 2.7071 -4.5852 3 872.9129109 47517 30354 747 54 648 a-a-CH3DCH2OH
254576.2689 0.0048 -3.6730 3 78.2535 29 47517 30314 6 8 14 5 9 a-a-CH3DCH2OH
254603.8879 0.0048 -3.6729 3 78.2526 29 47517 30314 6 9 14 510 a-a-CH3DCH2OH
254829.9554 0.0050 -3.7004 3 70.3924 27 47517 30313 6 7 13 5 8 a-a-CH3DCH2OH
254843.1642 0.0050 -3.7003 3 70.3920 27 47517 30313 6 8 13 5 9 a-a-CH3DCH2OH
255029.3427 0.0051 -3.7346 3 63.0960 25 47517 30312 6 6 12 5 7 a-a-CH3DCH2OH
255035.2617 0.0051 -3.7346 3 63.0958 25 47517 30312 6 7 12 5 8 a-a-CH3DCH2OH
255077.9286 2.2751 -5.7012 3 669.5516 97 47517 30348 544 47 641 a-a-CH3DCH2OH
255183.7436 0.0054 -3.7775 3 56.3635 23 47517 30311 6 5 11 5 6 a-a-CH3DCH2OH
255186.1980 0.0054 -3.7775 3 56.3634 23 47517 30311 6 6 11 5 7 a-a-CH3DCH2OH
255236.4942 0.1123 -4.4244 3 383.6205 71 47517 30335 729 34 826 a-a-CH3DCH2OH
255301.0177 0.0057 -3.8319 3 50.1942 21 47517 30310 6 4 10 5 5 a-a-CH3DCH2OH
255301.9435 0.0057 -3.8319 3 50.1941 21 47517 30310 6 5 10 5 6 a-a-CH3DCH2OH
255387.9060 0.0061 -3.9029 3 44.5875 19 47517 303 9 6 3 9 5 4 a-a-CH3DCH2OH
255388.2162 0.0061 -3.9029 3 44.5875 19 47517 303 9 6 4 9 5 5 a-a-CH3DCH2OH
255450.2590 0.0065 -4.0000 3 39.5430 17 47517 303 8 6 2 8 5 3 a-a-CH3DCH2OH
255450.3480 0.0065 -4.0000 3 39.5430 17 47517 303 8 6 3 8 5 4 a-a-CH3DCH2OH
255493.1845 0.0070 -4.1454 3 35.0602 15 47517 303 7 6 1 7 5 2 a-a-CH3DCH2OH
255493.2051 0.0070 -4.1454 3 35.0602 15 47517 303 7 6 2 7 5 3 a-a-CH3DCH2OH
255521.1390 0.0075 -4.4114 3 31.1386 13 47517 303 6 6 0 6 5 1 a-a-CH3DCH2OH
255521.1425 0.0075 -4.4114 3 31.1386 13 47517 303 6 6 1 6 5 2 a-a-CH3DCH2OH
255797.7846 0.0597 -4.4482 3 265.0630 61 47517 30330 427 29 524 a-a-CH3DCH2OH
256028.0419 0.1162 -3.8315 3 365.4441 71 47517 30335 531 35 432 a-a-CH3DCH2OH
256279.6129 0.0685 -5.8629 3 99.7201 21 47517 3031010 0 11 9 3 a-a-CH3DCH2OH
256279.6129 0.0685 -5.8629 3 99.7201 21 47517 3031010 1 11 9 2 a-a-CH3DCH2OH
256348.4921 0.0396 -4.2729 3 272.5526 61 47517 30330 526 29 623 a-a-CH3DCH2OH
256372.1461 0.0300 -3.3288 3 65.0242 33 -47517 30316 116 15 015 a-a-CH3DCH2OH
256417.2586 0.1152 -3.7932 3 373.9843 71 47517 30335 630 35 531 a-a-CH3DCH2OH
256816.9523 0.0542 -3.8964 3 257.1211 61 47517 30330 228 30 129 a-a-CH3DCH2OH
257927.8638 0.1886 -4.7819 3 337.4142 69 47517 30334 431 33 528 a-a-CH3DCH2OH
258075.9895 0.0300 -4.0782 3 201.6130 55 -47517 30327 126 27 027 a-a-CH3DCH2OH
258448.3807 0.1222 -4.4127 3 383.6152 71 47517 30335 728 34 827 a-a-CH3DCH2OH
258645.9088 0.0145 -4.0764 3 201.6135 55 47517 30327 226 27 127 a-a-CH3DCH2OH
258662.6411 0.2064 -4.5350 3 457.2273 77 47517 30338 831 37 928 a-a-CH3DCH2OH
258735.0717 0.0300 -4.1111 3 188.0301 51 -47517 30325 421 24 520 a-a-CH3DCH2OH
258776.2146 0.0300 -3.6072 3 52.8306 29 -47517 30314 213 13 112 a-a-CH3DCH2OH
259213.3405 0.1174 -3.8755 3 336.9499 69 47517 30334 331 34 232 a-a-CH3DCH2OH
259570.3908 0.2115 -4.5317 3 457.2260 77 47517 30338 830 37 929 a-a-CH3DCH2OH
259633.0589 0.0806 -4.5106 3 282.2437 63 47517 30331 428 30 525 a-a-CH3DCH2OH
259830.1126 0.1352 -3.8140 3 394.1981 73 47517 30336 631 36 532 a-a-CH3DCH2OH
259952.8336 2.3250 -4.7989 3 1018.6342117 47517 30358 949 58 850 a-a-CH3DCH2OH
260371.0259 0.0536 -3.8852 3 257.1281 61 47517 30330 328 30 229 a-a-CH3DCH2OH
260568.8764 0.0710 -4.2998 3 316.5678 65 47517 30332 626 31 725 a-a-CH3DCH2OH
260616.2916 0.2078 -3.8116 3 403.9055 73 47517 30336 729 36 630 a-a-CH3DCH2OH
260680.6416 0.1440 -4.6790 3 318.4223 67 47517 30333 430 32 527 a-a-CH3DCH2OH
260955.5143 0.0939 -3.8350 3 318.4131 67 47517 30333 430 33 331 a-a-CH3DCH2OH
261265.5434 0.1083 -4.5880 3 300.0308 65 47517 30332 429 31 526 a-a-CH3DCH2OH
261729.8626 0.3522 -4.6639 3 537.3954 83 47517 30341 933 401030 a-a-CH3DCH2OH
261749.8126 1.5593 -4.3235 3 716.4027 99 47517 30349 643 49 544 a-a-CH3DCH2OH
261823.8007 0.0300 -3.8331 3 23.4767 19 -47517 303 9 3 7 8 2 6 a-a-CH3DCH2OH
261839.6534 0.0078 -5.1364 3 49.5339 27 47517 30313 310 13 013 a-a-CH3DCH2OH
261969.6261 0.3545 -4.6631 3 537.3951 83 47517 30341 932 401031 a-a-CH3DCH2OH
262518.3469 4.5823 -4.9154 3 1078.2207121 47517 30360 852 60 753 a-a-CH3DCH2OH
262527.9234 0.9890 -4.2149 3 676.1159 95 47517 30347 839 47 740 a-a-CH3DCH2OH
263355.4500 0.0300 -3.7677 3 15.3808 13 -47517 303 6 4 3 5 3 2 a-a-CH3DCH2OH
263383.0284 0.0300 -3.7676 3 15.3799 13 -47517 303 6 4 2 5 3 3 a-a-CH3DCH2OH
263881.4233 0.1585 -3.8351 3 414.9507 75 47517 30337 632 37 533 a-a-CH3DCH2OH
263918.3899 0.1397 -3.8438 3 385.3948 73 47517 30336 532 36 433 a-a-CH3DCH2OH
266489.1268 0.2899 -3.9528 3 448.2696 79 47517 30339 435 39 336 a-a-CH3DCH2OH
266844.1244 0.1750 -3.7678 3 383.3351 71 47517 30335 728 35 629 a-a-CH3DCH2OH
266903.1839 0.7274 -4.1077 3 574.8018 89 47517 30344 539 44 440 a-a-CH3DCH2OH
267454.4329 2.4514 -4.7241 3 985.3046115 47517 30357 948 57 849 a-a-CH3DCH2OH
267896.4782 0.0680 -4.3051 3 334.6350 67 47517 30333 628 32 725 a-a-CH3DCH2OH
268017.4010 0.0636 -3.8943 3 273.7917 63 47517 30331 229 31 130 a-a-CH3DCH2OH
268347.7398 0.0300 -3.4903 3 78.5414 35 -47517 30317 116 16 215 a-a-CH3DCH2OH
268581.8428 0.1859 -3.8568 3 436.2389 77 47517 30338 633 38 534 a-a-CH3DCH2OH
268619.7748 0.0168 -4.0744 3 216.3759 57 47517 30328 127 28 028 a-a-CH3DCH2OH
269027.2418 0.0168 -4.0731 3 216.3762 57 47517 30328 227 28 128 a-a-CH3DCH2OH
269266.5858 0.0405 -4.1792 3 256.0813 59 47517 30329 524 28 623 a-a-CH3DCH2OH
269379.8783 2.0106 -5.5600 3 642.5511 95 47517 30347 543 46 640 a-a-CH3DCH2OH
269751.4815 3.1395 -4.6081 3 903.9403111 47517 30355 748 55 649 a-a-CH3DCH2OH
270226.2185 0.0300 -3.2701 3 73.5758 35 -47517 30317 017 16 116 a-a-CH3DCH2OH
270447.9380 0.0300 -3.5329 3 60.7131 31 -47517 30315 214 14 113 a-a-CH3DCH2OH
270673.0374 0.0631 -3.8862 3 273.7967 63 47517 30331 329 31 230 a-a-CH3DCH2OH
270729.7044 0.1124 -3.8412 3 336.9872 69 47517 30334 431 34 332 a-a-CH3DCH2OH
270805.1032 0.0300 -3.8295 3 23.2059 19 -47517 303 9 3 6 8 2 7 a-a-CH3DCH2OH
271171.1503 0.0509 -4.2564 3 289.5323 63 47517 30331 527 30 624 a-a-CH3DCH2OH
271463.3273 0.0300 -3.7349 3 102.8838 39 -47517 30319 217 18 316 a-a-CH3DCH2OH
271533.1117 0.9041 -4.1502 3 649.1202 93 47517 30346 838 46 739 a-a-CH3DCH2OH
271652.9831 0.0300 -3.9342 3 142.2640 45 -47517 30322 319 21 418 a-a-CH3DCH2OH
271688.9353 0.0300 -3.2651 3 73.5473 35 -47517 30317 117 16 016 a-a-CH3DCH2OH
271730.5408 0.1382 -3.8751 3 356.0535 71 47517 30335 332 35 233 a-a-CH3DCH2OH
272283.7190 0.1668 -3.8571 3 405.8683 75 47517 30337 533 37 434 a-a-CH3DCH2OH
272317.4200 0.1466 -3.7276 3 363.3729 69 47517 30334 727 34 628 a-a-CH3DCH2OH
273543.2860 0.1292 -4.3912 3 403.3287 73 47517 30336 730 35 827 a-a-CH3DCH2OH
273930.7777 0.2179 -3.8789 3 458.0599 79 47517 30339 634 39 535 a-a-CH3DCH2OH
275754.0428 0.0300 -3.7785 3 28.6263 21 -47517 30310 3 8 9 2 7 a-a-CH3DCH2OH
276096.0284 2.4812 -4.6484 3 952.5512113 47517 30356 947 56 848 a-a-CH3DCH2OH
276360.4666 0.0084 -5.1142 3 57.0199 29 47517 30314 311 14 014 a-a-CH3DCH2OH
277034.7211 0.2322 -4.5058 3 478.6007 79 47517 30339 832 38 929 a-a-CH3DCH2OH
277043.6943 0.1226 -3.6911 3 344.0157 67 47517 30333 726 33 627 a-a-CH3DCH2OH
277984.6227 1.7400 -4.3368 3 744.4231101 47517 30350 644 50 545 a-a-CH3DCH2OH
278159.3115 0.1461 -4.3754 3 403.3204 73 47517 30336 729 35 828 a-a-CH3DCH2OH
278376.1089 0.2410 -4.5014 3 478.5986 79 47517 30339 831 38 930 a-a-CH3DCH2OH
279063.2347 0.0746 -3.8952 3 290.9811 65 47517 30332 230 32 131 a-a-CH3DCH2OH
279125.1316 0.0300 -4.0730 3 231.6586 59 -47517 30329 128 29 029 a-a-CH3DCH2OH
279415.2332 0.0220 -4.0722 3 231.6588 59 47517 30329 228 29 129 a-a-CH3DCH2OH
279916.6829 0.2551 -3.9015 3 480.4110 81 47517 30340 635 40 536 a-a-CH3DCH2OH
279970.4138 0.3893 -4.6397 3 560.4340 85 47517 30342 934 411031 a-a-CH3DCH2OH
280078.2716 0.0300 -3.7062 3 18.7464 15 -47517 303 7 4 4 6 3 3 a-a-CH3DCH2OH
280161.3202 0.0300 -3.7061 3 18.7437 15 -47517 303 7 4 3 6 3 4 a-a-CH3DCH2OH
280332.6063 0.3933 -4.6385 3 560.4335 85 47517 30342 933 411032 a-a-CH3DCH2OH
280341.7614 0.8079 -4.0872 3 622.7310 91 47517 30345 837 45 738 a-a-CH3DCH2OH
280538.2335 0.3268 -3.9562 3 470.3317 81 47517 30340 436 40 337 a-a-CH3DCH2OH
280550.8787 0.0300 -4.2791 3 25.0057 21 -47517 30310 2 8 9 1 9 a-a-CH3DCH2OH
280706.6182 0.1334 -3.8492 3 356.0807 71 47517 30335 432 35 333 a-a-CH3DCH2OH
281034.3678 0.0741 -3.8895 3 290.9846 65 47517 30332 330 32 231 a-a-CH3DCH2OH
281070.2027 0.1024 -3.6582 3 325.2595 65 47517 30332 725 32 626 a-a-CH3DCH2OH
281074.4179 0.1978 -3.8717 3 426.8632 77 47517 30338 534 38 435 a-a-CH3DCH2OH
282177.3680 0.0917 -4.2533 3 334.6033 67 47517 30333 627 32 726 a-a-CH3DCH2OH
282421.8798 0.0300 -3.4625 3 69.1208 33 -47517 30316 215 15 114 a-a-CH3DCH2OH
282461.3237 0.7998 -4.1150 3 599.8344 91 47517 30345 540 45 441 a-a-CH3DCH2OH
282954.3487 1.7539 -5.4203 3 616.0918 93 47517 30346 542 45 639 a-a-CH3DCH2OH
283916.0092 0.1617 -3.8785 3 375.6734 73 47517 30336 333 36 234 a-a-CH3DCH2OH
284467.9604 0.0855 -3.6288 3 307.0998 63 47517 30331 724 31 625 a-a-CH3DCH2OH
284780.5816 0.0174 -4.0279 3 202.1312 53 47517 30326 422 25 521 a-a-CH3DCH2OH
284978.8159 0.0659 -4.2512 3 307.0998 65 47517 30332 528 31 625 a-a-CH3DCH2OH
285257.9533 0.0810 -4.2786 3 353.2569 69 47517 30334 629 33 726 a-a-CH3DCH2OH
285505.9827 2.4220 -4.5723 3 920.3841111 47517 30355 946 55 847 a-a-CH3DCH2OH
285931.7180 3.5529 -4.6314 3 935.4550113 47517 30356 749 56 650 a-a-CH3DCH2OH
286052.8659 0.0033 -3.2105 3 82.6098 37 47517 30318 018 17 117 a-a-CH3DCH2OH
286517.7849 0.2979 -3.9247 3 503.2899 83 47517 30341 636 41 537 a-a-CH3DCH2OH
286869.1071 0.0033 -3.4032 3 87.8815 37 47517 30318 117 17 216 a-a-CH3DCH2OH
287086.5550 0.0034 -3.2071 3 82.5896 37 47517 30318 118 17 017 a-a-CH3DCH2OH
287318.1892 0.0712 -3.6027 3 289.5323 61 47517 30330 723 30 624 a-a-CH3DCH2OH
287440.8588 0.1599 -3.7394 3 402.8651 73 47517 30336 730 36 631 a-a-CH3DCH2OH
287492.5055 0.1814 -3.7685 3 423.7528 75 47517 30337 731 37 632 a-a-CH3DCH2OH
287706.6845 0.1404 -3.7113 3 382.5374 71 47517 30335 729 35 630 a-a-CH3DCH2OH
287923.0830 0.2053 -3.7985 3 445.1978 77 47517 30338 732 38 633 a-a-CH3DCH2OH
288228.9607 0.1226 -3.6844 3 362.7720 69 47517 30334 728 34 629 a-a-CH3DCH2OH
288700.7408 0.7094 -4.0266 3 596.9523 89 47517 30344 836 44 737 a-a-CH3DCH2OH
288792.4211 0.2319 -3.8291 3 467.1972 79 47517 30339 733 39 634 a-a-CH3DCH2OH
288915.5212 0.0052 -3.7288 3 34.3639 23 47517 30311 3 9 10 2 8 a-a-CH3DCH2OH
288949.0248 0.1065 -3.6587 3 343.5710 67 47517 30333 727 33 628 a-a-CH3DCH2OH
289599.4921 0.0303 -4.0741 3 247.4611 61 47517 30330 129 30 030 a-a-CH3DCH2OH
289632.3823 0.0045 -3.7786 3 28.2161 21 47517 30310 3 7 9 2 8 a-a-CH3DCH2OH
289702.4224 0.0591 -3.5796 3 272.5526 59 47517 30329 722 29 623 a-a-CH3DCH2OH
289805.2358 0.0304 -4.0735 3 247.4612 61 47517 30330 229 30 130 a-a-CH3DCH2OH
289812.2420 0.0919 -3.6344 3 324.9362 65 47517 30332 726 32 627 a-a-CH3DCH2OH
289982.5458 0.0874 -3.8990 3 308.6894 67 47517 30333 231 33 132 a-a-CH3DCH2OH
290156.6353 0.2620 -3.8604 3 489.7480 81 47517 30340 734 40 635 a-a-CH3DCH2OH
290239.1401 0.2329 -3.8875 3 448.3785 79 47517 30339 535 39 436 a-a-CH3DCH2OH
290769.3279 0.0787 -3.6116 3 306.8688 63 47517 30331 725 31 626 a-a-CH3DCH2OH
290845.9752 0.1571 -3.8591 3 375.6932 73 47517 30336 433 36 334 a-a-CH3DCH2OH
291436.9342 0.0870 -3.8949 3 308.6918 67 47517 30333 331 33 232 a-a-CH3DCH2OH
291696.3019 0.0488 -3.5595 3 256.1570 57 47517 30328 721 28 622 a-a-CH3DCH2OH
291777.2712 0.0669 -3.5905 3 289.3701 61 47517 30330 724 30 625 a-a-CH3DCH2OH
291833.9796 0.1479 -4.3644 3 423.6080 75 47517 30337 731 36 828 a-a-CH3DCH2OH
292066.1413 0.2964 -3.8922 3 512.8471 83 47517 30341 735 41 636 a-a-CH3DCH2OH
292799.8335 0.0564 -3.5712 3 272.4408 59 47517 30329 723 29 624 a-a-CH3DCH2OH
293052.1278 0.0060 -3.5939 3 18.0027 11 47517 303 5 5 1 4 4 0 a-a-CH3DCH2OH
293052.1463 0.0060 -3.5939 3 18.0027 11 47517 303 5 5 0 4 4 1 a-a-CH3DCH2OH
293127.6654 0.0091 -5.1127 3 65.0242 31 47517 30315 312 15 015 a-a-CH3DCH2OH
293366.4057 0.0401 -3.5421 3 240.3422 55 47517 30327 720 27 621 a-a-CH3DCH2OH
293703.1889 0.3468 -3.9486 3 526.6942 85 47517 30342 637 42 538 a-a-CH3DCH2OH
293807.6476 0.0471 -3.5537 3 256.0813 57 47517 30328 722 28 623 a-a-CH3DCH2OH
293885.9143 0.0552 -4.1189 3 272.4408 61 47517 30330 525 29 624 a-a-CH3DCH2OH
294165.5307 0.3667 -3.9635 3 492.9059 83 47517 30341 437 41 338 a-a-CH3DCH2OH
294408.5039 1.9055 -4.3522 3 772.9399103 47517 30351 645 51 546 a-a-CH3DCH2OH
294563.8781 0.3362 -3.9245 3 536.4911 85 47517 30342 736 42 637 a-a-CH3DCH2OH
294616.6643 0.0053 -3.6260 3 113.5077 41 47517 30320 218 19 317 a-a-CH3DCH2OH
294769.2247 0.0326 -3.5274 3 225.1053 53 47517 30326 719 26 620 a-a-CH3DCH2OH
294777.9654 0.0390 -3.5383 3 240.2919 55 47517 30327 721 27 622 a-a-CH3DCH2OH
294786.7550 0.0037 -3.3963 3 78.0485 35 47517 30317 216 16 115 a-a-CH3DCH2OH
295311.0567 2.2917 -4.4967 3 888.8122109 47517 30354 945 54 846 a-a-CH3DCH2OH
295488.3586 0.2608 -4.4824 3 500.5424 81 47517 30340 833 39 930 a-a-CH3DCH2OH
295507.6118 1.5093 -5.2830 3 590.1843 91 47517 30345 541 44 638 a-a-CH3DCH2OH
295694.1299 0.0320 -3.5249 3 225.0725 53 47517 30326 720 26 621 a-a-CH3DCH2OH
295806.6650 0.1880 -3.8853 3 395.8100 75 47517 30337 334 37 235 a-a-CH3DCH2OH
295951.4738 0.0264 -3.5153 3 210.4440 51 47517 30325 718 25 619 a-a-CH3DCH2OH
296426.3829 0.6153 -3.9689 3 571.7862 87 47517 30343 835 43 736 a-a-CH3DCH2OH
296544.8575 0.0260 -3.5137 3 210.4231 51 47517 30325 719 25 620 a-a-CH3DCH2OH
296732.2178 0.0300 -3.6489 3 22.6765 17 -47517 303 8 4 5 7 3 4 a-a-CH3DCH2OH
296940.4582 0.0300 -3.6485 3 22.6699 17 -47517 303 8 4 4 7 3 5 a-a-CH3DCH2OH
296951.1165 0.0211 -3.5058 3 196.3562 49 47517 30324 717 24 618 a-a-CH3DCH2OH
297323.4184 0.0209 -3.5048 3 196.3431 49 47517 30324 718 24 619 a-a-CH3DCH2OH
297444.9547 0.2758 -4.4763 3 500.5391 81 47517 30340 832 39 931 a-a-CH3DCH2OH
297557.1865 0.0859 -4.2580 3 325.2595 67 47517 30333 529 32 626 a-a-CH3DCH2OH
297613.5915 0.0300 -3.8325 3 154.6493 47 -47517 30323 320 22 419 a-a-CH3DCH2OH
297683.8292 0.3824 -3.9572 3 560.6768 87 47517 30343 737 43 638 a-a-CH3DCH2OH
297728.1713 0.8698 -4.1256 3 625.3722 93 47517 30346 541 46 442 a-a-CH3DCH2OH
297798.6783 0.0168 -3.4989 3 182.8402 47 47517 30323 716 23 617 a-a-CH3DCH2OH
298026.7896 0.0166 -3.4982 3 182.8323 47 47517 30323 717 23 618 a-a-CH3DCH2OH
298311.3144 0.4304 -4.6208 3 584.0390 87 47517 30343 935 421032 a-a-CH3DCH2OH
298373.1049 0.1761 -4.3433 3 423.5952 75 47517 30337 730 36 829 a-a-CH3DCH2OH
298518.5921 0.0132 -3.4946 3 169.8947 45 47517 30322 715 22 616 a-a-CH3DCH2OH
298654.8424 0.0132 -3.4942 3 169.8899 45 47517 30322 716 22 617 a-a-CH3DCH2OH
298851.8567 0.4372 -4.6192 3 584.0382 87 47517 30343 934 421033 a-a-CH3DCH2OH
299130.4358 0.0104 -3.4931 3 157.5182 43 47517 30321 714 21 615 a-a-CH3DCH2OH
299209.6079 0.0104 -3.4929 3 157.5155 43 47517 30321 715 21 616 a-a-CH3DCH2OH
299649.9540 0.0300 -3.4945 3 145.7100 41 -47517 30320 713 20 614 a-a-CH3DCH2OH
299694.6040 0.0300 -3.4944 3 145.7084 41 -47517 30320 714 20 615 a-a-CH3DCH2OH
299726.5768 0.2723 -3.9048 3 470.4132 81 47517 30340 536 40 437 a-a-CH3DCH2OH
300048.4525 0.0420 -4.0775 3 263.7832 63 47517 30331 130 31 031 a-a-CH3DCH2OH
300090.1220 0.0300 -3.4989 3 134.4688 39 -47517 30319 712 19 613 a-a-CH3DCH2OH
300114.4960 0.0300 -3.4989 3 134.4680 39 -47517 30319 713 19 614 a-a-CH3DCH2OH
300193.8651 0.0420 -4.0771 3 263.7833 63 47517 30331 230 31 131 a-a-CH3DCH2OH
300461.5940 0.0300 -3.5068 3 123.7941 37 -47517 30318 711 18 612 a-a-CH3DCH2OH
300474.4080 0.0300 -3.5067 3 123.7937 37 -47517 30318 712 18 613 a-a-CH3DCH2OH
300773.1880 0.0300 -3.5183 3 113.6850 35 -47517 30317 710 17 611 a-a-CH3DCH2OH
300779.6690 0.0300 -3.5183 3 113.6848 35 -47517 30317 711 17 612 a-a-CH3DCH2OH
300798.9686 0.1023 -3.9054 3 326.9163 69 47517 30334 232 34 133 a-a-CH3DCH2OH
301032.7150 0.0300 -3.5339 3 104.1409 33 -47517 30316 7 9 16 610 a-a-CH3DCH2OH
301035.8480 0.0300 -3.5339 3 104.1408 33 -47517 30316 710 16 611 a-a-CH3DCH2OH
301112.2328 0.1837 -3.8710 3 395.8242 75 47517 30337 434 37 335 a-a-CH3DCH2OH
301246.9140 0.0300 -3.5544 3 95.1612 31 -47517 30315 7 8 15 6 9 a-a-CH3DCH2OH
301248.3190 0.0300 -3.5544 3 95.1611 31 -47517 30315 7 9 15 610 a-a-CH3DCH2OH
301313.0053 0.0300 -3.6828 3 40.6886 25 -47517 30312 310 11 2 9 a-a-CH3DCH2OH
301421.6860 0.0300 -3.5805 3 86.7452 29 -47517 30314 7 7 14 6 8 a-a-CH3DCH2OH
301422.2930 0.0300 -3.5805 3 86.7452 29 -47517 30314 7 8 14 6 9 a-a-CH3DCH2OH
301434.3075 0.4022 -3.9733 3 550.6221 87 47517 30343 638 43 539 a-a-CH3DCH2OH
301449.9096 0.4363 -3.9903 3 585.4010 89 47517 30344 738 44 639 a-a-CH3DCH2OH
301562.4520 0.0300 -3.6135 3 78.8926 27 -47517 30313 7 6 13 6 7 a-a-CH3DCH2OH
301562.4520 0.0300 -3.6135 3 78.8926 27 -47517 30313 7 7 13 6 8 a-a-CH3DCH2OH
301673.7860 0.0300 -3.6552 3 71.6028 25 -47517 30312 7 5 12 6 6 a-a-CH3DCH2OH
301673.7860 0.0300 -3.6552 3 71.6028 25 -47517 30312 7 6 12 6 7 a-a-CH3DCH2OH
301760.2710 0.0300 -3.7088 3 64.8755 23 -47517 30311 7 4 11 6 5 a-a-CH3DCH2OH
301760.2710 0.0300 -3.7088 3 64.8755 23 -47517 30311 7 5 11 6 6 a-a-CH3DCH2OH
301817.2160 0.0300 -3.1568 3 92.1658 39 -47517 30319 019 18 118 a-a-CH3DCH2OH
301825.8810 0.0300 -3.7791 3 58.7101 21 -47517 30310 7 3 10 6 4 a-a-CH3DCH2OH
301825.8810 0.0300 -3.7791 3 58.7101 21 -47517 30310 7 4 10 6 5 a-a-CH3DCH2OH
301866.3654 0.1020 -3.9025 3 326.9180 69 47517 30334 332 34 233 a-a-CH3DCH2OH
301874.1720 0.0300 -3.8761 3 53.1064 19 -47517 303 9 7 2 9 6 3 a-a-CH3DCH2OH
301874.1720 0.0300 -3.8761 3 53.1064 19 -47517 303 9 7 3 9 6 4 a-a-CH3DCH2OH
301908.3710 0.0300 -4.0222 3 48.0639 17 -47517 303 8 7 1 8 6 2 a-a-CH3DCH2OH
301908.3710 0.0300 -4.0222 3 48.0639 17 -47517 303 8 7 2 8 6 3 a-a-CH3DCH2OH
301931.5300 0.0300 -4.2900 3 43.5825 15 -47517 303 7 7 0 7 6 1 a-a-CH3DCH2OH
301931.5300 0.0300 -4.2900 3 43.5825 15 -47517 303 7 7 1 7 6 2 a-a-CH3DCH2OH
302221.4432 0.0965 -4.2599 3 372.4564 71 47517 30335 630 34 727 a-a-CH3DCH2OH
302543.5010 0.0300 -3.1546 3 92.1515 39 -47517 30319 119 18 018 a-a-CH3DCH2OH
302727.2825 3.9335 -4.6558 3 967.4584115 47517 30357 750 57 651 a-a-CH3DCH2OH
303407.2023 0.5298 -3.9144 3 547.2324 85 47517 30342 834 42 735 a-a-CH3DCH2OH
304695.2318 0.1187 -4.2113 3 353.2093 69 47517 30334 628 33 727 a-a-CH3DCH2OH
304852.2944 0.0300 -3.3272 3 97.7527 39 -47517 30319 118 18 217 a-a-CH3DCH2OH
305160.4112 2.1123 -4.4223 3 857.8431107 47517 30353 944 53 845 a-a-CH3DCH2OH
305615.1612 6.0157 -5.9750 3 912.9382113 47517 30356 651 55 748 a-a-CH3DCH2OH
305875.2639 0.4989 -4.0237 3 610.6604 91 47517 30345 739 45 640 a-a-CH3DCH2OH
306757.0806 1.2805 -5.1490 3 564.8393 89 47517 30344 540 43 637 a-a-CH3DCH2OH
307367.4494 0.4106 -3.9745 3 515.9928 85 47517 30342 438 42 339 a-a-CH3DCH2OH
307442.8786 0.2175 -3.8953 3 416.4633 77 47517 30338 335 38 236 a-a-CH3DCH2OH
307592.8552 0.0300 -3.3347 3 87.4925 37 -47517 30318 217 17 116 a-a-CH3DCH2OH
308680.5249 0.1131 -4.2772 3 344.0157 69 47517 30334 530 33 627 a-a-CH3DCH2OH
309268.9955 0.0300 -3.7374 3 33.7757 23 -47517 30311 3 8 10 2 9 a-a-CH3DCH2OH
309457.8258 0.0072 -4.2777 3 30.3662 23 47517 30311 2 9 10 110 a-a-CH3DCH2OH
309487.0149 0.3163 -3.9235 3 492.9665 83 47517 30341 537 41 438 a-a-CH3DCH2OH
309597.9753 0.4548 -3.8632 3 523.2892 83 47517 30341 833 41 734 a-a-CH3DCH2OH
309666.5243 0.4642 -3.9989 3 575.0716 89 47517 30344 639 44 540 a-a-CH3DCH2OH
309838.2195 0.1500 -3.5467 3 20.8035 13 -47517 303 6 5 2 5 4 1 a-a-CH3DCH2OH
309838.2195 0.1500 -3.5467 3 20.8035 13 -47517 303 6 5 1 5 4 2 a-a-CH3DCH2OH
310058.0996 0.1686 -4.3437 3 444.4594 77 47517 30338 732 37 829 a-a-CH3DCH2OH
310476.2450 0.0570 -4.0831 3 280.6248 65 47517 30332 131 32 032 a-a-CH3DCH2OH
310578.6918 0.0570 -4.0828 3 280.6248 65 47517 30332 231 32 132 a-a-CH3DCH2OH
310763.2634 2.0544 -4.3704 3 801.9549105 47517 30352 646 52 547 a-a-CH3DCH2OH
310961.9982 0.5713 -4.0576 3 636.4522 93 47517 30346 740 46 641 a-a-CH3DCH2OH
311474.7382 0.2137 -3.8847 3 416.4735 77 47517 30338 435 38 336 a-a-CH3DCH2OH
311531.8430 0.1198 -3.9142 3 345.6619 71 47517 30335 233 35 134 a-a-CH3DCH2OH
311569.1736 0.0239 -3.9488 3 216.7989 55 47517 30327 423 26 522 a-a-CH3DCH2OH
312190.9269 0.0099 -5.1287 3 73.5473 33 47517 30316 313 16 016 a-a-CH3DCH2OH
312311.4523 0.1196 -3.9122 3 345.6631 71 47517 30335 333 35 234 a-a-CH3DCH2OH
312589.0354 0.9391 -4.1399 3 651.4169 95 47517 30347 542 47 443 a-a-CH3DCH2OH
312986.4940 0.0056 -3.6391 3 47.5982 27 47517 30313 311 12 210 a-a-CH3DCH2OH
313273.9611 0.0047 -3.5961 3 27.1731 19 47517 303 9 4 6 8 3 5 a-a-CH3DCH2OH
313732.7426 0.0047 -3.5953 3 27.1586 19 47517 303 9 4 5 8 3 6 a-a-CH3DCH2OH
314008.4333 0.2924 -4.4642 3 523.0531 83 47517 30341 834 40 931 a-a-CH3DCH2OH
314747.7571 1.9057 -4.3497 3 827.4828105 47517 30352 943 52 844 a-a-CH3DCH2OH
315007.3949 0.3907 -3.8155 3 499.9533 81 47517 30340 832 40 733 a-a-CH3DCH2OH
316438.6884 1.0703 -5.0193 3 540.0668 87 47517 30343 539 42 636 a-a-CH3DCH2OH
316701.3488 0.6544 -4.0919 3 662.7734 95 47517 30347 741 47 642 a-a-CH3DCH2OH
316751.9369 0.4759 -4.6068 3 608.2106 89 47517 30344 936 431033 a-a-CH3DCH2OH
316826.4649 0.3171 -4.4558 3 523.0480 83 47517 30341 833 40 932 a-a-CH3DCH2OH
317269.5496 0.0050 -3.5274 3 124.6772 43 47517 30321 219 20 318 a-a-CH3DCH2OH
317535.5214 0.0036 -3.1084 3 102.2433 41 47517 30320 020 19 119 a-a-CH3DCH2OH
317549.2254 0.4871 -4.6045 3 608.2094 89 47517 30344 935 431034 a-a-CH3DCH2OH
318043.2676 0.0300 -3.1069 3 102.2333 41 -47517 30320 120 19 019 a-a-CH3DCH2OH
318121.6045 0.1499 -4.3095 3 363.3729 71 47517 30335 531 34 628 a-a-CH3DCH2OH
318350.9937 0.5332 -4.0254 3 600.0414 91 47517 30345 640 45 541 a-a-CH3DCH2OH
318651.2662 0.1154 -4.2491 3 392.2361 73 47517 30336 631 35 728 a-a-CH3DCH2OH
318863.8883 0.2505 -3.9080 3 437.6335 79 47517 30339 336 39 237 a-a-CH3DCH2OH
319006.3309 0.0079 -5.2199 3 52.8306 27 47517 30313 4 9 13 112 a-a-CH3DCH2OH
319015.9366 0.0081 -5.0720 3 60.7131 29 47517 30314 410 14 113 a-a-CH3DCH2OH
319190.4313 0.2142 -4.3156 3 444.4400 77 47517 30338 731 37 830 a-a-CH3DCH2OH
319473.6129 0.3652 -3.9438 3 516.0377 85 47517 30342 538 42 439 a-a-CH3DCH2OH
319600.1019 0.0738 -4.0622 3 289.3701 63 47517 30331 526 30 625 a-a-CH3DCH2OH
319682.6201 0.3365 -3.7712 3 477.2208 79 47517 30339 831 39 732 a-a-CH3DCH2OH
319815.3201 4.2716 -4.6821 3 999.9522117 47517 30358 751 58 652 a-a-CH3DCH2OH
320157.0652 0.0078 -5.3912 3 45.4796 25 47517 30312 4 8 12 111 a-a-CH3DCH2OH
320166.4238 0.4592 -3.9890 3 539.5932 87 47517 30343 439 43 340 a-a-CH3DCH2OH
320449.4545 0.0083 -4.9471 3 69.1208 31 47517 30315 411 15 114 a-a-CH3DCH2OH
320851.3650 0.0300 -3.2777 3 97.4505 39 -47517 30319 218 18 117 a-a-CH3DCH2OH
320886.0308 0.0756 -4.0908 3 297.9858 67 47517 30333 132 33 033 a-a-CH3DCH2OH
320957.9975 0.0756 -4.0906 3 297.9858 67 47517 30333 232 33 133 a-a-CH3DCH2OH
321792.6151 5.4711 -5.8320 3 881.4030111 47517 30355 650 54 747 a-a-CH3DCH2OH
321907.6209 0.2472 -3.9003 3 437.6409 79 47517 30339 436 39 337 a-a-CH3DCH2OH
322196.6862 0.1402 -3.9253 3 364.9261 73 47517 30336 234 36 135 a-a-CH3DCH2OH
322200.8219 0.0079 -5.5864 3 38.6670 23 47517 30311 4 7 11 110 a-a-CH3DCH2OH
322353.9725 0.0300 -3.2609 3 108.1529 41 -47517 30320 119 19 218 a-a-CH3DCH2OH
322763.6129 0.1400 -3.9239 3 364.9270 73 47517 30336 334 36 235 a-a-CH3DCH2OH
323074.2690 0.7485 -4.1268 3 689.6215 97 47517 30348 742 48 643 a-a-CH3DCH2OH
323553.0723 0.0086 -4.8451 3 78.0485 33 47517 30316 412 16 115 a-a-CH3DCH2OH
323633.0636 0.0300 -3.7369 3 167.5926 49 -47517 30324 321 23 420 a-a-CH3DCH2OH
323693.9693 0.2907 -3.7301 3 455.0871 77 47517 30338 830 38 731 a-a-CH3DCH2OH
323828.3531 1.6911 -4.2795 3 797.7348103 47517 30351 942 51 843 a-a-CH3DCH2OH
324001.3970 0.0300 -3.5968 3 55.0889 29 -47517 30314 312 13 211 a-a-CH3DCH2OH
324314.0238 0.8809 -4.8954 3 515.8763 85 47517 30342 538 41 635 a-a-CH3DCH2OH
324880.6624 0.0082 -5.8072 3 32.3996 21 47517 30310 4 6 10 1 9 a-a-CH3DCH2OH
325665.2780 0.1989 -4.3553 3 383.3351 73 47517 30336 532 35 629 a-a-CH3DCH2OH
326249.0694 0.4808 -3.9364 3 595.4563 89 47517 30344 837 44 738 a-a-CH3DCH2OH
326368.8382 0.5282 -3.9774 3 620.8634 91 47517 30345 838 45 739 a-a-CH3DCH2OH
326506.4939 0.4374 -3.8962 3 570.6065 87 47517 30343 836 43 737 a-a-CH3DCH2OH
326617.6949 0.0055 -3.4992 3 24.1654 15 47517 303 7 5 3 6 4 2 a-a-CH3DCH2OH
326618.5347 0.0055 -3.4992 3 24.1654 15 47517 303 7 5 2 6 4 3 a-a-CH3DCH2OH
326846.6769 2.1881 -4.3916 3 831.4703107 47517 30353 647 53 548 a-a-CH3DCH2OH
326925.4310 0.5807 -4.0191 3 646.8248 93 47517 30346 839 46 740 a-a-CH3DCH2OH
326983.3887 1.0101 -4.1579 3 677.9697 97 47517 30348 543 48 444 a-a-CH3DCH2OH
327080.1751 0.3972 -3.8569 3 546.3167 85 47517 30342 835 42 736 a-a-CH3DCH2OH
327122.0375 0.2519 -3.6920 3 433.5478 75 47517 30337 829 37 730 a-a-CH3DCH2OH
327436.4716 0.6093 -4.0531 3 625.5301 93 47517 30346 641 46 542 a-a-CH3DCH2OH
327909.8003 0.3597 -3.8187 3 522.5894 83 47517 30341 834 41 735 a-a-CH3DCH2OH
327975.1958 0.6399 -4.0614 3 673.3375 95 47517 30347 840 47 741 a-a-CH3DCH2OH
328151.2044 0.1913 -4.3288 3 465.8843 79 47517 30339 733 38 830 a-a-CH3DCH2OH
328236.5249 0.1534 -4.1731 3 372.3863 71 47517 30335 629 34 728 a-a-CH3DCH2OH
328546.3400 0.0089 -4.7654 3 87.4925 35 47517 30317 413 17 116 a-a-CH3DCH2OH
328937.4542 0.3246 -3.7816 3 499.4266 81 47517 30340 833 40 734 a-a-CH3DCH2OH
329569.2829 0.7078 -4.1043 3 700.3981 97 47517 30348 841 48 742 a-a-CH3DCH2OH
329643.3521 0.4193 -3.9656 3 539.6263 87 47517 30343 539 43 440 a-a-CH3DCH2OH
329643.7074 0.0047 -3.5482 3 32.2389 21 47517 30310 4 7 9 3 6 a-a-CH3DCH2OH
329912.1911 0.0050 -3.7063 3 39.8825 25 47517 30312 3 9 11 210 a-a-CH3DCH2OH
330048.2503 0.2188 -3.6568 3 412.5988 73 47517 30336 828 36 729 a-a-CH3DCH2OH
330052.3963 0.8542 -4.1622 3 716.9940 99 47517 30349 743 49 644 a-a-CH3DCH2OH
330105.2814 0.2874 -3.9235 3 459.3206 81 47517 30340 337 40 238 a-a-CH3DCH2OH
330109.1403 0.2917 -3.7458 3 476.8303 79 47517 30339 832 39 733 a-a-CH3DCH2OH
330178.2811 0.7135 -4.7787 3 492.2763 83 47517 30341 537 40 634 a-a-CH3DCH2OH
330217.0105 0.0078 -5.7739 3 11.6550 15 47517 303 7 3 5 6 0 6 a-a-CH3DCH2OH
330560.7242 0.0047 -3.5468 3 32.2102 21 47517 30310 4 6 9 3 7 a-a-CH3DCH2OH
331124.5927 0.2630 -4.4148 3 403.9055 75 47517 30337 533 36 630 a-a-CH3DCH2OH
331280.1641 0.0982 -4.1005 3 315.8660 69 47517 30334 133 34 034 a-a-CH3DCH2OH
331330.5843 0.0982 -4.1004 3 315.8660 69 47517 30334 233 34 134 a-a-CH3DCH2OH
331375.9776 0.2611 -3.7114 3 454.8019 77 47517 30338 831 38 732 a-a-CH3DCH2OH
331751.8980 0.7867 -4.1476 3 728.0033 99 47517 30349 842 49 743 a-a-CH3DCH2OH
332228.3192 1.4836 -4.2121 3 768.6010101 47517 30350 941 50 842 a-a-CH3DCH2OH
332389.4916 0.2845 -3.9178 3 459.3259 81 47517 30340 437 40 338 a-a-CH3DCH2OH
332548.8390 0.1902 -3.6242 3 392.2361 71 47517 30335 827 35 728 a-a-CH3DCH2OH
332572.9149 0.3268 -4.4509 3 546.1335 85 47517 30342 835 41 932 a-a-CH3DCH2OH
332599.9368 0.5134 -4.0068 3 563.7075 89 47517 30344 440 44 341 a-a-CH3DCH2OH
332695.0295 0.2327 -3.6785 3 433.3425 75 47517 30337 830 37 731 a-a-CH3DCH2OH
332805.7741 0.1639 -3.9386 3 384.7088 75 47517 30337 235 37 136 a-a-CH3DCH2OH
333216.3968 0.1638 -3.9376 3 384.7093 75 47517 30337 335 37 236 a-a-CH3DCH2OH
333219.8664 0.0037 -3.0648 3 112.8421 43 47517 30321 021 20 120 a-a-CH3DCH2OH
333550.1862 0.0108 -5.1586 3 82.5896 35 47517 30317 314 17 017 a-a-CH3DCH2OH
333573.2699 0.0037 -3.0638 3 112.8352 43 47517 30321 121 20 020 a-a-CH3DCH2OH
333869.4778 0.5686 -4.6709 3 469.2743 81 47517 30340 536 39 633 a-a-CH3DCH2OH
334029.7535 0.2065 -3.6471 3 412.4531 73 47517 30336 829 36 730 a-a-CH3DCH2OH
334357.1152 0.3446 -4.4877 3 425.0859 77 47517 30338 534 37 631 a-a-CH3DCH2OH
334389.7244 0.1395 -4.2465 3 412.5988 75 47517 30337 632 36 729 a-a-CH3DCH2OH
334441.4821 0.0060 -3.5552 3 63.1565 31 47517 30315 313 14 212 a-a-CH3DCH2OH
334540.4681 0.0034 -3.2254 3 107.9215 41 47517 30320 219 19 118 a-a-CH3DCH2OH
334558.8118 0.8790 -4.1913 3 756.1498101 47517 30350 843 50 744 a-a-CH3DCH2OH
334691.6335 0.1654 -3.5941 3 372.4564 69 47517 30334 826 34 727 a-a-CH3DCH2OH
335278.3474 0.4459 -4.5734 3 446.8762 79 47517 30339 535 38 632 a-a-CH3DCH2OH
335289.0896 0.5258 -4.5974 3 632.9495 91 47517 30345 937 441034 a-a-CH3DCH2OH
335350.0946 0.1825 -3.6174 3 392.1343 71 47517 30335 828 35 729 a-a-CH3DCH2OH
335619.1221 0.0092 -4.7072 3 97.4505 37 47517 30318 414 18 117 a-a-CH3DCH2OH
336451.7072 0.5443 -4.5942 3 632.9476 91 47517 30345 936 441035 a-a-CH3DCH2OH
336534.8809 0.1436 -3.5664 3 353.2569 67 47517 30333 825 33 726 a-a-CH3DCH2OH
336581.5344 0.3671 -4.4397 3 546.1258 85 47517 30342 834 41 933 a-a-CH3DCH2OH
336632.2686 0.1605 -3.5894 3 372.3863 69 47517 30334 827 34 728 a-a-CH3DCH2OH
336871.0698 0.6927 -4.0820 3 651.5366 95 47517 30347 642 47 543 a-a-CH3DCH2OH
336910.5880 4.5634 -4.7106 3 1032.9386119 47517 30359 752 59 653 a-a-CH3DCH2OH
337486.6028 4.9180 -5.6896 3 850.3978109 47517 30354 649 53 746 a-a-CH3DCH2OH
337599.3427 0.9715 -4.1983 3 744.8887101 47517 30350 744 50 645 a-a-CH3DCH2OH
337858.3021 0.1406 -3.5632 3 353.2093 67 47517 30333 826 33 727 a-a-CH3DCH2OH
338016.1974 0.9870 -4.2354 3 784.8342103 47517 30351 844 51 745 a-a-CH3DCH2OH
338127.3587 0.1244 -3.5409 3 334.6350 65 47517 30332 824 32 725 a-a-CH3DCH2OH
338947.8160 0.0320 -3.8732 3 232.0317 57 47517 30328 424 27 523 a-a-CH3DCH2OH
339015.4021 0.1226 -3.5388 3 334.6033 65 47517 30332 825 32 726 a-a-CH3DCH2OH
339298.2240 0.0300 -3.4389 3 136.3894 45 -47517 30322 220 21 319 a-a-CH3DCH2OH
339350.2331 4.3679 -4.7718 3 1095.3070121 47517 303601050 60 951 a-a-CH3DCH2OH
339442.2049 0.0300 -3.2029 3 119.0805 43 -47517 30321 120 20 219 a-a-CH3DCH2OH
339509.2084 0.1076 -3.5177 3 316.5887 63 47517 30331 823 31 724 a-a-CH3DCH2OH
339845.2209 1.2931 -4.1477 3 740.0809 99 47517 30349 940 49 841 a-a-CH3DCH2OH
339957.6571 0.4789 -3.9892 3 563.7318 89 47517 30344 540 44 441 a-a-CH3DCH2OH
340067.8930 0.0300 -4.2847 3 36.2547 25 -47517 30312 210 11 111 a-a-CH3DCH2OH
340095.2304 0.1065 -3.5163 3 316.5678 63 47517 30331 824 31 725 a-a-CH3DCH2OH
340713.0953 0.0927 -3.4967 3 299.1162 61 47517 30330 822 30 723 a-a-CH3DCH2OH
340725.2527 0.2631 -4.2918 3 465.8554 79 47517 30339 732 38 831 a-a-CH3DCH2OH
340894.6403 1.0854 -4.1793 3 705.0316 99 47517 30349 544 49 445 a-a-CH3DCH2OH
341093.1461 0.0921 -3.4958 3 299.1027 61 47517 30330 823 30 724 a-a-CH3DCH2OH
341197.9144 0.3286 -3.9413 3 481.5247 83 47517 30341 338 41 239 a-a-CH3DCH2OH
341660.3918 0.1251 -4.1123 3 334.2654 71 47517 30335 134 35 035 a-a-CH3DCH2OH
341695.6298 0.1251 -4.1122 3 334.2654 71 47517 30335 234 35 135 a-a-CH3DCH2OH
341765.4433 0.0797 -3.4778 3 282.2160 59 47517 30329 821 29 722 a-a-CH3DCH2OH
342007.4697 0.0793 -3.4772 3 282.2075 59 47517 30329 822 29 723 a-a-CH3DCH2OH
342139.8464 1.1128 -4.2798 3 814.0531105 47517 30352 845 52 746 a-a-CH3DCH2OH
342517.4628 2.3106 -4.4161 3 861.4878109 47517 30354 648 54 549 a-a-CH3DCH2OH
342687.6045 0.0682 -3.4610 3 265.8870 57 47517 30328 820 28 721 a-a-CH3DCH2OH
342838.8070 0.0680 -3.4607 3 265.8816 57 47517 30328 821 28 722 a-a-CH3DCH2OH
342903.0137 0.3262 -3.9373 3 481.5285 83 47517 30341 438 41 339 a-a-CH3DCH2OH
343368.7214 0.1914 -3.9540 3 405.0097 77 47517 30338 236 38 137 a-a-CH3DCH2OH
343385.3550 0.0300 -3.4533 3 28.0889 17 -47517 303 8 5 4 7 4 3 a-a-CH3DCH2OH
343388.4453 0.0300 -3.4533 3 28.0888 17 -47517 303 8 5 3 7 4 4 a-a-CH3DCH2OH
343496.8912 0.0582 -3.4465 3 250.1278 55 47517 30327 819 27 720 a-a-CH3DCH2OH
343589.4559 0.0581 -3.4463 3 250.1246 55 47517 30327 820 27 721 a-a-CH3DCH2OH
343665.0485 0.1913 -3.9533 3 405.0101 77 47517 30338 336 38 237 a-a-CH3DCH2OH
344207.4482 0.0495 -3.4342 3 234.9378 53 47517 30326 818 26 719 a-a-CH3DCH2OH
344262.9055 0.0495 -3.4340 3 234.9358 53 47517 30326 819 26 720 a-a-CH3DCH2OH
344404.2410 0.0300 -3.5138 3 71.7955 33 -47517 30316 314 15 213 a-a-CH3DCH2OH
344712.0334 0.5738 -4.0276 3 588.3360 91 47517 30345 441 45 342 a-a-CH3DCH2OH
344830.9632 0.0421 -3.4241 3 220.3159 51 47517 30325 817 25 718 a-a-CH3DCH2OH
344863.4307 0.0420 -3.4240 3 220.3148 51 47517 30325 818 25 719 a-a-CH3DCH2OH
344933.0408 0.0300 -4.6695 3 107.9215 39 -47517 30319 415 19 118 a-a-CH3DCH2OH
345377.2320 0.0356 -3.4164 3 206.2614 49 47517 30324 816 24 717 a-a-CH3DCH2OH
345395.7745 0.0356 -3.4164 3 206.2608 49 47517 30324 817 24 718 a-a-CH3DCH2OH
345672.2325 1.1004 -4.2351 3 773.3038103 47517 30351 745 51 646 a-a-CH3DCH2OH
345762.9087 0.0300 -3.5053 3 37.8772 23 -47517 30311 4 8 10 3 7 a-a-CH3DCH2OH
345854.5976 0.0302 -3.4112 3 192.7737 47 47517 30323 815 23 716 a-a-CH3DCH2OH
345864.9073 0.0302 -3.4112 3 192.7734 47 47517 30323 816 23 717 a-a-CH3DCH2OH
346032.9636 0.2164 -4.3197 3 487.8842 81 47517 30340 734 39 831 a-a-CH3DCH2OH
346270.2853 0.0256 -3.4087 3 179.8522 45 47517 30322 814 22 715 a-a-CH3DCH2OH
346275.8531 0.0256 -3.4087 3 179.8520 45 47517 30322 815 22 716 a-a-CH3DCH2OH
346364.0255 0.0967 -4.0084 3 306.8688 65 47517 30332 527 31 626 a-a-CH3DCH2OH
346603.8431 0.7836 -4.1122 3 678.0600 97 47517 30348 643 48 544 a-a-CH3DCH2OH
346630.6538 0.0218 -3.4089 3 167.4962 43 47517 30321 813 21 714 a-a-CH3DCH2OH
346633.5665 0.0218 -3.4089 3 167.4961 43 47517 30321 814 21 715 a-a-CH3DCH2OH
346640.7430 1.1247 -4.0867 3 712.1727 97 47517 30348 939 48 840 a-a-CH3DCH2OH
346934.7922 1.2579 -4.3246 3 843.8035107 47517 30353 846 53 747 a-a-CH3DCH2OH
346941.3814 0.0186 -3.4121 3 155.7052 41 47517 30320 812 20 713 a-a-CH3DCH2OH
346942.8528 0.0186 -3.4121 3 155.7051 41 47517 30320 813 20 714 a-a-CH3DCH2OH
347207.6013 0.0160 -3.4187 3 144.4788 39 47517 30319 811 19 712 a-a-CH3DCH2OH
347208.3163 0.0160 -3.4187 3 144.4788 39 47517 30319 812 19 713 a-a-CH3DCH2OH
347433.9998 0.0139 -3.4289 3 133.8164 37 47517 30318 810 18 711 a-a-CH3DCH2OH
347434.3325 0.0139 -3.4289 3 133.8164 37 47517 30318 811 18 712 a-a-CH3DCH2OH
347460.1800 0.0300 -3.5030 3 37.8244 23 -47517 30311 4 7 10 3 8 a-a-CH3DCH2OH
347624.8866 0.0122 -3.4432 3 123.7177 35 47517 30317 8 9 17 710 a-a-CH3DCH2OH
347625.0341 0.0122 -3.4432 3 123.7177 35 47517 30317 810 17 711 a-a-CH3DCH2OH
347784.2959 0.0300 -3.4624 3 114.1823 33 -47517 30316 8 8 16 7 9 a-a-CH3DCH2OH
347784.2959 0.0300 -3.4624 3 114.1823 33 -47517 30316 8 9 16 710 a-a-CH3DCH2OH
347915.7973 0.0300 -3.4873 3 105.2097 31 -47517 30315 8 7 15 7 8 a-a-CH3DCH2OH
347915.7973 0.0300 -3.4873 3 105.2097 31 -47517 30315 8 8 15 7 9 a-a-CH3DCH2OH
348022.9084 0.0300 -3.5191 3 96.7996 29 -47517 30314 8 6 14 7 7 a-a-CH3DCH2OH
348022.9084 0.0300 -3.5191 3 96.7996 29 -47517 30314 8 7 14 7 8 a-a-CH3DCH2OH
348108.7745 0.0300 -3.5599 3 88.9517 27 -47517 30313 8 5 13 7 6 a-a-CH3DCH2OH
348108.7745 0.0300 -3.5599 3 88.9517 27 -47517 30313 8 6 13 7 7 a-a-CH3DCH2OH
348176.3748 0.0300 -3.6125 3 81.6656 25 -47517 30312 8 4 12 7 5 a-a-CH3DCH2OH
348176.3748 0.0300 -3.6125 3 81.6656 25 -47517 30312 8 5 12 7 6 a-a-CH3DCH2OH
348228.3421 0.0300 -3.6824 3 74.9411 23 -47517 30311 8 3 11 7 4 a-a-CH3DCH2OH
348228.3421 0.0300 -3.6824 3 74.9411 23 -47517 30311 8 4 11 7 5 a-a-CH3DCH2OH
348267.2668 0.0300 -3.7792 3 68.7779 21 -47517 30310 8 2 10 7 3 a-a-CH3DCH2OH
348267.2668 0.0300 -3.7792 3 68.7779 21 -47517 30310 8 3 10 7 4 a-a-CH3DCH2OH
348295.4631 0.0110 -3.9256 3 63.1758 19 47517 303 9 8 1 9 7 2 a-a-CH3DCH2OH
348295.4631 0.0110 -3.9256 3 63.1758 19 47517 303 9 8 2 9 7 3 a-a-CH3DCH2OH
348314.8413 0.0300 -4.1947 3 58.1345 17 -47517 303 8 8 0 8 7 1 a-a-CH3DCH2OH
348314.8413 0.0300 -4.1947 3 58.1345 17 -47517 303 8 8 1 8 7 2 a-a-CH3DCH2OH
348616.0320 0.0300 -3.1777 3 118.9055 43 -47517 30321 220 20 119 a-a-CH3DCH2OH
348879.1765 0.0300 -3.0256 3 123.9620 45 -47517 30322 022 21 121 a-a-CH3DCH2OH
349124.1300 0.0300 -3.0249 3 123.9571 45 -47517 30322 122 21 021 a-a-CH3DCH2OH
349257.0542 0.1714 -4.2524 3 433.5478 77 47517 30338 633 37 730 a-a-CH3DCH2OH
349536.8985 0.0300 -3.6473 3 181.0915 51 -47517 30325 322 24 421 a-a-CH3DCH2OH
349547.5512 0.0075 -5.4889 3 15.4990 17 47517 303 8 3 6 7 0 7 a-a-CH3DCH2OH
349608.2969 3.9584 -4.6901 3 1060.9994119 47517 303591049 59 950 a-a-CH3DCH2OH
350382.7046 0.5444 -4.0144 3 588.3539 91 47517 30345 541 45 442 a-a-CH3DCH2OH
351151.3226 0.3640 -4.4425 3 569.7844 87 47517 30343 836 42 933 a-a-CH3DCH2OH
351768.7583 0.0054 -3.6857 3 46.5341 27 47517 30313 310 12 211 a-a-CH3DCH2OH
352028.0060 0.1569 -4.1259 3 353.1837 73 47517 30336 135 36 036 a-a-CH3DCH2OH
352052.5777 0.1569 -4.1258 3 353.1837 73 47517 30336 235 36 136 a-a-CH3DCH2OH
352167.7290 0.3745 -3.9615 3 504.2457 85 47517 30342 339 42 240 a-a-CH3DCH2OH
352387.8077 4.3670 -5.5483 3 819.9340107 47517 30353 648 52 745 a-a-CH3DCH2OH
352395.3499 1.4235 -4.3699 3 874.0823109 47517 30354 847 54 748 a-a-CH3DCH2OH
352627.8822 0.9797 -4.0288 3 684.8729 95 47517 30347 938 47 839 a-a-CH3DCH2OH
352893.1145 0.1974 -4.1381 3 392.1343 73 47517 30336 630 35 729 a-a-CH3DCH2OH
353434.4048 0.3724 -3.9585 3 504.2484 85 47517 30342 439 42 340 a-a-CH3DCH2OH
353780.9506 4.8110 -4.7419 3 1066.4198121 47517 30360 753 60 654 a-a-CH3DCH2OH
353893.0061 0.2232 -3.9714 3 425.8289 79 47517 30339 237 39 138 a-a-CH3DCH2OH
353916.1860 0.5803 -4.5922 3 658.2560 93 47517 30346 938 451035 a-a-CH3DCH2OH
354000.2483 0.0061 -3.4723 3 81.0001 35 47517 30317 315 16 214 a-a-CH3DCH2OH
354106.1345 0.2231 -3.9709 3 425.8291 79 47517 30339 337 39 238 a-a-CH3DCH2OH
354223.3989 1.2408 -4.2729 3 802.2375105 47517 30352 746 52 647 a-a-CH3DCH2OH
354337.8903 1.1674 -4.2042 3 732.6037101 47517 30350 545 50 446 a-a-CH3DCH2OH
355592.7217 0.6104 -4.5879 3 658.2530 93 47517 30346 937 451036 a-a-CH3DCH2OH
356187.1328 0.1000 -3.1522 3 130.5341 45 -47517 30322 121 21 220 a-a-CH3DCH2OH
356272.2184 0.0074 -3.3594 3 27.7779 13 47517 303 6 6 1 5 5 0 a-a-CH3DCH2OH
356272.2187 0.0074 -3.3594 3 27.7779 13 47517 303 6 6 0 5 5 1 a-a-CH3DCH2OH
356547.5031 0.6409 -4.0512 3 613.4791 93 47517 30346 442 46 343 a-a-CH3DCH2OH
356586.1343 0.8823 -4.1437 3 705.0995 99 47517 30349 644 49 545 a-a-CH3DCH2OH
356623.4002 0.0108 -4.6510 3 118.9055 41 47517 30320 416 20 119 a-a-CH3DCH2OH
356784.0736 0.4284 -4.4274 3 569.7728 87 47517 30343 835 42 934 a-a-CH3DCH2OH
357153.2276 0.0122 -5.1992 3 92.1515 37 47517 30318 315 18 018 a-a-CH3DCH2OH
357692.4193 2.4273 -4.4441 3 892.0089111 47517 30355 649 55 550 a-a-CH3DCH2OH
357855.8273 0.8567 -3.9742 3 658.1775 93 47517 30346 937 46 838 a-a-CH3DCH2OH
358505.5599 1.6098 -4.4156 3 904.8868111 47517 30355 848 55 749 a-a-CH3DCH2OH
359293.2026 3.5332 -4.6108 3 1027.3053117 47517 303581048 58 949 a-a-CH3DCH2OH
360134.2400 0.0054 -3.4097 3 32.5747 19 47517 303 9 5 5 8 4 4 a-a-CH3DCH2OH
360143.5246 0.0054 -3.4097 3 32.5744 19 47517 303 9 5 4 8 4 5 a-a-CH3DCH2OH
360613.7282 0.0300 -3.3605 3 148.6417 47 -47517 30323 221 22 320 a-a-CH3DCH2OH
360889.4627 0.6161 -4.0413 3 613.4921 93 47517 30346 542 46 443 a-a-CH3DCH2OH
361533.8068 0.0050 -3.4675 3 44.0918 25 47517 30312 4 9 11 3 8 a-a-CH3DCH2OH
362383.9585 0.1941 -4.1414 3 372.6209 75 47517 30337 136 37 037 a-a-CH3DCH2OH
362395.4096 0.7527 -3.9226 3 632.0822 91 47517 30345 936 45 837 a-a-CH3DCH2OH
362401.0568 0.1941 -4.1414 3 372.6209 75 47517 30337 236 37 137 a-a-CH3DCH2OH
363022.5604 0.0300 -3.1344 3 130.4031 45 -47517 30322 221 21 120 a-a-CH3DCH2OH
363036.0652 0.4255 -3.9838 3 527.4836 87 47517 30343 340 43 241 a-a-CH3DCH2OH
363052.7527 0.2148 -4.2675 3 455.0871 79 47517 30339 634 38 731 a-a-CH3DCH2OH
363100.8899 0.3256 -4.2714 3 487.8416 81 47517 30340 733 39 832 a-a-CH3DCH2OH
363202.1415 1.3924 -4.3116 3 831.6884107 47517 30353 747 53 648 a-a-CH3DCH2OH
363352.8871 0.0061 -3.4306 3 90.7637 37 47517 30318 316 17 215 a-a-CH3DCH2OH
363605.3046 0.2445 -4.3165 3 510.4608 83 47517 30341 735 40 832 a-a-CH3DCH2OH
363972.9173 0.4238 -3.9817 3 527.4855 87 47517 30343 440 43 341 a-a-CH3DCH2OH
364111.9309 1.1462 -4.2422 3 825.4657105 47517 30352 944 52 845 a-a-CH3DCH2OH
364309.8409 1.0637 -4.1909 3 796.1092103 47517 30351 943 51 844 a-a-CH3DCH2OH
364344.7921 1.2372 -4.2943 3 855.3760107 47517 30353 945 53 846 a-a-CH3DCH2OH
364384.4177 0.2598 -3.9906 3 447.1661 81 47517 30340 238 40 139 a-a-CH3DCH2OH
364483.1751 0.0049 -3.4639 3 44.0010 25 47517 30312 4 8 11 3 9 a-a-CH3DCH2OH
364519.8238 0.0300 -2.9904 3 135.6027 47 -47517 30323 023 22 122 a-a-CH3DCH2OH
364537.2334 0.2597 -3.9903 3 447.1663 81 47517 30340 338 40 239 a-a-CH3DCH2OH
364689.0620 0.0300 -2.9900 3 135.5993 47 -47517 30323 123 22 022 a-a-CH3DCH2OH
364879.2453 0.9872 -4.1403 3 767.3095101 47517 30350 942 50 843 a-a-CH3DCH2OH
365064.9009 1.3400 -4.3470 3 885.8370109 47517 30354 946 54 847 a-a-CH3DCH2OH
365240.0064 1.8169 -4.4618 3 936.2144113 47517 30356 849 56 750 a-a-CH3DCH2OH
365759.9336 0.9152 -4.0906 3 739.0694 99 47517 30349 941 49 842 a-a-CH3DCH2OH
366190.3462 3.8283 -5.4089 3 790.0227105 47517 30352 647 51 744 a-a-CH3DCH2OH
366324.0950 1.4588 -4.4002 3 916.8453111 47517 30355 947 55 848 a-a-CH3DCH2OH
366327.0292 0.6647 -3.8738 3 606.5823 89 47517 30344 935 44 836 a-a-CH3DCH2OH
366744.6019 0.0419 -3.8009 3 247.8282 59 47517 30329 425 28 524 a-a-CH3DCH2OH
366772.6306 0.9890 -4.1766 3 732.6545101 47517 30350 645 50 546 a-a-CH3DCH2OH
366892.5584 0.8467 -4.0420 3 711.3913 97 47517 30348 940 48 841 a-a-CH3DCH2OH
367348.2117 1.2580 -4.2322 3 760.6865103 47517 30351 546 51 447 a-a-CH3DCH2OH
368148.3637 0.7153 -4.0772 3 639.1368 95 47517 30347 443 47 344 a-a-CH3DCH2OH
368167.8639 1.5982 -4.4539 3 948.3975113 47517 30356 948 56 849 a-a-CH3DCH2OH
368220.2639 0.7811 -3.9945 3 684.2775 95 47517 30347 939 47 840 a-a-CH3DCH2OH
368246.7500 3.1211 -4.5343 3 994.2260115 47517 303571047 57 948 a-a-CH3DCH2OH
369690.0676 0.7183 -3.9482 3 657.7299 93 47517 30346 938 46 839 a-a-CH3DCH2OH
369703.0449 0.4038 -4.4386 3 594.0068 89 47517 30344 837 43 934 a-a-CH3DCH2OH
369731.8348 0.5895 -3.8277 3 581.6739 87 47517 30343 934 43 835 a-a-CH3DCH2OH
369922.3965 0.0074 -5.2544 3 19.8709 19 47517 303 9 3 7 8 0 8 a-a-CH3DCH2OH
370633.8534 1.7630 -4.5080 3 980.4901115 47517 30357 949 57 850 a-a-CH3DCH2OH
370797.2940 0.0125 -4.6499 3 130.4031 43 47517 30321 417 21 120 a-a-CH3DCH2OH
371253.9353 0.6585 -3.9031 3 631.7498 91 47517 30345 937 45 838 a-a-CH3DCH2OH
371453.5141 0.6946 -4.0699 3 639.1463 95 47517 30347 543 47 444 a-a-CH3DCH2OH
372314.7525 0.0087 -4.2972 3 42.6699 27 47517 30313 211 12 112 a-a-CH3DCH2OH
372337.7094 2.5443 -4.4754 3 923.0352113 47517 30356 650 56 551 a-a-CH3DCH2OH
372556.4477 1.5550 -4.3513 3 861.6552109 47517 30354 748 54 649 a-a-CH3DCH2OH
372564.9593 2.0442 -4.5087 3 968.0627115 47517 30357 850 57 751 a-a-CH3DCH2OH
372598.5042 0.0061 -3.3887 3 101.0792 39 47517 30319 317 18 216 a-a-CH3DCH2OH
372622.2555 0.6395 -4.5912 3 684.1307 95 47517 30347 939 461036 a-a-CH3DCH2OH
372654.3799 0.1000 -3.1079 3 142.5122 47 -47517 30323 122 22 221 a-a-CH3DCH2OH
372686.0657 0.5245 -3.7841 3 557.3530 85 47517 30342 933 42 834 a-a-CH3DCH2OH
372728.9472 0.2372 -4.1587 3 392.5768 77 47517 30338 137 38 038 a-a-CH3DCH2OH
372740.8221 0.2372 -4.1587 3 392.5768 77 47517 30338 237 38 138 a-a-CH3DCH2OH
372869.5167 0.6016 -3.8595 3 606.3388 89 47517 30344 936 44 837 a-a-CH3DCH2OH
373059.3984 0.0072 -3.3235 3 31.1386 15 47517 303 7 6 2 6 5 1 a-a-CH3DCH2OH
373059.4019 0.0072 -3.3235 3 31.1386 15 47517 303 7 6 1 6 5 2 a-a-CH3DCH2OH
373750.6600 1.9576 -4.5625 3 1013.1197117 47517 30358 950 58 851 a-a-CH3DCH2OH
373820.2070 0.4821 -4.0081 3 551.2382 89 47517 30344 341 44 242 a-a-CH3DCH2OH
374083.6081 0.1239 -3.9568 3 324.9362 67 47517 30333 528 32 627 a-a-CH3DCH2OH
374500.5401 0.5479 -3.8173 3 581.4976 87 47517 30343 935 43 836 a-a-CH3DCH2OH
374510.3342 0.4807 -4.0066 3 551.2395 89 47517 30344 441 44 342 a-a-CH3DCH2OH
374847.4272 0.3016 -4.0118 3 469.0212 83 47517 30341 239 41 140 a-a-CH3DCH2OH
374956.6852 0.3016 -4.0115 3 469.0213 83 47517 30341 339 41 240 a-a-CH3DCH2OH
375013.5894 0.6876 -4.5852 3 684.1262 95 47517 30347 938 461037 a-a-CH3DCH2OH
375040.5458 0.0060 -3.6758 3 53.7283 29 47517 30314 311 13 212 a-a-CH3DCH2OH
375147.7864 0.0300 -3.5637 3 195.1433 53 -47517 30326 323 25 422 a-a-CH3DCH2OH
375257.9827 0.4677 -3.7428 3 533.6162 83 47517 30341 932 41 833 a-a-CH3DCH2OH
375558.9485 0.2745 -4.2923 3 477.2208 81 47517 30340 635 39 732 a-a-CH3DCH2OH
376116.8865 0.4975 -3.7766 3 557.2269 85 47517 30342 934 42 835 a-a-CH3DCH2OH
376380.3662 2.7413 -4.4609 3 961.7608113 47517 303561046 56 947 a-a-CH3DCH2OH
376841.5841 0.0052 -3.4346 3 50.8872 27 47517 30313 410 12 3 9 a-a-CH3DCH2OH
376854.7929 0.0054 -3.3690 3 37.6236 21 47517 30310 5 6 9 4 5 a-a-CH3DCH2OH
376878.9756 0.0054 -3.3689 3 37.6228 21 47517 30310 5 5 9 4 6 a-a-CH3DCH2OH
377122.1120 1.1041 -4.2111 3 760.7243103 47517 30351 646 51 547 a-a-CH3DCH2OH
377506.6717 0.4176 -3.7038 3 510.4608 81 47517 30340 931 40 832 a-a-CH3DCH2OH
377522.2086 0.5045 -4.4186 3 593.9896 89 47517 30344 836 43 935 a-a-CH3DCH2OH
377536.9671 2.1857 -4.6174 3 1046.2830119 47517 30359 951 59 852 a-a-CH3DCH2OH
377694.3906 0.4504 -3.7375 3 533.5273 83 47517 30341 933 41 834 a-a-CH3DCH2OH
377702.2530 0.0300 -3.0953 3 142.4152 47 -47517 30323 222 22 121 a-a-CH3DCH2OH
378600.4924 3.3113 -5.2723 3 760.6750103 47517 30351 646 50 743 a-a-CH3DCH2OH
378720.9546 0.2517 -4.1056 3 412.4531 75 47517 30337 631 36 730 a-a-CH3DCH2OH
379214.4245 0.4066 -3.7001 3 510.3988 81 47517 30340 932 40 833 a-a-CH3DCH2OH
379482.0593 0.3730 -3.6668 3 487.8842 79 47517 30339 930 39 831 a-a-CH3DCH2OH
379552.0657 0.7974 -4.1057 3 665.3092 97 47517 30348 444 48 345 a-a-CH3DCH2OH
379970.9981 1.3589 -4.2631 3 789.2805105 47517 30352 547 52 448 a-a-CH3DCH2OH
380146.4644 0.0300 -2.9591 3 147.7640 49 -47517 30324 024 23 123 a-a-CH3DCH2OH
380263.0280 0.0300 -2.9588 3 147.7617 49 -47517 30324 124 23 023 a-a-CH3DCH2OH
380439.7751 2.2908 -4.5562 3 1000.4296117 47517 30358 851 58 752 a-a-CH3DCH2OH
380663.3301 0.3661 -3.6643 3 487.8416 79 47517 30339 931 39 832 a-a-CH3DCH2OH
380750.7225 0.2771 -4.3193 3 533.6162 85 47517 30342 736 41 833 a-a-CH3DCH2OH
381170.0808 0.0300 -3.2918 3 161.4315 49 -47517 30324 222 23 321 a-a-CH3DCH2OH
381225.6236 0.3331 -3.6319 3 465.8843 77 47517 30338 929 38 830 a-a-CH3DCH2OH
381700.5212 0.0051 -3.4296 3 50.7393 27 47517 30313 4 9 12 310 a-a-CH3DCH2OH
381883.7656 0.0060 -3.3469 3 111.9389 41 47517 30320 318 19 217 a-a-CH3DCH2OH
382001.0580 2.4496 -4.6726 3 1079.9765121 47517 30360 952 60 853 a-a-CH3DCH2OH
382031.7640 0.3288 -3.6302 3 465.8554 77 47517 30338 930 38 831 a-a-CH3DCH2OH
382054.7227 0.7803 -4.1003 3 665.3161 97 47517 30348 544 48 445 a-a-CH3DCH2OH
382234.5879 1.7285 -4.3922 3 892.1368111 47517 30355 749 55 650 a-a-CH3DCH2OH
382771.4361 0.2973 -3.5990 3 444.4594 75 47517 30337 928 37 829 a-a-CH3DCH2OH
382899.9356 0.0140 -5.2472 3 102.2333 39 47517 30319 316 19 019 a-a-CH3DCH2OH
383063.4795 0.2869 -4.1778 3 413.0512 79 47517 30339 138 39 039 a-a-CH3DCH2OH
383071.7120 0.2869 -4.1778 3 413.0512 79 47517 30339 238 39 139 a-a-CH3DCH2OH
383314.0098 0.2946 -3.5978 3 444.4400 75 47517 30337 929 37 830 a-a-CH3DCH2OH
383666.3141 2.4042 -4.3905 3 929.9075111 47517 303551045 55 946 a-a-CH3DCH2OH
384147.3009 0.2650 -3.5679 3 423.6080 73 47517 30336 927 36 828 a-a-CH3DCH2OH
384507.3052 0.2634 -3.5672 3 423.5952 73 47517 30336 928 36 829 a-a-CH3DCH2OH
384533.9998 0.5449 -4.0344 3 575.5094 91 47517 30345 342 45 243 a-a-CH3DCH2OH
385040.5031 0.5436 -4.0333 3 575.5103 91 47517 30345 442 45 343 a-a-CH3DCH2OH
385285.4837 0.3494 -4.0347 3 491.3940 85 47517 30342 240 42 141 a-a-CH3DCH2OH
385363.3932 0.3494 -4.0346 3 491.3941 85 47517 30342 340 42 241 a-a-CH3DCH2OH
385375.8548 0.2359 -3.5388 3 403.3287 71 47517 30335 926 35 827 a-a-CH3DCH2OH
385611.2166 0.2349 -3.5383 3 403.3204 71 47517 30335 927 35 828 a-a-CH3DCH2OH
386442.9141 0.4052 -4.2540 3 510.3988 83 47517 30341 734 40 833 a-a-CH3DCH2OH
386457.0993 2.6672 -4.5099 3 954.5675115 47517 30357 651 57 552 a-a-CH3DCH2OH
386475.5572 0.2097 -3.5116 3 383.6205 69 47517 30334 925 34 826 a-a-CH3DCH2OH
386546.5583 0.3558 -4.3276 3 499.9533 83 47517 30341 636 40 733 a-a-CH3DCH2OH
386627.0824 0.2091 -3.5113 3 383.6152 69 47517 30334 926 34 827 a-a-CH3DCH2OH
387461.5400 0.1861 -3.4863 3 364.4825 67 47517 30333 924 33 825 a-a-CH3DCH2OH
387527.4556 0.0151 -4.6647 3 142.4152 45 47517 30322 418 22 121 a-a-CH3DCH2OH
387557.5367 0.1858 -3.4861 3 364.4791 67 47517 30333 925 33 826 a-a-CH3DCH2OH
387597.8981 1.2282 -4.2470 3 789.3086105 47517 30352 647 52 548 a-a-CH3DCH2OH
388175.5553 0.4459 -4.4393 3 618.8017 91 47517 30345 838 44 935 a-a-CH3DCH2OH
388346.3137 0.1650 -3.4629 3 345.9137 65 47517 30332 923 32 824 a-a-CH3DCH2OH
388406.1152 0.1648 -3.4627 3 345.9116 65 47517 30332 924 32 825 a-a-CH3DCH2OH
388818.4771 2.5556 -4.6045 3 1033.3134119 47517 30359 852 59 753 a-a-CH3DCH2OH
388901.8489 0.1000 -3.0690 3 155.0140 49 -47517 30324 123 23 222 a-a-CH3DCH2OH
389140.3406 0.1461 -3.4414 3 327.9135 63 47517 30331 922 31 823 a-a-CH3DCH2OH
389176.9393 0.1460 -3.4413 3 327.9122 63 47517 30331 923 31 824 a-a-CH3DCH2OH
389344.4857 2.8242 -5.1397 3 731.9016101 47517 30350 645 49 742 a-a-CH3DCH2OH
389842.3738 0.0069 -3.2874 3 35.0602 17 47517 303 8 6 3 7 5 2 a-a-CH3DCH2OH
389842.3950 0.0069 -3.2874 3 35.0602 17 47517 303 8 6 2 7 5 3 a-a-CH3DCH2OH
389852.4888 0.1293 -3.4218 3 310.4811 61 47517 30330 921 30 822 a-a-CH3DCH2OH
389874.4716 0.1292 -3.4218 3 310.4804 61 47517 30330 922 30 823 a-a-CH3DCH2OH
390124.4847 2.1128 -4.3233 3 898.6627109 47517 303541044 54 945 a-a-CH3DCH2OH
390490.3873 0.1143 -3.4043 3 293.6161 59 47517 30329 920 29 821 a-a-CH3DCH2OH
390503.3314 0.1143 -3.4043 3 293.6156 59 47517 30329 921 29 822 a-a-CH3DCH2OH
390790.8499 0.8878 -4.1363 3 691.9963 99 47517 30349 445 49 346 a-a-CH3DCH2OH
391060.6998 0.1011 -3.3888 3 277.3178 57 47517 30328 919 28 820 a-a-CH3DCH2OH
391068.1621 0.1011 -3.3888 3 277.3175 57 47517 30328 920 28 821 a-a-CH3DCH2OH
391359.5468 0.0300 -3.3056 3 123.3351 43 -47517 30321 319 20 218 a-a-CH3DCH2OH
391390.7881 0.7031 -4.5940 3 710.5742 97 47517 30348 940 471037 a-a-CH3DCH2OH
391479.3930 0.0073 -5.0629 3 24.7661 21 47517 30310 3 8 9 0 9 a-a-CH3DCH2OH
391562.1092 0.0054 -3.4068 3 58.2679 29 47517 30314 411 13 310 a-a-CH3DCH2OH
391569.3318 0.0895 -3.3755 3 261.5857 55 47517 30327 918 27 819 a-a-CH3DCH2OH
391573.5377 0.0895 -3.3755 3 261.5855 55 47517 30327 919 27 820 a-a-CH3DCH2OH
392021.5877 0.0793 -3.3644 3 246.4193 53 47517 30326 917 26 818 a-a-CH3DCH2OH
392023.9014 0.0793 -3.3644 3 246.4192 53 47517 30326 918 26 819 a-a-CH3DCH2OH
392186.5098 1.9130 -4.4344 3 923.1324113 47517 30356 750 56 651 a-a-CH3DCH2OH
392254.9163 1.4713 -4.2967 3 818.3861107 47517 30353 548 53 449 a-a-CH3DCH2OH
392422.2874 0.0705 -3.3555 3 231.8182 51 47517 30325 916 25 817 a-a-CH3DCH2OH
392423.5274 0.0705 -3.3555 3 231.8182 51 47517 30325 917 25 818 a-a-CH3DCH2OH
392600.6315 0.0045 -3.0602 3 154.9426 49 47517 30324 223 23 122 a-a-CH3DCH2OH
392676.8000 0.8738 -4.1324 3 692.0013 99 47517 30349 545 49 446 a-a-CH3DCH2OH
392775.8534 0.0629 -3.3491 3 217.7820 49 47517 30324 915 24 816 a-a-CH3DCH2OH
392776.4994 0.0629 -3.3491 3 217.7819 49 47517 30324 916 24 817 a-a-CH3DCH2OH
393086.3751 0.0564 -3.3453 3 204.3102 47 47517 30323 914 23 815 a-a-CH3DCH2OH
393086.7014 0.0564 -3.3453 3 204.3102 47 47517 30323 915 23 816 a-a-CH3DCH2OH
393357.6562 0.0508 -3.3443 3 191.4025 45 47517 30322 913 22 814 a-a-CH3DCH2OH
393357.8156 0.0508 -3.3443 3 191.4025 45 47517 30322 914 22 815 a-a-CH3DCH2OH
393387.9205 0.3437 -4.1986 3 434.0441 81 47517 30340 139 40 040 a-a-CH3DCH2OH
393393.6184 0.3437 -4.1986 3 434.0441 81 47517 30340 239 40 140 a-a-CH3DCH2OH
393534.4408 0.0055 -3.3314 3 43.2365 23 47517 30311 5 7 10 4 6 a-a-CH3DCH2OH
393590.9225 0.0055 -3.3313 3 43.2347 23 47517 30311 5 6 10 4 7 a-a-CH3DCH2OH
393593.2505 0.0461 -3.3462 3 179.0585 43 47517 30321 912 21 813 a-a-CH3DCH2OH
393593.3255 0.0461 -3.3462 3 179.0585 43 47517 30321 913 21 814 a-a-CH3DCH2OH
393796.4882 0.0422 -3.3515 3 167.2779 41 47517 30320 911 20 812 a-a-CH3DCH2OH
393796.5221 0.0422 -3.3515 3 167.2779 41 47517 30320 912 20 813 a-a-CH3DCH2OH
393970.4957 0.0389 -3.3604 3 156.0604 39 47517 30319 910 19 811 a-a-CH3DCH2OH
393970.5104 0.0389 -3.3604 3 156.0604 39 47517 30319 911 19 812 a-a-CH3DCH2OH
394118.2111 0.0362 -3.3735 3 145.4056 37 47517 30318 9 9 18 810 a-a-CH3DCH2OH
394118.2171 0.0362 -3.3735 3 145.4056 37 47517 30318 910 18 811 a-a-CH3DCH2OH
394242.3954 0.0340 -3.3915 3 135.3133 35 47517 30317 9 8 17 8 9 a-a-CH3DCH2OH
394242.3977 0.0340 -3.3915 3 135.3133 35 47517 30317 9 9 17 810 a-a-CH3DCH2OH
394345.6418 0.0322 -3.4152 3 125.7831 33 47517 30316 9 7 16 8 8 a-a-CH3DCH2OH
394345.6426 0.0322 -3.4152 3 125.7831 33 47517 30316 9 8 16 8 9 a-a-CH3DCH2OH
394430.3828 0.0309 -3.4460 3 116.8149 31 47517 30315 9 6 15 8 7 a-a-CH3DCH2OH
394430.3830 0.0309 -3.4460 3 116.8149 31 47517 30315 9 7 15 8 8 a-a-CH3DCH2OH
394498.8954 0.0299 -3.4858 3 108.4084 29 47517 30314 9 5 14 8 6 a-a-CH3DCH2OH
394498.8955 0.0299 -3.4858 3 108.4084 29 47517 30314 9 6 14 8 7 a-a-CH3DCH2OH
394553.3059 0.0293 -3.5377 3 100.5633 27 47517 30313 9 4 13 8 5 a-a-CH3DCH2OH
394553.3059 0.0293 -3.5377 3 100.5633 27 47517 30313 9 5 13 8 6 a-a-CH3DCH2OH
394595.5925 0.0289 -3.6069 3 93.2795 25 47517 30312 9 3 12 8 4 a-a-CH3DCH2OH
394595.5925 0.0289 -3.6069 3 93.2795 25 47517 30312 9 4 12 8 5 a-a-CH3DCH2OH
394627.5884 0.0288 -3.7035 3 86.5568 23 47517 30311 9 2 11 8 3 a-a-CH3DCH2OH
394627.5884 0.0288 -3.7035 3 86.5568 23 47517 30311 9 3 11 8 4 a-a-CH3DCH2OH
394650.9833 0.0289 -3.8501 3 80.3949 21 47517 30310 9 1 10 8 2 a-a-CH3DCH2OH
394650.9833 0.0289 -3.8501 3 80.3949 21 47517 30310 9 2 10 8 3 a-a-CH3DCH2OH
394667.3251 0.0291 -4.1200 3 74.7937 19 47517 303 9 9 0 9 8 1 a-a-CH3DCH2OH
394667.3251 0.0291 -4.1200 3 74.7937 19 47517 303 9 9 1 9 8 2 a-a-CH3DCH2OH
394765.1662 0.7791 -4.5860 3 710.5674 97 47517 30348 939 471038 a-a-CH3DCH2OH
394775.0498 0.0532 -3.7316 3 264.1861 61 47517 30330 426 29 525 a-a-CH3DCH2OH
395188.4500 0.6142 -4.0626 3 600.2970 93 47517 30346 343 46 244 a-a-CH3DCH2OH
395558.9226 0.6132 -4.0618 3 600.2977 93 47517 30346 443 46 344 a-a-CH3DCH2OH
395701.2492 0.4037 -4.0595 3 514.2844 87 47517 30343 241 43 142 a-a-CH3DCH2OH
395756.6688 0.4037 -4.0593 3 514.2845 87 47517 30343 341 43 242 a-a-CH3DCH2OH
395762.3546 0.0300 -2.9312 3 160.4459 51 -47517 30325 025 24 124 a-a-CH3DCH2OH
395784.8197 0.4648 -4.3738 3 523.2892 85 47517 30342 637 41 734 a-a-CH3DCH2OH
395807.7293 1.8648 -4.2591 3 868.0222107 47517 303531043 53 944 a-a-CH3DCH2OH
395842.3690 0.0300 -2.9311 3 160.4444 51 -47517 30325 125 24 024 a-a-CH3DCH2OH
397330.8944 0.3170 -4.3284 3 557.3530 87 47517 30343 737 42 834 a-a-CH3DCH2OH
397651.4259 2.8375 -4.6537 3 1066.7123121 47517 30360 853 60 754 a-a-CH3DCH2OH
398168.0223 1.3616 -4.2845 3 818.4069107 47517 30353 648 53 549 a-a-CH3DCH2OH
398176.4624 2.3734 -5.0123 3 703.7122 99 47517 30349 644 48 741 a-a-CH3DCH2OH
398898.5324 0.6002 -4.4129 3 618.7764 91 47517 30345 837 44 936 a-a-CH3DCH2OH
399204.7417 0.0053 -3.4002 3 58.0383 29 47517 30314 410 13 311 a-a-CH3DCH2OH
399906.0171 0.0066 -3.6761 3 61.4624 31 47517 30315 312 14 213 a-a-CH3DCH2OH
400079.8183 2.8012 -4.5475 3 986.6069117 47517 30358 652 58 553 a-a-CH3DCH2OH
400291.6036 0.0300 -3.4867 3 209.7452 55 -47517 30327 324 26 423 a-a-CH3DCH2OH
400788.2138 1.6552 -4.1978 3 837.9816105 47517 303521042 52 943 a-a-CH3DCH2OH
400965.8669 0.0300 -3.2324 3 174.7560 51 -47517 30325 223 24 322 a-a-CH3DCH2OH
401170.7093 0.0300 -3.2652 3 135.2601 45 -47517 30322 320 21 219 a-a-CH3DCH2OH
401215.7302 2.3651 -4.6483 3 1092.7187121 47517 303601051 60 952 a-a-CH3DCH2OH
401320.6213 2.2219 -4.5864 3 1058.8762119 47517 303591050 59 951 a-a-CH3DCH2OH
401845.5579 2.0914 -4.5252 3 1025.5867117 47517 303581049 58 950 a-a-CH3DCH2OH
401891.8037 0.9869 -4.1690 3 719.1980101 47517 30350 446 50 347 a-a-CH3DCH2OH
402364.9800 2.1084 -4.4778 3 954.6412115 47517 30357 751 57 652 a-a-CH3DCH2OH
402623.2329 0.1554 -3.9070 3 343.5710 69 47517 30334 529 33 628 a-a-CH3DCH2OH
402731.8095 1.9691 -4.4647 3 992.8531115 47517 303571048 57 949 a-a-CH3DCH2OH
403054.2674 0.6072 -4.4317 3 547.2324 87 47517 30343 638 42 735 a-a-CH3DCH2OH
403306.8218 0.9755 -4.1661 3 719.2016101 47517 30350 546 50 447 a-a-CH3DCH2OH
403702.5273 0.4084 -4.2211 3 455.5551 83 47517 30341 140 41 041 a-a-CH3DCH2OH
403706.4650 0.4084 -4.2211 3 455.5551 83 47517 30341 240 41 141 a-a-CH3DCH2OH
403920.1384 1.8519 -4.4052 3 960.6782113 47517 303561047 56 948 a-a-CH3DCH2OH
404247.3129 1.5962 -4.3328 3 848.0035109 47517 30354 549 54 450 a-a-CH3DCH2OH
404887.3146 1.9641 -4.8915 3 676.1159 97 47517 30348 643 47 740 a-a-CH3DCH2OH
404978.2882 0.1000 -3.0351 3 168.0384 51 -47517 30325 124 24 223 a-a-CH3DCH2OH
405146.3147 1.4777 -4.1391 3 808.5365103 47517 303511041 51 942 a-a-CH3DCH2OH
405352.4584 1.7382 -4.3467 3 929.0645111 47517 303551046 55 947 a-a-CH3DCH2OH
405573.7952 0.0057 -3.3835 3 66.2383 31 47517 30315 412 14 311 a-a-CH3DCH2OH
405729.0883 0.3169 -4.0750 3 433.3425 77 47517 30338 632 37 731 a-a-CH3DCH2OH
405792.2641 0.6908 -4.0925 3 625.6010 95 47517 30347 344 47 245 a-a-CH3DCH2OH
406062.3878 0.6900 -4.0920 3 625.6015 95 47517 30347 444 47 345 a-a-CH3DCH2OH
406096.7813 0.4652 -4.0859 3 537.6922 89 47517 30344 242 44 143 a-a-CH3DCH2OH
406098.9820 0.0093 -4.3128 3 49.6105 29 47517 30314 212 13 113 a-a-CH3DCH2OH
406136.1135 0.4652 -4.0858 3 537.6923 89 47517 30344 342 44 243 a-a-CH3DCH2OH
406502.5654 0.4904 -4.4446 3 644.1704 93 47517 30346 839 45 936 a-a-CH3DCH2OH
406618.2700 0.0068 -3.2523 3 39.5430 19 47517 303 9 6 4 8 5 3 a-a-CH3DCH2OH
406618.3618 0.0068 -3.2523 3 39.5430 19 47517 303 9 6 3 8 5 4 a-a-CH3DCH2OH
406843.2441 0.0190 -4.6931 3 154.9426 47 47517 30323 419 23 122 a-a-CH3DCH2OH
406973.3186 1.6273 -4.2893 3 898.0142109 47517 303541045 54 946 a-a-CH3DCH2OH
407670.0598 0.0300 -3.0289 3 167.9863 51 -47517 30325 224 24 123 a-a-CH3DCH2OH
408162.2835 0.7882 -4.5014 3 571.7862 89 47517 30344 639 43 736 a-a-CH3DCH2OH
408731.1446 1.5190 -4.2331 3 867.5292107 47517 303531044 53 945 a-a-CH3DCH2OH
408805.1768 1.5051 -4.3236 3 848.0189109 47517 30354 649 54 550 a-a-CH3DCH2OH
408962.5923 1.3263 -4.0830 3 779.6829101 47517 303501040 50 941 a-a-CH3DCH2OH
409314.5656 1.5997 -4.7788 3 649.1202 95 47517 30347 642 46 739 a-a-CH3DCH2OH
410156.1170 0.0056 -3.2970 3 49.4144 25 47517 30312 5 8 11 4 7 a-a-CH3DCH2OH
410198.4178 0.7709 -4.6007 3 737.5871 99 47517 30349 941 481038 a-a-CH3DCH2OH
410277.1414 0.0056 -3.2969 3 49.4106 25 47517 30312 5 7 11 4 8 a-a-CH3DCH2OH
410579.1894 1.4138 -4.1781 3 837.6111105 47517 303521043 52 944 a-a-CH3DCH2OH
410650.4476 0.0163 -5.2996 3 112.8352 41 47517 30320 317 20 020 a-a-CH3DCH2OH
410868.7227 0.5052 -4.2390 3 533.5273 85 47517 30342 735 41 834 a-a-CH3DCH2OH
410959.2232 1.0123 -4.5828 3 596.9523 91 47517 30345 640 44 737 a-a-CH3DCH2OH
411352.3071 1.2824 -4.6755 3 622.7310 93 47517 30346 641 45 738 a-a-CH3DCH2OH
411369.7436 0.0300 -2.9068 3 173.6482 53 -47517 30326 026 25 125 a-a-CH3DCH2OH
411424.5720 0.0300 -2.9066 3 173.6471 53 -47517 30326 126 25 025 a-a-CH3DCH2OH
411443.1690 0.0058 -3.2263 3 147.7072 47 47517 30323 321 22 220 a-a-CH3DCH2OH
412312.6595 1.1958 -4.0292 3 751.4169 99 47517 303491039 49 940 a-a-CH3DCH2OH
412476.1731 1.3121 -4.1244 3 808.2612103 47517 303511042 51 943 a-a-CH3DCH2OH
412726.4435 2.3151 -4.5226 3 986.6626117 47517 30358 752 58 653 a-a-CH3DCH2OH
412877.2926 1.0954 -4.2037 3 746.9144103 47517 30351 447 51 348 a-a-CH3DCH2OH
413185.8103 0.3691 -4.3441 3 581.6739 89 47517 30344 738 43 835 a-a-CH3DCH2OH
413249.9072 2.9501 -4.5880 3 1019.1540119 47517 30359 653 59 554 a-a-CH3DCH2OH
413934.7342 1.0862 -4.2016 3 746.9170103 47517 30351 547 51 448 a-a-CH3DCH2OH
414007.4755 0.4817 -4.2453 3 477.5842 85 47517 30342 141 42 042 a-a-CH3DCH2OH
414010.1929 0.4817 -4.2453 3 477.5842 85 47517 30342 241 42 142 a-a-CH3DCH2OH
414305.0850 0.0074 -4.9081 3 30.1813 23 47517 30311 3 9 10 010 a-a-CH3DCH2OH
414386.6133 1.2143 -4.0722 3 779.4806101 47517 303501041 50 942 a-a-CH3DCH2OH
414909.5345 0.8890 -4.5899 3 737.5770 99 47517 30349 940 481039 a-a-CH3DCH2OH
415264.3924 1.0818 -3.9777 3 723.7354 97 47517 303481038 48 939 a-a-CH3DCH2OH
415991.5888 1.7344 -4.3711 3 878.1329111 47517 30355 550 55 451 a-a-CH3DCH2OH
416280.8708 1.1210 -4.0213 3 751.2698 99 47517 303491040 49 941 a-a-CH3DCH2OH
416352.3100 0.7753 -4.1243 3 651.4212 97 47517 30348 345 48 246 a-a-CH3DCH2OH
416473.6740 0.5346 -4.1140 3 561.6173 91 47517 30345 243 45 144 a-a-CH3DCH2OH
416501.5297 0.5345 -4.1140 3 561.6173 91 47517 30345 343 45 244 a-a-CH3DCH2OH
416548.6924 0.7746 -4.1239 3 651.4215 97 47517 30348 445 48 346 a-a-CH3DCH2OH
416721.1456 0.0130 -4.6139 3 147.7072 45 47517 30322 517 22 220 a-a-CH3DCH2OH
417112.0377 0.0056 -3.3759 3 65.8965 31 47517 30315 411 14 312 a-a-CH3DCH2OH
417396.2189 0.0116 -4.6939 3 135.2601 43 47517 30321 516 21 219 a-a-CH3DCH2OH
417876.8311 0.9810 -3.9283 3 696.6353 95 47517 303471037 47 938 a-a-CH3DCH2OH
417974.4038 0.0157 -4.5491 3 160.6705 47 47517 30323 518 23 221 a-a-CH3DCH2OH
418134.9522 1.0324 -3.9720 3 723.6296 97 47517 303481039 48 940 a-a-CH3DCH2OH
418773.0209 0.0061 -3.3644 3 74.8019 33 47517 30316 413 15 312 a-a-CH3DCH2OH
419469.8295 0.0084 -3.1717 3 39.6619 15 47517 303 7 7 0 6 6 1 a-a-CH3DCH2OH
419469.8295 0.0084 -3.1717 3 39.6619 15 47517 303 7 7 1 6 6 0 a-a-CH3DCH2OH
419486.4793 1.6593 -4.3643 3 878.1443111 47517 30355 650 55 551 a-a-CH3DCH2OH
419732.0862 0.0111 -4.7881 3 123.3351 41 47517 30320 515 20 218 a-a-CH3DCH2OH
419930.1221 0.9488 -3.9242 3 696.5600 95 47517 303471038 47 939 a-a-CH3DCH2OH
420038.4233 0.0300 -3.1815 3 188.6129 53 -47517 30326 224 25 323 a-a-CH3DCH2OH
420200.1797 0.8911 -3.8808 3 670.1143 93 47517 303461036 46 937 a-a-CH3DCH2OH
420923.4029 0.1000 -3.0055 3 181.5847 53 -47517 30326 125 25 224 a-a-CH3DCH2OH
421028.7648 0.7210 -4.4100 3 644.1335 93 47517 30346 838 45 937 a-a-CH3DCH2OH
421393.6324 0.0199 -4.5002 3 174.1459 49 47517 30324 519 24 222 a-a-CH3DCH2OH
421652.3819 0.8703 -3.8780 3 670.0614 93 47517 303461037 46 938 a-a-CH3DCH2OH
422271.2705 0.0300 -3.1895 3 160.6705 49 -47517 30324 322 23 221 a-a-CH3DCH2OH
422276.4470 0.8101 -3.8353 3 644.1704 91 47517 303451035 45 936 a-a-CH3DCH2OH
422846.3847 0.0657 -3.6655 3 281.1035 63 47517 30331 427 30 526 a-a-CH3DCH2OH
422870.4628 0.0300 -3.0013 3 181.5470 53 -47517 30326 225 25 124 a-a-CH3DCH2OH
423231.5964 2.5336 -4.5687 3 1019.1959119 47517 30359 753 59 654 a-a-CH3DCH2OH
423291.8703 0.7968 -3.8333 3 644.1335 91 47517 303451036 45 937 a-a-CH3DCH2OH
423383.6161 0.0067 -3.2189 3 44.5875 21 47517 30310 6 5 9 5 4 a-a-CH3DCH2OH
423383.9377 0.0067 -3.2189 3 44.5875 21 47517 30310 6 4 9 5 5 a-a-CH3DCH2OH
423440.8987 0.0111 -4.8954 3 111.9389 39 47517 30319 514 19 217 a-a-CH3DCH2OH
423765.5551 1.2139 -4.2402 3 775.1452105 47517 30352 448 52 349 a-a-CH3DCH2OH
424140.4010 0.7368 -3.7916 3 618.8017 89 47517 303441034 44 935 a-a-CH3DCH2OH
424302.8780 0.5644 -4.2712 3 500.1312 87 47517 30343 142 43 043 a-a-CH3DCH2OH
424304.7508 0.5644 -4.2711 3 500.1312 87 47517 30343 242 43 143 a-a-CH3DCH2OH
424552.8781 1.2064 -4.2387 3 775.1470105 47517 30352 548 52 449 a-a-CH3DCH2OH
424602.1713 0.5373 -4.4545 3 670.1143 95 47517 30347 840 46 937 a-a-CH3DCH2OH
424807.5554 0.0185 -3.4166 3 224.8944 57 47517 30328 325 27 424 a-a-CH3DCH2OH
424842.2348 0.7283 -3.7902 3 618.7764 89 47517 303441035 44 936 a-a-CH3DCH2OH
425820.6247 0.6700 -3.7497 3 594.0068 87 47517 303431033 43 934 a-a-CH3DCH2OH
426017.9568 3.1168 -4.6311 3 1052.2094121 47517 30360 654 60 555 a-a-CH3DCH2OH
426300.0123 0.6647 -3.7488 3 593.9896 87 47517 303431034 43 935 a-a-CH3DCH2OH
426502.5341 0.0072 -3.6859 3 69.7343 33 47517 30316 313 15 214 a-a-CH3DCH2OH
426696.6735 0.0057 -3.2661 3 56.1589 27 47517 30313 5 9 12 4 8 a-a-CH3DCH2OH
426833.1658 0.6125 -4.1438 3 586.0594 93 47517 30346 244 46 145 a-a-CH3DCH2OH
426852.8549 0.6125 -4.1438 3 586.0594 93 47517 30346 344 46 245 a-a-CH3DCH2OH
426874.0006 0.8682 -4.1577 3 677.7573 99 47517 30349 346 49 247 a-a-CH3DCH2OH
426938.3838 0.0057 -3.2657 3 56.1513 27 47517 30313 5 8 12 4 9 a-a-CH3DCH2OH
426970.2328 0.0300 -2.8854 3 187.3708 55 -47517 30327 027 26 126 a-a-CH3DCH2OH
427007.6940 0.0300 -2.8853 3 187.3701 55 -47517 30327 127 26 026 a-a-CH3DCH2OH
427016.3861 0.8677 -4.1574 3 677.7575 99 47517 30349 446 49 347 a-a-CH3DCH2OH
427182.0289 0.0257 -4.4675 3 188.1308 51 47517 30325 520 25 223 a-a-CH3DCH2OH
427340.5483 0.6090 -3.7096 3 569.7844 85 47517 303421032 42 933 a-a-CH3DCH2OH
427525.9806 1.8863 -4.4117 3 908.7744113 47517 30356 551 56 452 a-a-CH3DCH2OH
427664.0517 0.6057 -3.7090 3 569.7728 85 47517 303421033 42 934 a-a-CH3DCH2OH
428133.7463 0.4408 -4.3670 3 606.5823 91 47517 30345 739 44 836 a-a-CH3DCH2OH
428227.2222 0.0113 -5.0146 3 101.0792 37 47517 30318 513 18 216 a-a-CH3DCH2OH
428719.3876 0.5533 -3.6713 3 546.1335 83 47517 303411031 41 932 a-a-CH3DCH2OH
428723.1929 0.0246 -4.7329 3 167.9863 49 47517 30324 420 24 123 a-a-CH3DCH2OH
428934.9938 0.5513 -3.6709 3 546.1258 83 47517 303411032 41 933 a-a-CH3DCH2OH
429013.4528 0.8421 -4.6110 3 765.1702101 47517 30350 942 491039 a-a-CH3DCH2OH
429972.9613 0.5023 -3.6347 3 523.0531 81 47517 303401030 40 931 a-a-CH3DCH2OH
430114.8215 0.5011 -3.6344 3 523.0480 81 47517 303401031 40 932 a-a-CH3DCH2OH
430193.1157 1.8250 -4.4066 3 908.7827113 47517 30356 651 56 552 a-a-CH3DCH2OH
431088.9925 0.0065 -3.3488 3 83.9608 35 47517 30317 414 16 313 a-a-CH3DCH2OH
431114.3785 0.4556 -3.5998 3 500.5424 79 47517 303391029 39 930 a-a-CH3DCH2OH
431206.4827 0.4549 -3.5996 3 500.5391 79 47517 303391030 39 931 a-a-CH3DCH2OH
431815.5099 0.1908 -3.8586 3 362.7720 71 47517 30335 530 34 629 a-a-CH3DCH2OH
432154.6043 0.4130 -3.5666 3 478.6007 77 47517 303381028 38 929 a-a-CH3DCH2OH
432213.5829 0.4125 -3.5665 3 478.5986 77 47517 303381029 38 930 a-a-CH3DCH2OH
433102.9152 0.3741 -3.5352 3 457.2273 75 47517 303371027 37 928 a-a-CH3DCH2OH
433140.1420 0.3738 -3.5351 3 457.2260 75 47517 303371028 37 929 a-a-CH3DCH2OH
433708.9091 0.0300 -3.1553 3 174.1459 51 -47517 30325 323 24 222 a-a-CH3DCH2OH
433800.6940 0.0113 -5.1444 3 90.7637 35 47517 30317 512 17 215 a-a-CH3DCH2OH
433845.6895 2.7644 -4.6164 3 1052.2407121 47517 30360 754 60 655 a-a-CH3DCH2OH
433874.0181 0.3931 -4.0458 3 454.8019 79 47517 30339 633 38 732 a-a-CH3DCH2OH
433967.2615 0.3386 -3.5055 3 436.4218 73 47517 303361026 36 927 a-a-CH3DCH2OH
433990.4080 0.3384 -3.5054 3 436.4210 73 47517 303361027 36 928 a-a-CH3DCH2OH
434571.3355 1.3429 -4.2785 3 803.8903107 47517 30353 449 53 350 a-a-CH3DCH2OH
434588.7992 0.6573 -4.2986 3 523.1959 89 47517 30344 143 44 044 a-a-CH3DCH2OH
434590.0883 0.6573 -4.2986 3 523.1959 89 47517 30344 243 44 144 a-a-CH3DCH2OH
434754.5507 0.3064 -3.4776 3 416.1835 71 47517 303351025 35 926 a-a-CH3DCH2OH
434768.7174 0.3063 -3.4775 3 416.1830 71 47517 303351026 35 927 a-a-CH3DCH2OH
435155.5532 1.3368 -4.2774 3 803.8917107 47517 30353 549 53 450 a-a-CH3DCH2OH
435470.8671 0.2771 -3.4514 3 396.5120 69 47517 303341024 34 925 a-a-CH3DCH2OH
435479.3953 0.2771 -3.4514 3 396.5117 69 47517 303341025 34 926 a-a-CH3DCH2OH
435508.1285 0.0335 -4.4506 3 202.6239 53 47517 30326 521 26 224 a-a-CH3DCH2OH
435521.5726 1.0229 -4.5967 3 765.1555101 47517 30350 941 491040 a-a-CH3DCH2OH
435563.6989 0.0058 -3.3570 3 74.3122 33 47517 30316 412 15 313 a-a-CH3DCH2OH
436121.6409 0.2507 -3.4271 3 377.4068 67 47517 303331023 33 924 a-a-CH3DCH2OH
436126.6860 0.2507 -3.4271 3 377.4066 67 47517 303331024 33 925 a-a-CH3DCH2OH
436257.6380 0.0080 -3.1440 3 43.5825 17 47517 303 8 7 2 7 6 1 a-a-CH3DCH2OH
436257.6381 0.0080 -3.1440 3 43.5825 17 47517 303 8 7 1 7 6 2 a-a-CH3DCH2OH
436474.5772 0.6282 -4.2261 3 557.2269 87 47517 30343 736 42 835 a-a-CH3DCH2OH
436711.7768 0.2270 -3.4046 3 358.8675 65 47517 303321022 32 923 a-a-CH3DCH2OH
436714.7069 0.2270 -3.4046 3 358.8674 65 47517 303321023 32 924 a-a-CH3DCH2OH
436768.6926 0.1000 -2.9799 3 195.6524 55 -47517 30327 126 26 225 a-a-CH3DCH2OH
437176.2216 0.6999 -4.1752 3 611.0184 95 47517 30347 245 47 146 a-a-CH3DCH2OH
437190.1129 0.6998 -4.1752 3 611.0184 95 47517 30347 345 47 246 a-a-CH3DCH2OH
437245.7526 0.2056 -3.3840 3 340.8938 63 47517 303311021 31 922 a-a-CH3DCH2OH
437247.4213 0.2056 -3.3840 3 340.8937 63 47517 303311022 31 923 a-a-CH3DCH2OH
437361.6041 0.9704 -4.1928 3 704.6092101 47517 30350 347 50 248 a-a-CH3DCH2OH
437464.5798 0.9700 -4.1926 3 704.6094101 47517 30350 447 50 348 a-a-CH3DCH2OH
437727.6923 0.1866 -3.3654 3 323.4852 61 47517 303301020 30 921 a-a-CH3DCH2OH
437728.6232 0.1866 -3.3654 3 323.4852 61 47517 303301021 30 922 a-a-CH3DCH2OH
438161.4233 0.1696 -3.3488 3 306.6415 59 47517 303291019 29 920 a-a-CH3DCH2OH
438161.9312 0.1696 -3.3488 3 306.6414 59 47517 303291020 29 921 a-a-CH3DCH2OH
438169.5004 0.0300 -2.9770 3 195.6252 55 -47517 30327 226 26 125 a-a-CH3DCH2OH
438434.4818 0.0077 -4.7842 3 36.1147 25 47517 30312 310 11 011 a-a-CH3DCH2OH
438453.3742 0.0300 -3.1383 3 203.0000 55 -47517 30327 225 26 324 a-a-CH3DCH2OH
438550.5184 0.1546 -3.3343 3 290.3622 57 47517 303281018 28 919 a-a-CH3DCH2OH
438550.7890 0.1546 -3.3343 3 290.3622 57 47517 303281019 28 920 a-a-CH3DCH2OH
438883.2564 2.0527 -4.4542 3 939.9280115 47517 30357 552 57 453 a-a-CH3DCH2OH
438898.3288 0.1414 -3.3219 3 274.6470 55 47517 303271017 27 918 a-a-CH3DCH2OH
438898.4693 0.1414 -3.3219 3 274.6470 55 47517 303271018 27 919 a-a-CH3DCH2OH
439208.0089 0.1298 -3.3119 3 259.4957 53 47517 303261016 26 917 a-a-CH3DCH2OH
439208.0799 0.1298 -3.3119 3 259.4957 53 47517 303261017 26 918 a-a-CH3DCH2OH
439482.5362 0.1197 -3.3042 3 244.9080 51 47517 303251015 25 916 a-a-CH3DCH2OH
439482.5711 0.1197 -3.3042 3 244.9080 51 47517 303251016 25 917 a-a-CH3DCH2OH
439724.7265 0.1110 -3.2992 3 230.8836 49 47517 303241014 24 915 a-a-CH3DCH2OH
439724.7431 0.1110 -3.2992 3 230.8836 49 47517 303241015 24 916 a-a-CH3DCH2OH
439885.9255 0.0112 -5.2843 3 81.0001 33 47517 30316 511 16 214 a-a-CH3DCH2OH
439937.2461 0.1034 -3.2968 3 217.4221 47 47517 303231013 23 914 a-a-CH3DCH2OH
439937.2537 0.1034 -3.2968 3 217.4221 47 47517 303231014 23 915 a-a-CH3DCH2OH
440071.1652 8.3153 -5.6350 3 1018.6342119 47517 30359 753 58 850 a-a-CH3DCH2OH
440122.6215 0.0969 -3.2975 3 204.5235 45 47517 303221012 22 913 a-a-CH3DCH2OH
440122.6249 0.0969 -3.2975 3 204.5235 45 47517 303221013 22 914 a-a-CH3DCH2OH
440134.2912 0.0067 -3.1874 3 50.1942 23 47517 30311 6 6 10 5 5 a-a-CH3DCH2OH
440135.2573 0.0067 -3.1874 3 50.1941 23 47517 30311 6 5 10 5 6 a-a-CH3DCH2OH
440233.7847 0.0193 -5.3539 3 123.9571 43 47517 30321 318 21 021 a-a-CH3DCH2OH
440283.2480 0.0914 -3.3015 3 192.1874 43 47517 303211011 21 912 a-a-CH3DCH2OH
440283.2494 0.0914 -3.3015 3 192.1874 43 47517 303211012 21 913 a-a-CH3DCH2OH
440421.3956 0.0867 -3.3092 3 180.4136 41 47517 303201010 20 911 a-a-CH3DCH2OH
440421.3961 0.0867 -3.3092 3 180.4136 41 47517 303201011 20 912 a-a-CH3DCH2OH
440539.2147 0.0828 -3.3212 3 169.2018 39 47517 3031910 9 19 910 a-a-CH3DCH2OH
440539.2149 0.0828 -3.3212 3 169.2018 39 47517 303191010 19 911 a-a-CH3DCH2OH
440638.7407 0.0795 -3.3380 3 158.5520 37 47517 3031810 8 18 9 9 a-a-CH3DCH2OH
440638.7408 0.0795 -3.3380 3 158.5520 37 47517 3031810 9 18 910 a-a-CH3DCH2OH
440721.8974 0.0768 -3.3606 3 148.4638 35 47517 3031710 7 17 9 8 a-a-CH3DCH2OH
440721.8974 0.0768 -3.3606 3 148.4638 35 47517 3031710 8 17 9 9 a-a-CH3DCH2OH
440790.4999 0.0746 -3.3903 3 138.9371 33 47517 3031610 6 16 9 7 a-a-CH3DCH2OH
440790.4999 0.0746 -3.3903 3 138.9371 33 47517 3031610 7 16 9 8 a-a-CH3DCH2OH
440846.2573 0.0728 -3.4293 3 129.9717 31 47517 3031510 5 15 9 6 a-a-CH3DCH2OH
440846.2573 0.0728 -3.4293 3 129.9717 31 47517 3031510 6 15 9 7 a-a-CH3DCH2OH
440890.7745 0.0714 -3.4804 3 121.5674 29 47517 3031410 4 14 9 5 a-a-CH3DCH2OH
440890.7745 0.0714 -3.4804 3 121.5674 29 47517 3031410 5 14 9 6 a-a-CH3DCH2OH
440909.9053 2.0030 -4.4504 3 939.9341115 47517 30357 652 57 553 a-a-CH3DCH2OH
440925.5534 0.0704 -3.5491 3 113.7242 27 47517 3031310 3 13 9 4 a-a-CH3DCH2OH
440925.5534 0.0704 -3.5491 3 113.7242 27 47517 3031310 4 13 9 5 a-a-CH3DCH2OH
440951.9947 0.0696 -3.6453 3 106.4418 25 47517 3031210 2 12 9 3 a-a-CH3DCH2OH
440951.9947 0.0696 -3.6453 3 106.4418 25 47517 3031210 3 12 9 4 a-a-CH3DCH2OH
440971.3979 0.0691 -3.7919 3 99.7201 23 47517 3031110 1 11 9 2 a-a-CH3DCH2OH
440971.3979 0.0691 -3.7919 3 99.7201 23 47517 3031110 2 11 9 3 a-a-CH3DCH2OH
440984.9628 0.0688 -4.0623 3 93.5590 21 47517 3031010 0 10 9 1 a-a-CH3DCH2OH
440984.9628 0.0688 -4.0623 3 93.5590 21 47517 3031010 1 10 9 2 a-a-CH3DCH2OH
441293.4657 0.0099 -4.3293 3 57.0755 31 47517 30315 213 14 114 a-a-CH3DCH2OH
441972.5439 0.5418 -4.3977 3 632.0822 93 47517 30346 740 45 837 a-a-CH3DCH2OH
442375.0608 0.5882 -4.4691 3 696.6353 97 47517 30348 841 47 938 a-a-CH3DCH2OH
442493.6682 0.0070 -3.3357 3 93.7157 37 47517 30318 415 17 314 a-a-CH3DCH2OH
442564.8432 0.0300 -2.8671 3 201.6135 57 -47517 30328 028 27 127 a-a-CH3DCH2OH
442590.4010 0.0300 -2.8670 3 201.6130 57 -47517 30328 128 27 027 a-a-CH3DCH2OH
443124.8133 0.0058 -3.2385 3 63.4715 29 47517 30314 510 13 4 9 a-a-CH3DCH2OH
443579.9801 0.0058 -3.2378 3 63.4573 29 47517 30314 5 9 13 410 a-a-CH3DCH2OH
444038.0890 0.8734 -4.4095 3 670.0614 95 47517 30347 839 46 938 a-a-CH3DCH2OH
444865.2657 0.7613 -4.3276 3 546.7782 91 47517 30345 144 45 045 a-a-CH3DCH2OH
444866.1520 0.7613 -4.3276 3 546.7782 91 47517 30345 244 45 145 a-a-CH3DCH2OH
445306.4839 1.4831 -4.3186 3 833.1497109 47517 30354 450 54 351 a-a-CH3DCH2OH
445738.6306 1.4783 -4.3178 3 833.1507109 47517 30354 550 54 451 a-a-CH3DCH2OH
445767.9512 0.0300 -3.1239 3 188.1308 53 -47517 30326 324 25 223 a-a-CH3DCH2OH
446228.5298 0.0108 -5.4340 3 71.7955 31 47517 30315 510 15 213 a-a-CH3DCH2OH
446506.9025 0.0438 -4.4491 3 217.6252 55 47517 30327 522 27 225 a-a-CH3DCH2OH
447503.5955 0.7974 -4.2082 3 636.4940 97 47517 30348 246 48 147 a-a-CH3DCH2OH
447513.3796 0.7973 -4.2082 3 636.4941 97 47517 30348 346 48 247 a-a-CH3DCH2OH
447794.2746 0.9161 -4.6251 3 793.3244103 47517 30351 943 501040 a-a-CH3DCH2OH
447818.4935 1.0825 -4.2295 3 731.9767103 47517 30351 348 51 249 a-a-CH3DCH2OH
447892.7928 1.0822 -4.2294 3 731.9769103 47517 30351 448 51 349 a-a-CH3DCH2OH
448559.6512 0.0215 -3.3538 3 240.5878 59 47517 30329 326 28 425 a-a-CH3DCH2OH
450090.9502 2.2342 -4.4987 3 971.5935117 47517 30358 553 58 454 a-a-CH3DCH2OH
450761.0413 0.0787 -3.6028 3 298.5776 65 47517 30332 428 31 527 a-a-CH3DCH2OH
451624.8336 2.1940 -4.4959 3 971.5980117 47517 30358 653 58 554 a-a-CH3DCH2OH
452538.7102 0.1000 -2.9580 3 210.2410 57 -47517 30328 127 27 226 a-a-CH3DCH2OH
452597.6899 0.0104 -5.5937 3 63.1565 29 47517 30314 5 9 14 212 a-a-CH3DCH2OH
453004.0761 0.0076 -3.3241 3 104.0649 39 47517 30319 416 18 315 a-a-CH3DCH2OH
453042.2067 0.0076 -3.1162 3 48.0639 19 47517 303 9 7 3 8 6 2 a-a-CH3DCH2OH
453042.2072 0.0076 -3.1162 3 48.0639 19 47517 303 9 7 2 8 6 3 a-a-CH3DCH2OH
453092.3986 0.0325 -4.7816 3 181.5470 51 47517 30325 421 25 124 a-a-CH3DCH2OH
453435.4505 7.2735 -5.4949 3 985.3046117 47517 30358 752 57 849 a-a-CH3DCH2OH
453541.6365 0.0081 -2.9560 3 210.2215 57 47517 30328 227 27 126 a-a-CH3DCH2OH
454482.8027 0.6834 -4.4366 3 658.1775 95 47517 30347 741 46 838 a-a-CH3DCH2OH
454726.0862 0.0062 -3.3440 3 83.2836 35 47517 30317 413 16 314 a-a-CH3DCH2OH
454913.7592 0.0079 -3.7040 3 78.5414 35 47517 30317 314 16 215 a-a-CH3DCH2OH
455132.2738 0.8772 -4.3582 3 570.8778 93 47517 30346 145 46 046 a-a-CH3DCH2OH
455132.8826 0.8772 -4.3582 3 570.8778 93 47517 30346 245 46 146 a-a-CH3DCH2OH
455980.4911 1.6353 -4.3603 3 862.9231111 47517 30355 451 55 352 a-a-CH3DCH2OH
456292.5951 0.0089 -3.1020 3 217.9152 57 47517 30328 226 27 325 a-a-CH3DCH2OH
456299.2193 1.6314 -4.3597 3 862.9238111 47517 30355 551 55 452 a-a-CH3DCH2OH
456690.1022 1.1883 -4.6062 3 793.3030103 47517 30351 942 501041 a-a-CH3DCH2OH
456865.4303 0.0066 -3.1583 3 56.3635 25 47517 30312 6 7 11 5 6 a-a-CH3DCH2OH
456868.0089 0.0066 -3.1583 3 56.3634 25 47517 30312 6 6 11 5 7 a-a-CH3DCH2OH
457815.8779 0.9059 -4.2427 3 662.4862 99 47517 30349 247 49 148 a-a-CH3DCH2OH
457822.7581 0.9059 -4.2427 3 662.4862 99 47517 30349 347 49 248 a-a-CH3DCH2OH
458154.3002 0.0300 -2.8516 3 216.3762 59 -47517 30329 029 28 128 a-a-CH3DCH2OH
458171.6960 0.0300 -2.8515 3 216.3759 59 -47517 30329 129 28 028 a-a-CH3DCH2OH
458247.3425 1.2054 -4.2678 3 759.8597105 47517 30352 349 52 250 a-a-CH3DCH2OH
458300.8339 1.2052 -4.2677 3 759.8598105 47517 30352 449 52 350 a-a-CH3DCH2OH
458423.1291 0.0300 -3.0957 3 202.6239 55 -47517 30327 325 26 224 a-a-CH3DCH2OH
459398.6472 0.0058 -3.2143 3 71.3543 31 47517 30315 511 14 410 a-a-CH3DCH2OH
459702.8766 0.6460 -4.4888 3 723.7354 99 47517 30349 842 48 939 a-a-CH3DCH2OH
460213.7686 0.0059 -3.2133 3 71.3290 31 47517 30315 510 14 411 a-a-CH3DCH2OH
460278.8236 0.0575 -4.4622 3 233.1355 57 47517 30328 523 28 226 a-a-CH3DCH2OH
461171.8724 2.4313 -4.5449 3 1003.7710119 47517 30359 554 59 455 a-a-CH3DCH2OH
461470.7463 0.2293 -3.8116 3 382.5374 73 47517 30336 531 35 630 a-a-CH3DCH2OH
462328.5829 2.3990 -4.5429 3 1003.7743119 47517 30359 654 59 555 a-a-CH3DCH2OH
462677.6370 0.0083 -3.3133 3 115.0055 41 47517 30320 417 19 316 a-a-CH3DCH2OH
463060.5225 0.4797 -4.0175 3 476.8303 81 47517 30340 634 39 733 a-a-CH3DCH2OH
463322.0078 0.7759 -4.2146 3 581.4976 89 47517 30344 737 43 836 a-a-CH3DCH2OH
463859.1728 0.0082 -4.6861 3 42.5656 27 47517 30313 311 12 012 a-a-CH3DCH2OH
465021.1017 6.2758 -5.3586 3 952.5512115 47517 30357 751 56 848 a-a-CH3DCH2OH
465389.7956 1.0061 -4.3903 3 595.4947 95 47517 30347 146 47 047 a-a-CH3DCH2OH
465390.2134 1.0061 -4.3903 3 595.4947 95 47517 30347 246 47 147 a-a-CH3DCH2OH
465433.6602 0.8774 -4.4846 3 684.8729 97 47517 30348 742 47 839 a-a-CH3DCH2OH
466487.6348 0.9919 -4.6429 3 822.0508105 47517 30352 944 511041 a-a-CH3DCH2OH
466600.9462 1.8001 -4.4037 3 893.2103113 47517 30356 452 56 353 a-a-CH3DCH2OH
466835.3859 1.7971 -4.4032 3 893.2108113 47517 30356 552 56 453 a-a-CH3DCH2OH
468054.5452 1.0642 -4.4112 3 696.5600 97 47517 30348 840 47 939 a-a-CH3DCH2OH
468113.5311 1.0264 -4.2788 3 688.9946101 47517 30350 248 50 149 a-a-CH3DCH2OH
468118.3622 1.0264 -4.2788 3 688.9946101 47517 30350 348 50 249 a-a-CH3DCH2OH
468252.2010 0.0300 -2.9394 3 225.3500 59 -47517 30329 128 28 227 a-a-CH3DCH2OH
468650.2790 1.3400 -4.3077 3 788.2579107 47517 30353 350 53 251 a-a-CH3DCH2OH
468688.7112 1.3397 -4.3076 3 788.2579107 47517 30353 450 53 351 a-a-CH3DCH2OH
468967.1531 0.0097 -2.9380 3 225.3361 59 47517 30329 228 28 127 a-a-CH3DCH2OH
469821.6059 0.0073 -3.0892 3 53.1064 21 47517 30310 7 4 9 6 3 a-a-CH3DCH2OH
469821.6083 0.0073 -3.0892 3 53.1064 21 47517 30310 7 3 9 6 4 a-a-CH3DCH2OH
471448.8330 0.0240 -3.2986 3 256.8225 61 47517 30330 327 29 426 a-a-CH3DCH2OH
471454.7013 0.0230 -5.4082 3 135.5993 45 47517 30322 319 22 022 a-a-CH3DCH2OH
471590.9606 0.0132 -5.6002 3 82.6098 35 47517 30317 414 17 117 a-a-CH3DCH2OH
471603.7054 0.0300 -3.3023 3 126.5330 43 -47517 30321 418 20 317 a-a-CH3DCH2OH
471622.0306 0.0110 -3.0707 3 217.6252 57 47517 30328 326 27 225 a-a-CH3DCH2OH
472144.7310 2.6447 -4.5930 3 1036.4603121 47517 30360 555 60 456 a-a-CH3DCH2OH
473014.0857 2.6189 -4.5914 3 1036.4627121 47517 30360 655 60 556 a-a-CH3DCH2OH
473571.2947 0.0300 -3.1316 3 63.0960 27 -47517 30313 6 8 12 5 7 a-a-CH3DCH2OH
473577.5654 0.0300 -3.1316 3 63.0958 27 -47517 30313 6 7 12 5 8 a-a-CH3DCH2OH
473643.1431 0.0103 -3.0717 3 233.3568 59 47517 30329 227 28 326 a-a-CH3DCH2OH
473739.0614 0.0300 -2.8388 3 231.6588 61 -47517 30330 030 29 129 a-a-CH3DCH2OH
473750.8350 0.0300 -2.8388 3 231.6586 61 -47517 30330 130 29 029 a-a-CH3DCH2OH
474580.0867 5.3374 -5.2273 3 920.3841113 47517 30356 750 55 847 a-a-CH3DCH2OH
474591.7216 1.1356 -4.5422 3 712.1727 99 47517 30349 743 48 840 a-a-CH3DCH2OH
474788.3158 0.0066 -3.3372 3 92.8083 37 47517 30318 414 17 315 a-a-CH3DCH2OH
475463.0997 0.0300 -3.1937 3 79.8098 33 -47517 30316 512 15 411 a-a-CH3DCH2OH
475637.7837 1.1490 -4.4239 3 620.6285 97 47517 30348 147 48 048 a-a-CH3DCH2OH
475638.0701 1.1490 -4.4239 3 620.6285 97 47517 30348 247 48 148 a-a-CH3DCH2OH
476446.8670 0.7175 -4.5138 3 751.4169101 47517 30350 843 49 940 a-a-CH3DCH2OH
476860.3359 0.0300 -3.1920 3 79.7668 33 -47517 30316 511 15 412 a-a-CH3DCH2OH
476885.3232 0.0760 -4.4885 3 249.1559 59 47517 30329 524 29 227 a-a-CH3DCH2OH
477173.9186 1.9785 -4.4486 3 924.0112115 47517 30357 453 57 354 a-a-CH3DCH2OH
477345.9244 1.9761 -4.4483 3 924.0115115 47517 30357 553 57 454 a-a-CH3DCH2OH
477745.6629 0.0105 -4.3453 3 65.0642 33 47517 30316 214 15 115 a-a-CH3DCH2OH
478320.9735 0.0915 -3.5441 3 316.6057 67 47517 30333 429 32 528 a-a-CH3DCH2OH
478396.9166 1.1597 -4.3164 3 716.0191103 47517 30351 249 51 150 a-a-CH3DCH2OH
478400.3041 1.1597 -4.3164 3 716.0191103 47517 30351 349 51 250 a-a-CH3DCH2OH
478518.1789 1.3943 -4.6181 3 822.0200105 47517 30352 943 511042 a-a-CH3DCH2OH
479029.0048 1.4869 -4.3491 3 817.1710109 47517 30354 351 54 252 a-a-CH3DCH2OH
479056.5647 1.4867 -4.3490 3 817.1711109 47517 30354 451 54 352 a-a-CH3DCH2OH
479825.7459 0.0430 -4.8366 3 195.6252 53 47517 30326 422 26 125 a-a-CH3DCH2OH
479894.8223 0.0300 -3.2906 3 138.6417 45 -47517 30322 419 21 318 a-a-CH3DCH2OH
481733.2761 1.4686 -4.6100 3 740.0809101 47517 30350 744 49 841 a-a-CH3DCH2OH
481904.7619 4.4713 -5.1023 3 888.8122111 47517 30355 749 54 846 a-a-CH3DCH2OH
482640.9701 0.0116 -3.0189 3 53.6539 17 47517 303 8 8 0 7 7 1 a-a-CH3DCH2OH
482640.9701 0.0116 -3.0189 3 53.6539 17 47517 303 8 8 1 7 7 0 a-a-CH3DCH2OH
483923.3282 0.0114 -2.9240 3 240.9791 61 47517 30330 129 29 228 a-a-CH3DCH2OH
484430.9803 0.0116 -2.9231 3 240.9692 61 47517 30330 229 29 128 a-a-CH3DCH2OH
485026.8875 1.0688 -4.6644 3 851.3505107 47517 30353 945 521042 a-a-CH3DCH2OH
485165.0844 0.0086 -3.7286 3 87.8815 37 47517 30318 315 17 216 a-a-CH3DCH2OH
485296.3036 0.0130 -3.0489 3 233.1355 59 47517 30329 327 28 226 a-a-CH3DCH2OH
485876.1740 1.3068 -4.4590 3 646.2791 99 47517 30349 148 49 049 a-a-CH3DCH2OH
485876.3702 1.3068 -4.4590 3 646.2791 99 47517 30349 248 49 149 a-a-CH3DCH2OH
486593.5761 0.0070 -3.0635 3 58.7101 23 47517 30311 7 5 10 6 4 a-a-CH3DCH2OH
486593.5855 0.0070 -3.0635 3 58.7101 23 47517 30311 7 4 10 6 5 a-a-CH3DCH2OH
486659.1478 1.8853 -4.6883 3 768.6010103 47517 30351 745 50 842 a-a-CH3DCH2OH
486838.1001 3.6874 -4.9849 3 857.8431109 47517 30354 748 53 845 a-a-CH3DCH2OH
487680.3457 0.0300 -3.2777 3 151.3254 47 -47517 30323 420 22 319 a-a-CH3DCH2OH
487704.2692 2.1713 -4.4951 3 955.3255117 47517 30358 454 58 355 a-a-CH3DCH2OH
487830.1705 2.1694 -4.4949 3 955.3257117 47517 30358 554 58 455 a-a-CH3DCH2OH
488666.3155 1.3070 -4.3555 3 743.5595105 47517 30352 250 52 151 a-a-CH3DCH2OH
488668.6877 1.3070 -4.3555 3 743.5595105 47517 30352 350 52 251 a-a-CH3DCH2OH
489210.5253 2.3924 -4.7771 3 797.7348105 47517 30352 746 51 843 a-a-CH3DCH2OH
489283.2741 2.9932 -4.8762 3 827.4828107 47517 30353 747 52 844 a-a-CH3DCH2OH
489319.3843 0.0300 -2.8286 3 247.4612 63 -47517 30331 031 30 130 a-a-CH3DCH2OH
489327.4000 0.0300 -2.8286 3 247.4611 63 -47517 30331 131 30 030 a-a-CH3DCH2OH
489384.8881 1.6473 -4.3920 3 846.5990111 47517 30355 352 55 253 a-a-CH3DCH2OH
489404.6162 1.6472 -4.3920 3 846.5990111 47517 30355 452 55 353 a-a-CH3DCH2OH
490244.9295 0.0300 -3.1075 3 70.3924 29 -47517 30314 6 9 13 5 8 a-a-CH3DCH2OH
490259.0393 0.0300 -3.1074 3 70.3920 29 -47517 30314 6 8 13 5 9 a-a-CH3DCH2OH
490538.7727 0.0088 -4.6091 3 49.5339 29 47517 30314 312 13 013 a-a-CH3DCH2OH
490589.6348 0.0120 -3.0468 3 249.3232 61 47517 30330 228 29 327 a-a-CH3DCH2OH
491247.2808 0.0300 -3.1765 3 88.8411 35 -47517 30317 513 16 412 a-a-CH3DCH2OH
491384.6186 0.2699 -3.7660 3 402.8651 75 47517 30337 532 36 631 a-a-CH3DCH2OH
491426.2878 0.9489 -4.2043 3 606.3388 91 47517 30345 738 44 837 a-a-CH3DCH2OH
492447.0260 0.8140 -4.5444 3 779.6829103 47517 30351 844 50 941 a-a-CH3DCH2OH
493147.9754 0.5754 -3.9898 3 499.4266 83 47517 30341 635 40 734 a-a-CH3DCH2OH
493199.2658 1.2995 -4.4147 3 723.6296 99 47517 30349 841 48 940 a-a-CH3DCH2OH
493421.1871 0.0259 -3.2511 3 273.5955 63 47517 30331 328 30 427 a-a-CH3DCH2OH
493551.4614 0.0300 -3.1740 3 88.7706 35 -47517 30317 512 16 413 a-a-CH3DCH2OH
495102.6545 0.0300 -3.2635 3 164.5766 49 -47517 30324 421 23 320 a-a-CH3DCH2OH
495956.5484 0.0072 -3.3372 3 102.8838 39 47517 30319 415 18 316 a-a-CH3DCH2OH
496104.8888 1.4808 -4.4956 3 672.4463101 47517 30350 149 50 050 a-a-CH3DCH2OH
496105.0231 1.4808 -4.4956 3 672.4463101 47517 30350 249 50 150 a-a-CH3DCH2OH
496341.7800 0.1004 -4.5265 3 265.6876 61 47517 30330 525 30 228 a-a-CH3DCH2OH
498195.9024 2.3793 -4.5432 3 987.1530119 47517 30359 455 59 356 a-a-CH3DCH2OH
498287.8540 2.3778 -4.5430 3 987.1532119 47517 30359 555 59 456 a-a-CH3DCH2OH
498921.9444 1.4691 -4.3961 3 771.6156107 47517 30353 251 53 152 a-a-CH3DCH2OH
498923.6037 1.4691 -4.3961 3 771.6156107 47517 30353 351 53 252 a-a-CH3DCH2OH
499372.1970 0.0154 -3.0302 3 249.1559 61 47517 30330 328 29 227 a-a-CH3DCH2OH
499429.2216 0.0111 -2.9974 3 58.1345 19 47517 303 9 8 1 8 7 2 a-a-CH3DCH2OH
499429.2216 0.0111 -2.9974 3 58.1345 19 47517 303 9 8 2 8 7 1 a-a-CH3DCH2OH
499562.6143 0.0138 -2.9116 3 257.1281 63 47517 30331 130 30 229 a-a-CH3DCH2OH
499719.0346 1.8221 -4.4364 3 876.5415113 47517 30356 353 56 254 a-a-CH3DCH2OH
499733.1330 1.8220 -4.4364 3 876.5415113 47517 30356 453 56 354 a-a-CH3DCH2OH
499921.7842 0.0140 -2.9109 3 257.1211 63 47517 30331 230 30 129 a-a-CH3DCH2OH
501121.9467 1.6517 -4.6322 3 851.3066107 47517 30353 944 521043 a-a-CH3DCH2OH
502315.1441 0.0151 -3.2479 3 178.3879 51 47517 30325 422 24 321 a-a-CH3DCH2OH
503330.2104 1.1469 -4.6898 3 881.2249109 47517 30354 946 531043 a-a-CH3DCH2OH
503355.5213 0.0068 -3.0393 3 64.8755 25 47517 30312 7 6 11 6 5 a-a-CH3DCH2OH
503355.5534 0.0068 -3.0393 3 64.8755 25 47517 30312 7 5 11 6 6 a-a-CH3DCH2OH
504098.2130 0.0274 -5.4609 3 147.7617 47 47517 30323 320 23 023 a-a-CH3DCH2OH
504895.4414 0.0171 -2.8210 3 263.7833 65 47517 30332 032 31 131 a-a-CH3DCH2OH
504900.8692 0.0171 -2.8210 3 263.7832 65 47517 30332 132 31 031 a-a-CH3DCH2OH
505334.1406 0.1031 -3.4899 3 335.1849 69 47517 30334 430 33 529 a-a-CH3DCH2OH
506323.8387 1.6721 -4.5336 3 699.1300103 47517 30351 150 51 051 a-a-CH3DCH2OH
506323.9306 1.6721 -4.5336 3 699.1300103 47517 30351 250 51 151 a-a-CH3DCH2OH
506663.1461 0.0060 -3.1630 3 98.4516 37 47517 30318 514 17 413 a-a-CH3DCH2OH
506877.8778 0.0064 -3.0859 3 78.2535 31 47517 30315 610 14 5 9 a-a-CH3DCH2OH
506907.5818 0.0064 -3.0858 3 78.2526 31 47517 30315 6 9 14 510 a-a-CH3DCH2OH
507208.9894 0.0143 -3.0265 3 265.8131 63 47517 30331 229 30 328 a-a-CH3DCH2OH
507522.0186 0.9522 -4.5812 3 808.5365105 47517 30352 845 51 942 a-a-CH3DCH2OH
508651.9656 2.6036 -4.5928 3 1019.4935121 47517 30360 456 60 357 a-a-CH3DCH2OH
508718.9838 2.6024 -4.5927 3 1019.4936121 47517 30360 556 60 457 a-a-CH3DCH2OH
508755.3618 0.0569 -4.8956 3 210.2215 55 47517 30327 423 27 126 a-a-CH3DCH2OH
509163.9674 1.6473 -4.4381 3 800.1871109 47517 30354 252 54 153 a-a-CH3DCH2OH
509165.1268 1.6473 -4.4381 3 800.1871109 47517 30354 352 54 253 a-a-CH3DCH2OH
509166.0036 0.1000 -4.4462 3 272.5483 61 47517 30330 624 30 327 a-a-CH3DCH2OH
509480.5361 0.0179 -3.2310 3 192.7508 53 47517 30326 423 25 322 a-a-CH3DCH2OH
509721.0865 0.0836 -4.4870 3 255.5501 59 47517 30329 623 29 326 a-a-CH3DCH2OH
509976.6281 0.0091 -5.4146 3 32.3996 23 47517 30311 4 8 10 1 9 a-a-CH3DCH2OH
510032.3428 2.0123 -4.4823 3 906.9983115 47517 30357 354 57 255 a-a-CH3DCH2OH
510042.4022 2.0122 -4.4823 3 906.9983115 47517 30357 454 57 355 a-a-CH3DCH2OH
510332.6722 0.0057 -3.1593 3 98.3404 37 47517 30318 513 17 414 a-a-CH3DCH2OH
511012.1486 0.1194 -4.4180 3 290.0543 63 47517 30331 625 31 328 a-a-CH3DCH2OH
512422.4650 0.0692 -4.5394 3 239.0644 57 47517 30328 622 28 325 a-a-CH3DCH2OH
513490.6002 0.0108 -5.4999 3 78.5414 33 47517 30316 512 16 215 a-a-CH3DCH2OH
513777.8693 0.0180 -3.0146 3 265.6876 63 47517 30331 329 30 228 a-a-CH3DCH2OH
514470.2217 0.0270 -3.2112 3 290.9042 65 47517 30332 329 31 428 a-a-CH3DCH2OH
515177.8213 0.0168 -2.9019 3 273.7967 65 47517 30332 131 31 230 a-a-CH3DCH2OH
515279.2438 0.0113 -4.3598 3 73.5758 35 47517 30317 215 16 116 a-a-CH3DCH2OH
515431.1086 0.0170 -2.9015 3 273.7917 65 47517 30332 231 31 130 a-a-CH3DCH2OH
515476.2673 0.1435 -4.4029 3 308.0650 65 47517 30332 626 32 329 a-a-CH3DCH2OH
516214.7201 0.0108 -2.9761 3 63.1758 21 47517 30310 8 2 9 7 3 a-a-CH3DCH2OH
516214.7201 0.0108 -2.9761 3 63.1758 21 47517 30310 8 3 9 7 2 a-a-CH3DCH2OH
516532.9243 1.8818 -4.5731 3 726.3299105 47517 30352 151 52 052 a-a-CH3DCH2OH
516532.9871 1.8818 -4.5731 3 726.3299105 47517 30352 251 52 152 a-a-CH3DCH2OH
516767.6770 0.0215 -3.2132 3 207.6569 55 47517 30327 424 26 323 a-a-CH3DCH2OH
516982.6820 0.0563 -4.6022 3 223.0975 55 47517 30327 621 27 324 a-a-CH3DCH2OH
517226.6467 0.0093 -3.7579 3 97.7527 39 47517 30319 316 18 217 a-a-CH3DCH2OH
518411.6116 0.0096 -4.5493 3 57.0199 31 47517 30315 313 14 014 a-a-CH3DCH2OH
518443.9688 0.0080 -3.3443 3 113.5077 41 47517 30320 416 19 317 a-a-CH3DCH2OH
518611.1321 0.1321 -4.5745 3 282.7318 63 47517 30331 526 31 229 a-a-CH3DCH2OH
519392.5052 1.8426 -4.4816 3 829.2739111 47517 30355 253 55 154 a-a-CH3DCH2OH
519393.3143 1.8426 -4.4816 3 829.2739111 47517 30355 353 55 254 a-a-CH3DCH2OH
519574.1242 1.5843 -4.4196 3 751.2698101 47517 30350 842 49 941 a-a-CH3DCH2OH
520013.5587 0.0112 -5.4112 3 87.8815 35 47517 30317 513 17 216 a-a-CH3DCH2OH
520104.4985 0.0066 -3.0170 3 71.6028 27 47517 30313 7 7 12 6 6 a-a-CH3DCH2OH
520104.5946 0.0066 -3.0170 3 71.6028 27 47517 30313 7 6 12 6 7 a-a-CH3DCH2OH
520325.5457 2.2190 -4.5297 3 937.9693117 47517 30358 355 58 256 a-a-CH3DCH2OH
520332.7128 2.2189 -4.5297 3 937.9693117 47517 30358 455 58 356 a-a-CH3DCH2OH
520467.2650 0.0219 -2.8158 3 280.6248 67 47517 30333 033 32 132 a-a-CH3DCH2OH
520470.9366 0.0219 -2.8158 3 280.6248 67 47517 30333 133 32 032 a-a-CH3DCH2OH
520749.5884 1.1458 -4.1947 3 631.7498 93 47517 30346 739 45 838 a-a-CH3DCH2OH
521298.8755 1.2281 -4.7193 3 911.6759111 47517 30355 947 541044 a-a-CH3DCH2OH
521343.8998 0.3110 -3.7221 3 423.7528 77 47517 30338 533 37 632 a-a-CH3DCH2OH
521470.3092 1.1537 -4.6248 3 837.9816107 47517 30353 846 52 943 a-a-CH3DCH2OH
521605.7014 0.0064 -3.1532 3 108.6455 39 47517 30319 515 18 414 a-a-CH3DCH2OH
522735.4406 0.1747 -4.4012 3 326.5791 67 47517 30333 627 33 330 a-a-CH3DCH2OH
523091.7382 0.0449 -4.6739 3 207.6569 53 47517 30326 620 26 323 a-a-CH3DCH2OH
523459.7344 0.0062 -3.0669 3 86.6801 33 47517 30316 611 15 510 a-a-CH3DCH2OH
523519.0068 0.0062 -3.0668 3 86.6782 33 47517 30316 610 15 511 a-a-CH3DCH2OH
523568.0186 0.0171 -3.0105 3 282.8253 65 47517 30332 230 31 329 a-a-CH3DCH2OH
523959.7946 0.6782 -3.9626 3 522.5894 85 47517 30342 636 41 735 a-a-CH3DCH2OH
524166.1322 0.0090 -5.1914 3 38.6670 25 47517 30312 4 9 11 110 a-a-CH3DCH2OH
524345.3867 0.0256 -3.1949 3 223.0975 57 47517 30328 425 27 324 a-a-CH3DCH2OH
524627.3936 1.9727 -4.6483 3 881.1630109 47517 30354 945 531044 a-a-CH3DCH2OH
526732.0373 2.1114 -4.6141 3 754.0457107 47517 30353 152 53 053 a-a-CH3DCH2OH
526732.0802 2.1114 -4.6141 3 754.0457107 47517 30353 252 53 153 a-a-CH3DCH2OH
527266.2470 0.0058 -3.1480 3 108.4757 39 47517 30319 514 18 415 a-a-CH3DCH2OH
527616.6031 0.0116 -5.3357 3 97.7527 37 47517 30318 514 18 217 a-a-CH3DCH2OH
528448.0753 0.0211 -3.0019 3 282.7318 65 47517 30332 330 31 229 a-a-CH3DCH2OH
529607.6422 2.0563 -4.5265 3 858.8757113 47517 30356 254 56 155 a-a-CH3DCH2OH
529608.2064 2.0563 -4.5265 3 858.8757113 47517 30356 354 56 255 a-a-CH3DCH2OH
530429.4613 0.0350 -4.7530 3 192.7508 51 47517 30325 619 25 322 a-a-CH3DCH2OH
530599.2439 2.4433 -4.5785 3 969.4541119 47517 30359 356 59 257 a-a-CH3DCH2OH
530604.3434 2.4433 -4.5785 3 969.4541119 47517 30359 456 59 357 a-a-CH3DCH2OH
530774.6040 0.0204 -2.8950 3 290.9846 67 47517 30333 132 32 231 a-a-CH3DCH2OH
530952.6890 0.0206 -2.8947 3 290.9811 67 47517 30333 232 32 131 a-a-CH3DCH2OH
531623.7684 0.1127 -3.4408 3 354.3122 71 47517 30335 431 34 530 a-a-CH3DCH2OH
532372.8960 0.0303 -3.1765 3 239.0644 59 47517 30329 426 28 325 a-a-CH3DCH2OH
532927.5733 0.2160 -4.4126 3 345.5963 69 47517 30334 628 34 331 a-a-CH3DCH2OH
532996.0523 0.0106 -2.9554 3 68.7779 23 47517 30311 8 4 10 7 3 a-a-CH3DCH2OH
532996.0524 0.0106 -2.9554 3 68.7779 23 47517 30311 8 3 10 7 4 a-a-CH3DCH2OH
534073.0388 1.4419 -4.6756 3 868.0222109 47517 30354 847 53 944 a-a-CH3DCH2OH
534632.3116 0.0276 -3.1784 3 308.7457 67 47517 30333 330 32 429 a-a-CH3DCH2OH
535956.1033 0.0072 -3.1470 3 119.4272 41 47517 30320 516 19 415 a-a-CH3DCH2OH
536034.8743 0.0276 -2.8129 3 297.9858 69 47517 30334 034 33 133 a-a-CH3DCH2OH
536037.3548 0.0276 -2.8129 3 297.9858 69 47517 30334 134 33 033 a-a-CH3DCH2OH
536373.4381 0.0123 -5.2725 3 108.1529 39 47517 30319 515 19 218 a-a-CH3DCH2OH
536837.1995 0.0065 -2.9967 3 78.8926 29 47517 30314 7 8 13 6 7 a-a-CH3DCH2OH
536837.4605 0.0065 -2.9967 3 78.8926 29 47517 30314 7 7 13 6 8 a-a-CH3DCH2OH
536921.0618 2.3621 -4.6564 3 782.2774109 47517 30354 153 54 054 a-a-CH3DCH2OH
536921.0911 2.3621 -4.6564 3 782.2774109 47517 30354 253 54 154 a-a-CH3DCH2OH
538677.4973 0.0268 -4.8383 3 178.3879 49 47517 30324 618 24 321 a-a-CH3DCH2OH
538815.6602 1.3185 -4.7532 3 942.7053113 47517 30356 948 551045 a-a-CH3DCH2OH
538956.4718 0.0090 -4.9896 3 45.4796 27 47517 30313 410 12 111 a-a-CH3DCH2OH
539679.4963 0.0747 -4.9564 3 225.3361 57 47517 30328 424 28 127 a-a-CH3DCH2OH
539722.7820 0.0207 -2.9982 3 300.3589 67 47517 30333 231 32 330 a-a-CH3DCH2OH
539809.4324 2.2896 -4.5729 3 888.9922115 47517 30357 255 57 156 a-a-CH3DCH2OH
539809.8255 2.2896 -4.5729 3 888.9922115 47517 30357 355 57 256 a-a-CH3DCH2OH
539977.1633 0.0061 -3.0505 3 95.6731 35 47517 30317 612 16 511 a-a-CH3DCH2OH
540089.9263 0.0061 -3.0504 3 95.6696 35 47517 30317 611 16 512 a-a-CH3DCH2OH
540853.9308 2.6865 -4.6287 3 1001.4526121 47517 30360 357 60 258 a-a-CH3DCH2OH
540857.5545 2.6864 -4.6287 3 1001.4526121 47517 30360 457 60 358 a-a-CH3DCH2OH
540987.8205 0.0353 -3.1587 3 255.5501 61 47517 30330 427 29 326 a-a-CH3DCH2OH
542456.3858 0.0089 -3.3589 3 124.6772 43 47517 30321 417 20 318 a-a-CH3DCH2OH
543326.3885 0.0247 -2.9921 3 300.2897 67 47517 30333 331 32 230 a-a-CH3DCH2OH
543601.2612 0.1724 -4.6305 3 300.2897 65 47517 30332 527 32 230 a-a-CH3DCH2OH
544433.4956 0.0061 -3.1402 3 119.1755 41 47517 30320 515 19 416 a-a-CH3DCH2OH
545099.2651 1.8393 -4.7344 3 898.6627111 47517 30355 848 54 945 a-a-CH3DCH2OH
545781.6445 0.0293 -2.8933 3 69.7530 19 47517 303 9 9 0 8 8 1 a-a-CH3DCH2OH
545781.6445 0.0293 -2.8933 3 69.7530 19 47517 303 9 9 1 8 8 0 a-a-CH3DCH2OH
546150.9150 0.2708 -4.4367 3 365.1175 71 47517 30335 629 35 332 a-a-CH3DCH2OH
546348.6968 0.0136 -5.2207 3 119.0805 41 47517 30320 516 20 219 a-a-CH3DCH2OH
546357.0409 0.0248 -2.8905 3 308.6918 69 47517 30334 133 33 232 a-a-CH3DCH2OH
546481.9082 0.0250 -2.8903 3 308.6894 69 47517 30334 233 33 132 a-a-CH3DCH2OH
547099.8748 2.6352 -4.7001 3 811.0246111 47517 30355 154 55 055 a-a-CH3DCH2OH
547099.8948 2.6352 -4.7001 3 811.0246111 47517 30355 254 55 155 a-a-CH3DCH2OH
547248.3624 1.9208 -4.4256 3 779.4806103 47517 30351 843 50 942 a-a-CH3DCH2OH
547402.8415 0.0105 -4.5035 3 65.0242 33 47517 30316 314 15 015 a-a-CH3DCH2OH
547528.7683 0.0204 -4.9284 3 164.5766 47 47517 30323 617 23 320 a-a-CH3DCH2OH
549164.4069 2.3695 -4.6660 3 911.5894111 47517 30355 946 541045 a-a-CH3DCH2OH
549589.1077 0.0087 -3.1445 3 130.8011 43 47517 30321 517 20 416 a-a-CH3DCH2OH
549771.5952 0.0105 -2.9358 3 74.9411 25 47517 30312 8 5 11 7 4 a-a-CH3DCH2OH
549771.5955 0.0105 -2.9358 3 74.9411 25 47517 30312 8 4 11 7 5 a-a-CH3DCH2OH
549997.9038 2.5438 -4.6206 3 919.6233117 47517 30358 256 58 157 a-a-CH3DCH2OH
549998.1774 2.5438 -4.6206 3 919.6233117 47517 30358 356 58 257 a-a-CH3DCH2OH
550294.1518 0.0404 -3.1421 3 272.5483 63 47517 30331 428 30 327 a-a-CH3DCH2OH
551020.8593 0.0104 -3.7901 3 108.1529 41 47517 30320 317 19 218 a-a-CH3DCH2OH
551131.1269 0.3507 -3.6804 3 445.1978 79 47517 30339 534 38 633 a-a-CH3DCH2OH
551200.2332 1.3638 -4.1853 3 657.7299 95 47517 30347 740 46 839 a-a-CH3DCH2OH
551598.2348 0.0344 -2.8122 3 315.8660 71 47517 30335 035 34 134 a-a-CH3DCH2OH
551599.9087 0.0344 -2.8122 3 315.8660 71 47517 30335 135 34 034 a-a-CH3DCH2OH
553549.9224 0.0063 -2.9784 3 86.7452 31 47517 30315 7 9 14 6 8 a-a-CH3DCH2OH
553550.5746 0.0063 -2.9784 3 86.7452 31 47517 30315 7 8 14 6 9 a-a-CH3DCH2OH
553696.4105 0.0124 -4.3722 3 82.6098 37 47517 30318 216 17 117 a-a-CH3DCH2OH
553976.9015 0.0282 -3.1524 3 327.1176 69 47517 30334 331 33 430 a-a-CH3DCH2OH
554314.1105 2.3666 -4.8018 3 929.9075113 47517 30356 849 55 946 a-a-CH3DCH2OH
554567.9162 0.0091 -4.8089 3 52.8306 29 47517 30314 411 13 112 a-a-CH3DCH2OH
555293.4309 0.7854 -3.9358 3 546.3167 87 47517 30343 637 42 736 a-a-CH3DCH2OH
555719.0753 0.0250 -2.9893 3 318.4131 69 47517 30334 232 33 331 a-a-CH3DCH2OH
555743.5197 1.4308 -4.7916 3 974.3155115 47517 30357 949 561046 a-a-CH3DCH2OH
556413.0224 0.0060 -3.0368 3 105.2337 37 47517 30318 613 17 512 a-a-CH3DCH2OH
556618.7484 0.0060 -3.0366 3 105.2273 37 47517 30318 612 17 513 a-a-CH3DCH2OH
556693.6093 0.0159 -5.0226 3 151.3254 45 47517 30322 616 22 319 a-a-CH3DCH2OH
557039.7305 0.1192 -3.3974 3 373.9843 73 47517 30336 432 35 531 a-a-CH3DCH2OH
557268.3473 2.9323 -4.7453 3 840.2872113 47517 30356 155 56 056 a-a-CH3DCH2OH
557268.3610 2.9323 -4.7453 3 840.2872113 47517 30356 255 56 156 a-a-CH3DCH2OH
557596.5005 0.0161 -5.1796 3 130.5341 43 47517 30321 517 21 220 a-a-CH3DCH2OH
558365.7278 0.0289 -2.9850 3 318.3621 69 47517 30334 332 33 231 a-a-CH3DCH2OH
560173.0618 2.8203 -4.6697 3 950.7687119 47517 30359 257 59 158 a-a-CH3DCH2OH
560173.2521 2.8203 -4.6697 3 950.7687119 47517 30359 357 59 258 a-a-CH3DCH2OH
560353.5670 0.0454 -3.1272 3 290.0543 65 47517 30332 429 31 328 a-a-CH3DCH2OH
561490.0326 3.0415 -4.8782 3 961.7608115 47517 30357 850 56 947 a-a-CH3DCH2OH
561928.0423 0.0300 -2.8885 3 326.9180 71 47517 30335 134 34 233 a-a-CH3DCH2OH
561937.3872 0.0069 -3.1360 3 130.4388 43 47517 30321 516 20 417 a-a-CH3DCH2OH
562015.3744 0.0302 -2.8884 3 326.9163 71 47517 30335 234 34 133 a-a-CH3DCH2OH
562384.5241 0.0109 -3.1454 3 142.7716 45 47517 30322 518 21 417 a-a-CH3DCH2OH
562460.8140 0.3422 -4.4725 3 385.1439 73 47517 30336 630 36 333 a-a-CH3DCH2OH
562570.2403 0.0293 -2.8769 3 74.7937 21 47517 30310 9 1 9 8 2 a-a-CH3DCH2OH
562570.2403 0.0293 -2.8769 3 74.7937 21 47517 30310 9 2 9 8 1 a-a-CH3DCH2OH
565903.1267 0.0134 -5.1204 3 138.6417 43 47517 30321 615 21 318 a-a-CH3DCH2OH
566420.7926 3.8784 -4.9641 3 994.2260117 47517 30358 851 57 948 a-a-CH3DCH2OH
566539.5144 0.0106 -2.9175 3 81.6656 27 47517 30313 8 6 12 7 5 a-a-CH3DCH2OH
566539.5153 0.0106 -2.9175 3 81.6656 27 47517 30313 8 5 12 7 6 a-a-CH3DCH2OH
567157.2845 0.0424 -2.8138 3 334.2654 73 47517 30336 036 35 135 a-a-CH3DCH2OH
567158.4130 0.0424 -2.8138 3 334.2654 73 47517 30336 136 35 035 a-a-CH3DCH2OH
567426.3448 3.2549 -4.7918 3 870.0649115 47517 30357 156 57 057 a-a-CH3DCH2OH
567426.3541 3.2549 -4.7918 3 870.0649115 47517 30357 256 57 157 a-a-CH3DCH2OH
568174.9266 0.0103 -3.3807 3 136.3894 45 47517 30322 418 21 319 a-a-CH3DCH2OH
568919.7477 6.0694 -5.1643 3 1060.9994121 47517 30360 853 59 950 a-a-CH3DCH2OH
568936.8087 4.8867 -5.0595 3 1027.3053119 47517 30359 852 58 949 a-a-CH3DCH2OH
570159.2684 0.0200 -5.1484 3 142.5122 45 47517 30322 518 22 221 a-a-CH3DCH2OH
570238.5250 0.0063 -2.9623 3 95.1612 33 47517 30316 710 15 6 9 a-a-CH3DCH2OH
570240.0453 0.0063 -2.9623 3 95.1611 33 47517 30316 7 9 15 610 a-a-CH3DCH2OH
570334.8922 3.1205 -4.7202 3 982.4282121 47517 30360 258 60 159 a-a-CH3DCH2OH
570335.0245 3.1205 -4.7202 3 982.4282121 47517 30360 358 60 259 a-a-CH3DCH2OH
571167.5685 0.2223 -4.6923 3 318.3621 67 47517 30333 528 33 231 a-a-CH3DCH2OH
571182.7300 0.0504 -3.1143 3 308.0650 67 47517 30333 430 32 329 a-a-CH3DCH2OH
571214.8152 0.0093 -4.6491 3 60.7131 31 47517 30315 412 14 113 a-a-CH3DCH2OH
571593.5200 0.0301 -2.9836 3 336.9872 71 47517 30335 233 34 332 a-a-CH3DCH2OH
571924.7027 1.5874 -4.8350 3 1006.5094117 47517 30358 950 571047 a-a-CH3DCH2OH
572370.4854 0.0969 -5.0174 3 240.9692 59 47517 30329 425 29 128 a-a-CH3DCH2OH
572594.3563 0.0295 -3.1323 3 346.0178 71 47517 30335 332 34 431 a-a-CH3DCH2OH
572744.9824 0.0064 -3.0257 3 115.3633 39 47517 30319 614 18 513 a-a-CH3DCH2OH
573106.6019 0.0063 -3.0253 3 115.3521 39 47517 30319 613 18 514 a-a-CH3DCH2OH
573527.8582 0.0338 -2.9805 3 336.9499 71 47517 30335 333 34 232 a-a-CH3DCH2OH
574241.5563 0.0139 -3.1494 3 155.3417 47 47517 30323 519 22 418 a-a-CH3DCH2OH
574857.8424 2.8530 -4.6852 3 942.5856113 47517 30356 947 551046 a-a-CH3DCH2OH
574911.1625 0.0124 -5.2217 3 126.5330 41 47517 30320 614 20 317 a-a-CH3DCH2OH
576246.5949 2.3083 -4.4323 3 808.2612105 47517 30352 844 51 943 a-a-CH3DCH2OH
577429.8814 0.0116 -4.4690 3 73.5473 35 47517 30317 315 16 016 a-a-CH3DCH2OH
577489.6607 0.0362 -2.8889 3 345.6631 73 47517 30336 135 35 234 a-a-CH3DCH2OH
577550.5988 0.0363 -2.8888 3 345.6619 73 47517 30336 235 35 134 a-a-CH3DCH2OH
577573.7276 3.6044 -4.8396 3 900.3575117 47517 30358 157 58 058 a-a-CH3DCH2OH
577573.7339 3.6044 -4.8396 3 900.3575117 47517 30358 257 58 158 a-a-CH3DCH2OH
579356.3332 0.0295 -2.8607 3 80.3949 23 47517 30311 9 2 10 8 3 a-a-CH3DCH2OH
579356.3332 0.0295 -2.8607 3 80.3949 23 47517 30311 9 3 10 8 2 a-a-CH3DCH2OH
579904.4477 0.0085 -3.1357 3 142.2640 45 47517 30322 517 21 418 a-a-CH3DCH2OH
580529.5886 0.3867 -3.6412 3 467.1972 81 47517 30340 535 39 634 a-a-CH3DCH2OH
581470.0038 0.1220 -3.3601 3 394.1981 75 47517 30337 433 36 532 a-a-CH3DCH2OH
581864.1413 0.4330 -4.5190 3 405.6770 75 47517 30337 631 37 334 a-a-CH3DCH2OH
582637.6720 1.5985 -4.1760 3 684.2775 97 47517 30348 741 47 840 a-a-CH3DCH2OH
582711.9426 0.0518 -2.8175 3 353.1837 75 47517 30337 037 36 136 a-a-CH3DCH2OH
582712.7027 0.0518 -2.8175 3 353.1837 75 47517 30337 137 36 036 a-a-CH3DCH2OH
582757.3025 0.0552 -3.1038 3 326.5791 69 47517 30334 431 33 330 a-a-CH3DCH2OH
583297.7615 0.0109 -2.9008 3 88.9517 29 47517 30314 8 7 13 7 6 a-a-CH3DCH2OH
583297.7646 0.0109 -2.9008 3 88.9517 29 47517 30314 8 6 13 7 7 a-a-CH3DCH2OH
583496.5582 0.0123 -5.3268 3 115.0055 39 47517 30319 613 19 316 a-a-CH3DCH2OH
584066.7916 0.0258 -5.1264 3 155.0140 47 47517 30323 519 23 222 a-a-CH3DCH2OH
585092.9737 0.0177 -3.1560 3 168.5135 49 47517 30324 520 23 419 a-a-CH3DCH2OH
586430.8630 0.0120 -3.8234 3 119.0805 43 47517 30321 318 20 219 a-a-CH3DCH2OH
586898.3537 0.0065 -2.9483 3 104.1409 35 47517 30317 711 16 610 a-a-CH3DCH2OH
586901.6929 0.0065 -2.9483 3 104.1408 35 47517 30317 710 16 611 a-a-CH3DCH2OH
586929.1193 0.8937 -3.9095 3 570.6065 89 47517 30344 638 43 737 a-a-CH3DCH2OH
587180.5732 1.8225 -4.8839 3 1039.2900119 47517 30359 951 581048 a-a-CH3DCH2OH
587374.8945 0.0360 -2.9808 3 356.0807 73 47517 30336 234 35 333 a-a-CH3DCH2OH
587710.3514 3.9827 -4.8889 3 931.1648119 47517 30359 158 59 059 a-a-CH3DCH2OH
587710.3557 3.9827 -4.8889 3 931.1648119 47517 30359 258 59 159 a-a-CH3DCH2OH
588782.3687 0.0395 -2.9786 3 356.0535 73 47517 30336 334 35 233 a-a-CH3DCH2OH
588943.8330 0.0075 -3.0173 3 126.0634 41 47517 30320 615 19 514 a-a-CH3DCH2OH
589087.7642 0.0094 -4.5105 3 69.1208 33 47517 30316 413 15 114 a-a-CH3DCH2OH
589558.5837 0.0072 -3.0167 3 126.0444 41 47517 30320 614 19 515 a-a-CH3DCH2OH
590584.2855 0.0322 -3.1177 3 365.4441 73 47517 30336 333 35 432 a-a-CH3DCH2OH
592782.6477 0.0139 -4.3822 3 92.1658 39 47517 30319 217 18 118 a-a-CH3DCH2OH
593043.3235 0.0434 -2.8916 3 364.9270 75 47517 30337 136 36 235 a-a-CH3DCH2OH
593085.7534 0.0435 -2.8915 3 364.9261 75 47517 30337 236 36 135 a-a-CH3DCH2OH
594915.3810 0.0223 -3.1644 3 182.2870 51 47517 30325 521 24 420 a-a-CH3DCH2OH
595021.1359 0.0601 -3.0959 3 345.5963 71 47517 30335 432 34 331 a-a-CH3DCH2OH
595738.9849 0.0121 -3.4095 3 148.6417 47 47517 30323 419 22 320 a-a-CH3DCH2OH
596138.8251 0.0299 -2.8451 3 86.5568 25 47517 30312 9 3 11 8 4 a-a-CH3DCH2OH
596138.8251 0.0299 -2.8451 3 86.5568 25 47517 30312 9 4 11 8 3 a-a-CH3DCH2OH
597836.0676 4.3912 -4.9394 3 962.4866121 47517 30360 159 60 060 a-a-CH3DCH2OH
597836.0705 4.3912 -4.9394 3 962.4866121 47517 30360 259 60 160 a-a-CH3DCH2OH
598203.8260 0.3791 -4.4792 3 413.5939 75 47517 30337 730 37 433 a-a-CH3DCH2OH
598262.1159 0.0625 -2.8232 3 372.6209 77 47517 30338 038 37 137 a-a-CH3DCH2OH
598262.6274 0.0625 -2.8232 3 372.6209 77 47517 30338 138 37 037 a-a-CH3DCH2OH
598410.1028 0.4245 -4.4669 3 435.1263 77 47517 30338 731 38 434 a-a-CH3DCH2OH
598485.8216 0.0108 -3.1396 3 154.6493 47 47517 30323 518 22 419 a-a-CH3DCH2OH
599335.5864 0.0334 -5.1129 3 168.0384 49 47517 30324 520 24 223 a-a-CH3DCH2OH
600044.0702 0.0115 -2.8858 3 96.7996 31 47517 30315 8 8 14 7 7 a-a-CH3DCH2OH
600044.0795 0.0115 -2.8858 3 96.7996 31 47517 30315 8 7 14 7 8 a-a-CH3DCH2OH
600593.6186 0.3421 -4.5019 3 392.5651 73 47517 30336 729 36 432 a-a-CH3DCH2OH
601119.8900 0.2827 -4.7580 3 336.9499 69 47517 30334 529 34 232 a-a-CH3DCH2OH
601312.5088 2.1784 -4.9387 3 1072.6610121 47517 30360 952 591049 a-a-CH3DCH2OH
601443.9797 0.4848 -4.4659 3 457.1587 79 47517 30339 732 39 435 a-a-CH3DCH2OH
601815.9575 3.4315 -4.7056 3 974.1515115 47517 30357 948 561047 a-a-CH3DCH2OH
603085.4847 0.0430 -2.9807 3 375.6932 75 47517 30337 235 36 334 a-a-CH3DCH2OH
603524.1341 0.0073 -2.9365 3 113.6850 37 47517 30318 712 17 611 a-a-CH3DCH2OH
603531.0999 0.0073 -2.9365 3 113.6848 37 47517 30318 711 17 612 a-a-CH3DCH2OH
603732.9073 0.0280 -3.1739 3 196.6605 53 47517 30326 522 25 421 a-a-CH3DCH2OH
604105.4640 0.0461 -2.9792 3 375.6734 75 47517 30337 335 36 234 a-a-CH3DCH2OH
604313.7593 0.5454 -4.5745 3 426.7185 77 47517 30338 632 38 335 a-a-CH3DCH2OH
604849.2868 0.1207 -3.3293 3 414.9507 77 47517 30338 434 37 533 a-a-CH3DCH2OH
604971.4470 0.0094 -3.0117 3 137.3358 43 47517 30321 616 20 515 a-a-CH3DCH2OH
605306.9643 0.3088 -4.5341 3 372.0452 71 47517 30335 728 35 431 a-a-CH3DCH2OH
605985.2929 0.0089 -3.0106 3 137.3048 43 47517 30321 615 20 516 a-a-CH3DCH2OH
606540.7249 2.7428 -4.4394 3 837.6111107 47517 30353 845 52 944 a-a-CH3DCH2OH
606580.7921 0.1240 -5.0773 3 257.1211 61 47517 30330 426 30 129 a-a-CH3DCH2OH
607493.3888 0.5686 -4.4764 3 479.6895 81 47517 30340 733 40 436 a-a-CH3DCH2OH
607897.8031 0.0652 -3.0905 3 365.1175 73 47517 30336 433 35 332 a-a-CH3DCH2OH
608046.1745 0.0367 -3.1079 3 385.3948 75 47517 30337 334 36 433 a-a-CH3DCH2OH
608336.7064 0.0096 -4.3926 3 78.0485 35 47517 30317 414 16 115 a-a-CH3DCH2OH
608405.8922 0.0129 -4.4436 3 82.5896 37 47517 30318 316 17 017 a-a-CH3DCH2OH
608590.0063 0.0517 -2.8964 3 384.7093 77 47517 30338 137 37 236 a-a-CH3DCH2OH
608619.4909 0.0519 -2.8963 3 384.7088 77 47517 30338 237 37 136 a-a-CH3DCH2OH
608887.8781 0.0698 -2.7900 3 87.9584 21 47517 3031010 0 9 9 1 a-a-CH3DCH2OH
608887.8781 0.0698 -2.7900 3 87.9584 21 47517 3031010 1 9 9 0 a-a-CH3DCH2OH
609329.9479 0.4163 -3.6054 3 489.7480 83 47517 30341 536 40 635 a-a-CH3DCH2OH
611614.1186 0.0350 -3.1836 3 211.6305 55 47517 30327 523 26 422 a-a-CH3DCH2OH
612037.0305 0.2769 -4.5743 3 352.0411 69 47517 30334 727 34 430 a-a-CH3DCH2OH
612916.4756 0.0305 -2.8306 3 93.2795 27 47517 30313 9 4 12 8 5 a-a-CH3DCH2OH
612916.4756 0.0305 -2.8306 3 93.2795 27 47517 30313 9 5 12 8 4 a-a-CH3DCH2OH
613807.7024 0.0749 -2.8310 3 392.5768 79 47517 30339 039 38 138 a-a-CH3DCH2OH
613808.0464 0.0749 -2.8310 3 392.5768 79 47517 30339 139 38 038 a-a-CH3DCH2OH
614881.2719 1.8444 -4.1666 3 711.3913 99 47517 30349 742 48 841 a-a-CH3DCH2OH
615968.5409 0.0432 -5.1071 3 181.5847 51 47517 30325 521 25 224 a-a-CH3DCH2OH
616702.5259 0.6847 -4.4987 3 502.7182 83 47517 30341 734 41 437 a-a-CH3DCH2OH
616775.9510 0.0125 -2.8726 3 105.2097 33 47517 30316 8 9 15 7 8 a-a-CH3DCH2OH
616775.9765 0.0125 -2.8726 3 105.2097 33 47517 30316 8 8 15 7 9 a-a-CH3DCH2OH
617856.8456 0.0140 -3.1479 3 167.5926 49 47517 30324 519 23 420 a-a-CH3DCH2OH
618636.8441 0.9990 -3.8840 3 595.4563 91 47517 30345 639 44 738 a-a-CH3DCH2OH
618664.3616 0.0434 -3.1928 3 227.1917 57 47517 30328 524 27 423 a-a-CH3DCH2OH
618742.3310 0.0509 -2.9832 3 395.8242 77 47517 30338 236 37 335 a-a-CH3DCH2OH
619478.7653 0.0537 -2.9821 3 395.8100 77 47517 30338 336 37 235 a-a-CH3DCH2OH
620109.8099 0.0089 -2.9268 3 123.7941 39 47517 30319 713 18 612 a-a-CH3DCH2OH
620123.6978 0.0089 -2.9268 3 123.7937 39 47517 30319 712 18 613 a-a-CH3DCH2OH
620453.0754 0.2456 -4.6212 3 332.5608 67 47517 30333 726 33 429 a-a-CH3DCH2OH
620778.4863 0.0123 -3.0087 3 149.1830 45 47517 30322 617 21 516 a-a-CH3DCH2OH
621301.6876 0.0707 -3.0877 3 385.1439 75 47517 30337 434 36 333 a-a-CH3DCH2OH
622404.6496 0.0115 -3.0071 3 149.1335 45 47517 30322 616 21 517 a-a-CH3DCH2OH
623307.5407 0.0145 -3.8565 3 130.5341 45 47517 30322 319 21 220 a-a-CH3DCH2OH
624130.3599 0.0614 -2.9033 3 405.0101 79 47517 30339 138 38 237 a-a-CH3DCH2OH
624150.8112 0.0615 -2.9033 3 405.0097 79 47517 30339 238 38 137 a-a-CH3DCH2OH
625016.7273 0.0534 -3.2010 3 243.3378 59 47517 30329 525 28 424 a-a-CH3DCH2OH
625072.9768 0.0434 -3.1023 3 405.8683 77 47517 30338 335 37 434 a-a-CH3DCH2OH
625233.3122 0.0150 -3.4443 3 161.4315 49 47517 30324 420 23 321 a-a-CH3DCH2OH
625676.7478 0.0704 -2.7778 3 93.5590 23 47517 3031110 1 10 9 2 a-a-CH3DCH2OH
625676.7478 0.0704 -2.7778 3 93.5590 23 47517 3031110 2 10 9 1 a-a-CH3DCH2OH
627162.1764 0.1155 -3.3049 3 436.2389 79 47517 30339 435 38 534 a-a-CH3DCH2OH
629059.6715 0.0098 -4.2946 3 87.4925 37 47517 30318 415 17 116 a-a-CH3DCH2OH
629171.6420 0.8406 -4.5322 3 526.2455 85 47517 30342 735 42 438 a-a-CH3DCH2OH
629348.5947 0.0890 -2.8407 3 413.0512 81 47517 30340 040 39 139 a-a-CH3DCH2OH
629348.8258 0.0890 -2.8407 3 413.0512 81 47517 30340 140 39 039 a-a-CH3DCH2OH
629687.9017 0.0314 -2.8172 3 100.5633 29 47517 30314 9 5 13 8 6 a-a-CH3DCH2OH
629687.9017 0.0314 -2.8172 3 100.5633 29 47517 30314 9 6 13 8 5 a-a-CH3DCH2OH
629705.8942 0.6809 -4.6374 3 448.2696 79 47517 30339 633 39 336 a-a-CH3DCH2OH
630117.4351 4.1081 -4.7268 3 1006.2868117 47517 30358 949 571048 a-a-CH3DCH2OH
630212.6483 0.2150 -4.6733 3 313.6133 65 47517 30332 725 32 428 a-a-CH3DCH2OH
630500.9660 0.0121 -5.2832 3 124.6772 41 47517 30320 615 20 318 a-a-CH3DCH2OH
630824.1897 0.0652 -3.2076 3 260.0614 61 47517 30330 526 29 425 a-a-CH3DCH2OH
632315.1871 0.0159 -4.3902 3 102.2433 41 47517 30320 218 19 119 a-a-CH3DCH2OH
633231.4801 0.3543 -4.8256 3 356.0535 71 47517 30335 530 35 233 a-a-CH3DCH2OH
633343.9950 0.0138 -5.2088 3 136.3894 43 47517 30321 616 21 319 a-a-CH3DCH2OH
633490.6825 0.0140 -2.8611 3 114.1823 35 47517 30317 810 16 7 9 a-a-CH3DCH2OH
633490.7475 0.0140 -2.8611 3 114.1823 35 47517 30317 8 9 16 710 a-a-CH3DCH2OH
633954.8692 0.0554 -5.1085 3 195.6524 53 47517 30326 522 26 225 a-a-CH3DCH2OH
634358.3175 0.0600 -2.9881 3 416.4735 79 47517 30339 237 38 336 a-a-CH3DCH2OH
634888.2243 0.0625 -2.9873 3 416.4633 79 47517 30339 337 38 236 a-a-CH3DCH2OH
635146.8386 0.0768 -3.0875 3 405.6770 77 47517 30338 435 37 334 a-a-CH3DCH2OH
636254.0012 0.0787 -3.2126 3 277.3544 63 47517 30331 527 30 426 a-a-CH3DCH2OH
636302.0531 0.0162 -3.0086 3 161.6075 47 47517 30323 618 22 517 a-a-CH3DCH2OH
636648.3068 0.0113 -2.9194 3 134.4688 41 47517 30320 714 19 613 a-a-CH3DCH2OH
636674.9050 0.0112 -2.9194 3 134.4680 41 47517 30320 713 19 614 a-a-CH3DCH2OH
637004.0088 0.0172 -5.1434 3 148.6417 45 47517 30322 617 22 320 a-a-CH3DCH2OH
637339.2015 0.4371 -3.5734 3 512.8471 85 47517 30342 537 41 636 a-a-CH3DCH2OH
638047.4815 3.2165 -4.4464 3 867.5292109 47517 30354 846 53 945 a-a-CH3DCH2OH
638214.3120 0.0182 -3.1613 3 181.0915 51 47517 30325 520 24 421 a-a-CH3DCH2OH
638843.9823 0.0149 -3.0063 3 161.5307 47 47517 30323 617 22 518 a-a-CH3DCH2OH
639664.8031 0.0725 -2.9124 3 425.8291 81 47517 30340 139 39 238 a-a-CH3DCH2OH
639678.9646 0.0726 -2.9124 3 425.8289 81 47517 30340 239 39 138 a-a-CH3DCH2OH
640242.0488 0.0145 -4.4257 3 92.1515 39 47517 30319 317 18 018 a-a-CH3DCH2OH
640973.1533 0.1854 -4.7292 3 295.2081 63 47517 30331 724 31 427 a-a-CH3DCH2OH
641484.0089 0.0939 -3.2158 3 295.2081 65 47517 30332 528 31 427 a-a-CH3DCH2OH
641580.0297 0.0227 -5.0868 3 161.4315 47 47517 30323 618 23 321 a-a-CH3DCH2OH
641747.4675 0.0520 -3.1007 3 426.8632 79 47517 30339 336 38 435 a-a-CH3DCH2OH
642047.4652 0.1565 -5.1349 3 273.7917 63 47517 30331 427 31 130 a-a-CH3DCH2OH
642463.2313 0.0712 -2.7658 3 99.7201 25 47517 3031210 2 11 9 3 a-a-CH3DCH2OH
642463.2313 0.0712 -2.7658 3 99.7201 25 47517 3031210 3 11 9 2 a-a-CH3DCH2OH
644884.6812 0.1050 -2.8524 3 434.0441 83 47517 30341 041 40 140 a-a-CH3DCH2OH
644884.8364 0.1050 -2.8524 3 434.0441 83 47517 30341 141 40 040 a-a-CH3DCH2OH
644954.8262 1.0422 -4.5764 3 550.2728 87 47517 30343 736 43 439 a-a-CH3DCH2OH
646451.5764 0.0327 -2.8052 3 108.4084 31 47517 30315 9 7 14 8 6 a-a-CH3DCH2OH
646451.5765 0.0327 -2.8052 3 108.4084 31 47517 30315 9 6 14 8 7 a-a-CH3DCH2OH
646699.6321 0.1103 -3.2173 3 313.6133 67 47517 30333 529 32 428 a-a-CH3DCH2OH
647166.8347 0.0302 -5.0386 3 174.7560 49 47517 30324 619 24 322 a-a-CH3DCH2OH
647720.4807 2.0945 -4.1570 3 739.0694101 47517 30350 743 49 842 a-a-CH3DCH2OH
648439.8401 0.1074 -3.2869 3 458.0599 81 47517 30340 436 39 535 a-a-CH3DCH2OH
649352.9666 0.0839 -3.0898 3 426.7185 79 47517 30339 436 38 335 a-a-CH3DCH2OH
649943.0863 0.0704 -2.9954 3 437.6409 81 47517 30340 238 39 337 a-a-CH3DCH2OH
650182.0441 1.0962 -3.8598 3 620.8634 93 47517 30346 640 45 739 a-a-CH3DCH2OH
650185.3001 0.0160 -2.8516 3 123.7177 37 47517 30318 811 17 710 a-a-CH3DCH2OH
650185.4561 0.0160 -2.8516 3 123.7177 37 47517 30318 810 17 711 a-a-CH3DCH2OH
650323.1919 0.0725 -2.9948 3 437.6335 81 47517 30340 338 39 237 a-a-CH3DCH2OH
651300.0534 0.0103 -4.2152 3 97.4505 39 47517 30319 416 18 117 a-a-CH3DCH2OH
651463.6756 0.0210 -3.0114 3 174.6127 49 47517 30324 619 23 518 a-a-CH3DCH2OH
652089.9060 0.1275 -3.2175 3 332.5608 69 47517 30334 530 33 429 a-a-CH3DCH2OH
652401.0401 0.1575 -4.7879 3 277.3544 61 47517 30330 723 30 426 a-a-CH3DCH2OH
653131.1966 0.0145 -2.9142 3 145.7100 43 47517 30321 715 20 614 a-a-CH3DCH2OH
653180.3383 0.0145 -2.9141 3 145.7084 43 47517 30321 714 20 615 a-a-CH3DCH2OH
653270.3837 0.0702 -5.1162 3 210.2410 55 47517 30327 523 27 226 a-a-CH3DCH2OH
653852.9748 0.0399 -4.9986 3 188.6129 51 47517 30325 620 25 323 a-a-CH3DCH2OH
655193.5901 0.0851 -2.9234 3 447.1663 83 47517 30341 140 40 239 a-a-CH3DCH2OH
655203.3809 0.0852 -2.9234 3 447.1661 83 47517 30341 240 40 139 a-a-CH3DCH2OH
655342.3432 0.0192 -3.0081 3 174.4963 49 47517 30324 618 23 519 a-a-CH3DCH2OH
656682.0862 0.0195 -3.4839 3 174.7560 51 47517 30325 421 24 322 a-a-CH3DCH2OH
657841.2150 0.1448 -3.2167 3 352.0411 71 47517 30335 531 34 430 a-a-CH3DCH2OH
657882.1146 0.8405 -4.7060 3 470.3317 81 47517 30340 634 40 337 a-a-CH3DCH2OH
658140.7468 0.0625 -3.1024 3 448.3785 81 47517 30340 337 39 436 a-a-CH3DCH2OH
659246.4365 0.0723 -2.7546 3 106.4418 27 47517 3031310 3 12 9 4 a-a-CH3DCH2OH
659246.4365 0.0723 -2.7546 3 106.4418 27 47517 3031310 4 12 9 3 a-a-CH3DCH2OH
659770.4827 0.0238 -3.1800 3 195.1433 53 47517 30326 521 25 422 a-a-CH3DCH2OH
659799.0556 4.8802 -4.7485 3 1038.9908119 47517 30359 950 581049 a-a-CH3DCH2OH
660415.8484 0.1231 -2.8659 3 455.5551 85 47517 30342 042 41 141 a-a-CH3DCH2OH
660415.9525 0.1231 -2.8659 3 455.5551 85 47517 30342 142 41 041 a-a-CH3DCH2OH
661474.4823 0.0183 -3.8882 3 142.5122 47 47517 30323 320 22 221 a-a-CH3DCH2OH
661718.9207 0.0519 -4.9666 3 203.0000 53 47517 30326 621 26 324 a-a-CH3DCH2OH
663205.8275 0.0343 -2.7948 3 116.8149 33 47517 30316 9 8 15 8 7 a-a-CH3DCH2OH
663205.8278 0.0343 -2.7948 3 116.8149 33 47517 30316 9 7 15 8 8 a-a-CH3DCH2OH
663848.7953 0.0920 -3.0945 3 448.2696 81 47517 30340 437 39 336 a-a-CH3DCH2OH
664055.6414 1.2933 -4.6305 3 574.8018 89 47517 30344 737 44 440 a-a-CH3DCH2OH
664128.1180 0.1613 -3.2154 3 372.0452 73 47517 30336 532 35 431 a-a-CH3DCH2OH
664178.1201 0.1317 -4.8484 3 260.0614 59 47517 30329 722 29 425 a-a-CH3DCH2OH
664391.5976 0.4468 -3.5461 3 536.4911 87 47517 30343 538 42 637 a-a-CH3DCH2OH
665503.7839 0.0821 -3.0048 3 459.3259 83 47517 30341 239 40 338 a-a-CH3DCH2OH
665775.6484 0.0839 -3.0045 3 459.3206 83 47517 30341 339 40 238 a-a-CH3DCH2OH
666168.2589 0.0270 -3.0171 3 188.2021 51 47517 30325 620 24 519 a-a-CH3DCH2OH
666856.5794 0.0189 -2.8440 3 133.8164 39 47517 30319 812 18 711 a-a-CH3DCH2OH
666856.9331 0.0189 -2.8440 3 133.8164 39 47517 30319 811 18 712 a-a-CH3DCH2OH
667247.7705 0.4373 -4.8936 3 375.6734 73 47517 30336 531 36 234 a-a-CH3DCH2OH
668751.1606 0.0978 -3.2749 3 480.4110 83 47517 30341 437 40 536 a-a-CH3DCH2OH
669548.2287 0.0187 -2.9112 3 157.5182 45 47517 30322 716 21 615 a-a-CH3DCH2OH
669636.1206 0.0187 -2.9111 3 157.5155 45 47517 30322 715 21 616 a-a-CH3DCH2OH
670631.7428 3.7192 -4.4532 3 898.0142111 47517 30355 847 54 946 a-a-CH3DCH2OH
670716.8589 0.0995 -2.9364 3 469.0213 85 47517 30342 141 41 240 a-a-CH3DCH2OH
670723.6181 0.0995 -2.9364 3 469.0212 85 47517 30342 241 41 140 a-a-CH3DCH2OH
670835.3871 0.0665 -4.9423 3 217.9152 55 47517 30327 622 27 325 a-a-CH3DCH2OH
671101.9197 0.1765 -3.2142 3 392.5651 75 47517 30337 533 36 432 a-a-CH3DCH2OH
671952.9861 0.0243 -3.0125 3 188.0301 51 47517 30325 619 24 520 a-a-CH3DCH2OH
672075.4589 0.0182 -4.3966 3 112.8421 43 47517 30321 219 20 120 a-a-CH3DCH2OH
672849.1913 0.0164 -4.4140 3 102.2333 41 47517 30320 318 19 019 a-a-CH3DCH2OH
673878.0869 0.0879 -5.1296 3 225.3500 57 47517 30328 524 28 227 a-a-CH3DCH2OH
674312.2067 0.0747 -3.1073 3 470.4132 83 47517 30341 338 40 437 a-a-CH3DCH2OH
675051.9706 0.0114 -4.1523 3 107.9215 41 47517 30320 417 19 118 a-a-CH3DCH2OH
675941.9807 0.1435 -2.8813 3 477.5842 87 47517 30343 043 42 142 a-a-CH3DCH2OH
675942.0505 0.1435 -2.8813 3 477.5842 87 47517 30343 143 42 042 a-a-CH3DCH2OH
676005.6621 0.1084 -4.9101 3 243.3378 57 47517 30328 721 28 424 a-a-CH3DCH2OH
676025.3702 0.0737 -2.7443 3 113.7242 29 47517 3031410 4 13 9 5 a-a-CH3DCH2OH
676025.3702 0.0737 -2.7443 3 113.7242 29 47517 3031410 5 13 9 4 a-a-CH3DCH2OH
678496.2291 0.1946 -5.1900 3 290.9811 65 47517 30332 428 32 131 a-a-CH3DCH2OH
678573.3808 0.1014 -3.1016 3 470.3317 83 47517 30341 438 40 337 a-a-CH3DCH2OH
678879.0373 0.1896 -3.2137 3 413.5939 77 47517 30338 534 37 433 a-a-CH3DCH2OH
679948.8354 0.0365 -2.7859 3 125.7831 35 47517 30317 9 9 16 8 8 a-a-CH3DCH2OH
679948.8363 0.0365 -2.7859 3 125.7831 35 47517 30317 9 8 16 8 9 a-a-CH3DCH2OH
680304.8799 0.0341 -3.0259 3 202.3800 53 47517 30326 621 25 520 a-a-CH3DCH2OH
680924.3879 2.3407 -4.1475 3 767.3095103 47517 30351 744 50 843 a-a-CH3DCH2OH
681045.6574 0.0954 -3.0165 3 481.5285 85 47517 30342 240 41 339 a-a-CH3DCH2OH
681239.5841 0.0968 -3.0162 3 481.5247 85 47517 30342 340 41 239 a-a-CH3DCH2OH
681261.8805 0.0838 -4.9255 3 233.3568 57 47517 30328 623 28 326 a-a-CH3DCH2OH
681331.2072 1.1799 -3.8373 3 646.8248 95 47517 30347 641 46 740 a-a-CH3DCH2OH
682743.1139 0.0312 -3.2044 3 209.7452 55 47517 30327 522 26 423 a-a-CH3DCH2OH
683501.0111 0.0225 -2.8383 3 144.4788 41 47517 30320 813 19 712 a-a-CH3DCH2OH
683501.7754 0.0225 -2.8383 3 144.4788 41 47517 30320 812 19 713 a-a-CH3DCH2OH
684302.7746 1.1186 -4.6228 3 609.2563 91 47517 30345 837 45 540 a-a-CH3DCH2OH
685750.1197 1.2330 -4.6337 3 635.3034 93 47517 30346 838 46 541 a-a-CH3DCH2OH
685853.1983 1.0430 -4.6217 3 583.7047 89 47517 30344 836 44 539 a-a-CH3DCH2OH
685886.6909 0.0239 -2.9104 3 169.8947 47 47517 30323 717 22 616 a-a-CH3DCH2OH
686039.3155 0.0238 -2.9102 3 169.8899 47 47517 30323 716 22 617 a-a-CH3DCH2OH
686234.6658 0.1157 -2.9514 3 491.3941 87 47517 30343 142 42 241 a-a-CH3DCH2OH
686239.3257 0.1157 -2.9514 3 491.3940 87 47517 30343 242 42 141 a-a-CH3DCH2OH
686422.3369 1.5959 -4.6930 3 599.8344 91 47517 30345 738 45 441 a-a-CH3DCH2OH
687532.0778 0.2005 -3.2144 3 435.1263 79 47517 30339 535 38 434 a-a-CH3DCH2OH
687607.6243 0.0879 -4.9729 3 227.1917 55 47517 30327 720 27 423 a-a-CH3DCH2OH
688190.8072 0.0891 -3.2684 3 503.2899 85 47517 30342 438 41 537 a-a-CH3DCH2OH
688635.6636 1.0243 -4.7783 3 492.9059 83 47517 30341 635 41 338 a-a-CH3DCH2OH
688745.9174 0.0303 -3.0197 3 202.1312 53 47517 30326 620 25 521 a-a-CH3DCH2OH
690050.2927 0.0263 -3.5270 3 188.6129 53 47517 30326 422 25 323 a-a-CH3DCH2OH
690153.4156 0.9861 -4.6295 3 558.6528 87 47517 30343 835 43 538 a-a-CH3DCH2OH
690310.3726 0.0885 -3.1151 3 492.9665 85 47517 30342 339 41 438 a-a-CH3DCH2OH
690359.8734 0.4442 -3.5239 3 560.6768 89 47517 30344 539 43 638 a-a-CH3DCH2OH
690396.6743 1.4100 -4.6548 3 661.8437 95 47517 30347 839 47 542 a-a-CH3DCH2OH
690846.4168 5.7384 -4.7704 3 1072.2628121 47517 30360 951 591050 a-a-CH3DCH2OH
691462.9617 0.1663 -2.8985 3 500.1312 89 47517 30344 044 43 143 a-a-CH3DCH2OH
691463.0085 0.1663 -2.8985 3 500.1312 89 47517 30344 144 43 043 a-a-CH3DCH2OH
692798.9383 0.0755 -2.7351 3 121.5674 31 47517 3031510 5 14 9 6 a-a-CH3DCH2OH
692798.9383 0.0755 -2.7351 3 121.5674 31 47517 3031510 6 14 9 5 a-a-CH3DCH2OH
693045.5005 0.1045 -4.9158 3 249.3232 59 47517 30329 624 29 327 a-a-CH3DCH2OH
693476.0745 0.1122 -3.1109 3 492.9059 85 47517 30342 439 41 338 a-a-CH3DCH2OH
693750.4399 0.0426 -3.0378 3 217.1509 55 47517 30327 622 26 521 a-a-CH3DCH2OH
695729.0705 0.1091 -5.1481 3 240.9791 59 47517 30329 525 29 228 a-a-CH3DCH2OH
696572.5218 0.1102 -3.0302 3 504.2484 87 47517 30343 241 42 340 a-a-CH3DCH2OH
696678.6307 0.0394 -2.7786 3 135.3133 37 47517 30318 910 17 8 9 a-a-CH3DCH2OH
696678.6331 0.0394 -2.7786 3 135.3133 37 47517 30318 9 9 17 810 a-a-CH3DCH2OH
696710.5109 0.1115 -3.0300 3 504.2457 87 47517 30343 341 42 240 a-a-CH3DCH2OH
696912.6651 0.9339 -4.6452 3 534.1064 85 47517 30342 834 42 537 a-a-CH3DCH2OH
697086.2453 0.2093 -3.2166 3 457.1587 81 47517 30340 536 39 435 a-a-CH3DCH2OH
698396.4793 1.6711 -4.6864 3 688.8767 97 47517 30348 840 48 543 a-a-CH3DCH2OH
698734.5604 0.0701 -5.0367 3 211.6305 53 47517 30326 719 26 422 a-a-CH3DCH2OH
700114.7665 0.0271 -2.8345 3 155.7052 43 47517 30321 814 20 713 a-a-CH3DCH2OH
700116.3488 0.0271 -2.8345 3 155.7051 43 47517 30321 813 20 714 a-a-CH3DCH2OH
700270.5578 0.0134 -4.1040 3 118.9055 43 47517 30321 418 20 119 a-a-CH3DCH2OH
700731.6374 0.0236 -3.9179 3 155.0140 49 47517 30324 321 23 222 a-a-CH3DCH2OH
701747.0102 0.1340 -2.9682 3 514.2845 89 47517 30344 143 43 242 a-a-CH3DCH2OH
701750.2188 0.1340 -2.9682 3 514.2844 89 47517 30344 243 43 142 a-a-CH3DCH2OH
702130.5574 0.0301 -2.9118 3 182.8402 49 47517 30324 718 23 617 a-a-CH3DCH2OH
702388.5178 0.0298 -2.9115 3 182.8323 49 47517 30324 717 23 618 a-a-CH3DCH2OH
702893.6115 0.5319 -4.9607 3 395.8100 75 47517 30337 532 37 235 a-a-CH3DCH2OH
704114.2723 4.2379 -4.4596 3 929.0645113 47517 30356 848 55 947 a-a-CH3DCH2OH
705163.9009 0.0117 -5.2348 3 63.1565 31 47517 30315 511 14 212 a-a-CH3DCH2OH
705805.0310 0.8791 -4.6674 3 510.0731 83 47517 30341 833 41 536 a-a-CH3DCH2OH
705810.3923 0.0373 -3.0299 3 216.7989 55 47517 30327 621 26 522 a-a-CH3DCH2OH
706139.2040 0.0185 -4.4072 3 112.8352 43 47517 30321 319 20 020 a-a-CH3DCH2OH
706174.1822 0.1039 -3.1256 3 516.0377 87 47517 30343 340 42 439 a-a-CH3DCH2OH
706220.0195 0.1289 -4.9130 3 265.8131 61 47517 30330 625 30 328 a-a-CH3DCH2OH
706377.0086 0.0529 -3.0528 3 232.5191 57 47517 30328 623 27 522 a-a-CH3DCH2OH
706866.9930 0.0847 -3.2669 3 526.6942 87 47517 30343 439 42 538 a-a-CH3DCH2OH
706978.6745 0.1917 -2.9175 3 523.1959 91 47517 30345 045 44 144 a-a-CH3DCH2OH
706978.7058 0.1917 -2.9175 3 523.1959 91 47517 30345 145 44 044 a-a-CH3DCH2OH
707341.4826 0.0411 -3.2349 3 224.8944 57 47517 30328 523 27 424 a-a-CH3DCH2OH
707522.1622 0.2163 -3.2208 3 479.6895 83 47517 30341 537 40 436 a-a-CH3DCH2OH
708515.6992 0.1247 -3.1225 3 515.9928 87 47517 30343 440 42 339 a-a-CH3DCH2OH
709169.3821 0.0550 -5.1020 3 196.6605 51 47517 30325 718 25 421 a-a-CH3DCH2OH
709565.9447 0.0778 -2.7272 3 129.9717 33 47517 3031610 6 15 9 7 a-a-CH3DCH2OH
709565.9447 0.0778 -2.7272 3 129.9717 33 47517 3031610 7 15 9 6 a-a-CH3DCH2OH
709856.0478 2.0311 -4.7284 3 716.4027 99 47517 30349 841 49 544 a-a-CH3DCH2OH
711858.5920 1.2443 -3.8173 3 673.3375 97 47517 30348 642 47 741 a-a-CH3DCH2OH
711864.1601 0.0208 -4.4022 3 123.9620 45 47517 30322 220 21 121 a-a-CH3DCH2OH
711945.1794 1.9503 -4.7627 3 625.3722 93 47517 30346 739 46 442 a-a-CH3DCH2OH
712087.1227 0.1269 -3.0459 3 527.4855 89 47517 30344 242 43 341 a-a-CH3DCH2OH
712185.0831 0.1279 -3.0458 3 527.4836 89 47517 30344 342 43 241 a-a-CH3DCH2OH
713393.0900 0.0430 -2.7730 3 145.4056 39 47517 30319 911 18 810 a-a-CH3DCH2OH
713393.0963 0.0430 -2.7730 3 145.4056 39 47517 30319 910 18 811 a-a-CH3DCH2OH
714249.7608 2.5740 -4.1381 3 796.1092105 47517 30352 745 51 844 a-a-CH3DCH2OH
715164.2536 0.4288 -3.5072 3 585.4010 91 47517 30345 540 44 639 a-a-CH3DCH2OH
715646.7350 0.2388 -5.2421 3 308.6894 67 47517 30333 429 33 132 a-a-CH3DCH2OH
715726.8644 0.0120 -5.0701 3 71.7955 33 47517 30316 512 15 213 a-a-CH3DCH2OH
716480.2576 0.8191 -4.6947 3 486.5616 81 47517 30340 832 40 535 a-a-CH3DCH2OH
716693.6460 0.0327 -2.8326 3 167.4962 45 47517 30322 815 21 714 a-a-CH3DCH2OH
716696.7980 0.0327 -2.8326 3 167.4961 45 47517 30322 814 21 715 a-a-CH3DCH2OH
717253.8518 0.1544 -2.9868 3 537.6923 91 47517 30345 144 44 243 a-a-CH3DCH2OH
717256.0586 0.1545 -2.9868 3 537.6922 91 47517 30345 244 44 143 a-a-CH3DCH2OH
718062.9805 0.0651 -3.0706 3 248.4888 59 47517 30329 624 28 523 a-a-CH3DCH2OH
718259.3833 0.0374 -2.9154 3 196.3562 51 47517 30325 719 24 618 a-a-CH3DCH2OH
718684.6336 0.0369 -2.9150 3 196.3431 51 47517 30325 718 24 619 a-a-CH3DCH2OH
718735.2354 0.0424 -5.1696 3 182.2870 49 47517 30324 717 24 420 a-a-CH3DCH2OH
718763.6948 0.1341 -5.1711 3 257.1281 61 47517 30330 526 30 229 a-a-CH3DCH2OH
718784.1567 0.2224 -3.2271 3 502.7182 85 47517 30342 538 41 437 a-a-CH3DCH2OH
720805.2543 0.1577 -4.9166 3 282.8253 63 47517 30331 626 31 329 a-a-CH3DCH2OH
721720.3630 1.2318 -4.8528 3 515.9928 85 47517 30342 636 42 339 a-a-CH3DCH2OH
721934.4124 0.1210 -3.1385 3 539.6263 89 47517 30344 341 43 440 a-a-CH3DCH2OH
722489.0016 0.2200 -2.9382 3 546.7782 93 47517 30346 046 45 145 a-a-CH3DCH2OH
722489.0226 0.2200 -2.9382 3 546.7782 93 47517 30346 146 45 045 a-a-CH3DCH2OH
723257.1762 0.0454 -3.0430 3 232.0317 57 47517 30328 622 27 523 a-a-CH3DCH2OH
723659.3521 0.1390 -3.1363 3 539.5932 89 47517 30344 441 43 340 a-a-CH3DCH2OH
724832.9806 2.4980 -4.7804 3 744.4231101 47517 30350 842 50 545 a-a-CH3DCH2OH
724890.9970 0.0878 -3.2700 3 550.6221 89 47517 30344 440 43 539 a-a-CH3DCH2OH
725250.3152 0.0361 -3.5721 3 203.0000 55 47517 30327 423 26 324 a-a-CH3DCH2OH
726313.8936 0.0121 -4.9130 3 81.0001 35 47517 30317 513 16 214 a-a-CH3DCH2OH
726325.0911 0.0807 -2.7207 3 138.9371 35 47517 3031710 7 16 9 8 a-a-CH3DCH2OH
726325.0911 0.0807 -2.7207 3 138.9371 35 47517 3031710 8 16 9 7 a-a-CH3DCH2OH
726883.4422 0.0165 -4.0683 3 130.4031 45 47517 30322 419 21 120 a-a-CH3DCH2OH
727591.4123 0.1455 -3.0636 3 551.2395 91 47517 30345 243 44 342 a-a-CH3DCH2OH
727660.8071 0.1463 -3.0636 3 551.2382 91 47517 30345 343 44 242 a-a-CH3DCH2OH
728575.8065 0.7539 -4.7259 3 463.5815 79 47517 30339 831 39 534 a-a-CH3DCH2OH
728706.8933 0.0798 -3.0912 3 265.0630 61 47517 30330 625 29 524 a-a-CH3DCH2OH
730089.9319 0.0475 -2.7692 3 156.0604 41 47517 30320 912 19 811 a-a-CH3DCH2OH
730089.9473 0.0475 -2.7692 3 156.0604 41 47517 30320 911 19 812 a-a-CH3DCH2OH
730791.6019 0.2283 -3.2356 3 526.2455 87 47517 30343 539 42 438 a-a-CH3DCH2OH
732755.1233 0.1773 -3.0072 3 561.6173 93 47517 30346 145 45 244 a-a-CH3DCH2OH
732756.6395 0.1773 -3.0072 3 561.6173 93 47517 30346 245 45 144 a-a-CH3DCH2OH
733233.0061 0.0394 -2.8327 3 179.8522 47 47517 30323 816 22 715 a-a-CH3DCH2OH
733239.0707 0.0394 -2.8327 3 179.8520 47 47517 30323 815 22 716 a-a-CH3DCH2OH
733749.6871 0.0546 -3.2713 3 240.5878 59 47517 30329 524 28 425 a-a-CH3DCH2OH
734246.9080 0.0459 -2.9214 3 210.4440 53 47517 30326 720 25 619 a-a-CH3DCH2OH
734931.8784 0.0452 -2.9207 3 210.4231 53 47517 30326 719 25 620 a-a-CH3DCH2OH
736806.7424 0.1915 -4.9262 3 300.3589 65 47517 30332 627 32 330 a-a-CH3DCH2OH
737140.6639 0.0121 -4.7636 3 90.7637 37 47517 30318 514 17 215 a-a-CH3DCH2OH
737615.0779 0.1399 -3.1538 3 563.7318 91 47517 30345 342 44 441 a-a-CH3DCH2OH
737993.8255 0.2514 -2.9607 3 570.8778 95 47517 30347 047 46 146 a-a-CH3DCH2OH
737993.8396 0.2514 -2.9607 3 570.8778 95 47517 30347 147 46 046 a-a-CH3DCH2OH
738241.3435 0.0975 -3.1139 3 282.2437 63 47517 30331 626 30 525 a-a-CH3DCH2OH
738281.6630 4.7579 -4.4655 3 960.6782115 47517 30357 849 56 948 a-a-CH3DCH2OH
738776.6824 0.4016 -3.4963 3 610.6604 93 47517 30346 541 45 640 a-a-CH3DCH2OH
738881.1031 0.1553 -3.1523 3 563.7075 91 47517 30345 442 44 341 a-a-CH3DCH2OH
739878.9440 0.6380 -5.0261 3 416.4633 77 47517 30338 533 38 236 a-a-CH3DCH2OH
740026.2890 0.0208 -4.4047 3 123.9571 45 47517 30322 320 21 021 a-a-CH3DCH2OH
740457.7863 2.3553 -4.8379 3 651.4169 95 47517 30347 740 47 443 a-a-CH3DCH2OH
740859.1112 0.0307 -3.9451 3 168.0384 51 47517 30325 322 24 223 a-a-CH3DCH2OH
741220.2995 0.0549 -3.0595 3 247.8282 59 47517 30329 623 28 524 a-a-CH3DCH2OH
741554.8719 1.2841 -3.8003 3 700.3981 99 47517 30349 643 48 742 a-a-CH3DCH2OH
741728.0357 0.6853 -4.7596 3 441.1430 77 47517 30338 830 38 533 a-a-CH3DCH2OH
742369.4542 0.0995 -3.2771 3 575.0716 91 47517 30345 441 44 540 a-a-CH3DCH2OH
742913.0092 0.1636 -5.1980 3 273.7967 63 47517 30331 527 31 230 a-a-CH3DCH2OH
743074.9761 0.0843 -2.7156 3 148.4638 37 47517 3031810 8 17 9 9 a-a-CH3DCH2OH
743074.9761 0.0843 -2.7156 3 148.4638 37 47517 3031810 9 17 9 8 a-a-CH3DCH2OH
743086.7594 0.1662 -3.0833 3 575.5103 93 47517 30346 244 45 343 a-a-CH3DCH2OH
743135.8203 0.1669 -3.0832 3 575.5094 93 47517 30346 344 45 243 a-a-CH3DCH2OH
743332.6891 3.0741 -4.8414 3 772.9399103 47517 30351 843 51 546 a-a-CH3DCH2OH
743450.5855 0.2347 -3.2463 3 550.2728 89 47517 30344 540 43 439 a-a-CH3DCH2OH
746643.6857 0.1188 -3.1382 3 300.0308 65 47517 30332 627 31 526 a-a-CH3DCH2OH
746766.7106 0.0531 -2.7670 3 167.2779 43 47517 30321 913 20 812 a-a-CH3DCH2OH
746766.7465 0.0531 -2.7670 3 167.2779 43 47517 30321 912 20 813 a-a-CH3DCH2OH
747447.7054 2.7838 -4.1295 3 825.4657107 47517 30353 746 52 845 a-a-CH3DCH2OH
748250.7386 0.2027 -3.0294 3 586.0594 95 47517 30347 146 46 245 a-a-CH3DCH2OH
748251.7792 0.2028 -3.0294 3 586.0594 95 47517 30347 246 46 145 a-a-CH3DCH2OH
748438.5292 0.0121 -4.6227 3 101.0792 39 47517 30319 515 18 216 a-a-CH3DCH2OH
749727.6536 0.0473 -2.8347 3 192.7737 49 47517 30324 817 23 716 a-a-CH3DCH2OH
749738.9602 0.0473 -2.8347 3 192.7734 49 47517 30324 816 23 717 a-a-CH3DCH2OH
750059.3553 0.0557 -2.9296 3 225.1053 55 47517 30327 721 26 620 a-a-CH3DCH2OH
751139.0188 0.0545 -2.9286 3 225.0725 55 47517 30327 720 26 621 a-a-CH3DCH2OH
751515.8448 0.0235 -4.4077 3 135.6027 47 47517 30323 221 22 122 a-a-CH3DCH2OH
753234.7063 0.1607 -3.1714 3 588.3539 93 47517 30346 343 45 442 a-a-CH3DCH2OH
753493.0287 0.2861 -2.9848 3 595.4947 97 47517 30348 048 47 147 a-a-CH3DCH2OH
753493.0381 0.2861 -2.9848 3 595.4947 97 47517 30348 148 47 047 a-a-CH3DCH2OH
753940.8597 0.1440 -3.1634 3 318.4223 67 47517 30333 628 32 527 a-a-CH3DCH2OH
754160.7432 0.1736 -3.1702 3 588.3360 93 47517 30346 443 45 342 a-a-CH3DCH2OH
754215.7324 0.2310 -4.9414 3 318.4131 67 47517 30333 628 33 331 a-a-CH3DCH2OH
754556.6724 0.0409 -5.1744 3 181.0915 49 47517 30324 718 24 421 a-a-CH3DCH2OH
754621.7365 0.0529 -5.1150 3 195.1433 51 47517 30325 719 25 422 a-a-CH3DCH2OH
754800.7764 0.0209 -4.0431 3 142.4152 47 47517 30323 420 22 121 a-a-CH3DCH2OH
755195.8333 0.0673 -5.0618 3 209.7452 53 47517 30326 720 26 423 a-a-CH3DCH2OH
755581.1361 0.6154 -4.7948 3 419.2560 75 47517 30337 829 37 532 a-a-CH3DCH2OH
756383.4165 0.0842 -5.0148 3 224.8944 55 47517 30327 721 27 424 a-a-CH3DCH2OH
756663.8709 0.2424 -3.2593 3 574.8018 91 47517 30345 541 44 440 a-a-CH3DCH2OH
756859.9286 1.4620 -4.9280 3 539.5932 87 47517 30343 637 43 340 a-a-CH3DCH2OH
758290.7489 0.1038 -4.9739 3 240.5878 57 47517 30328 722 28 425 a-a-CH3DCH2OH
758574.1053 0.1892 -3.1047 3 600.2977 95 47517 30347 245 46 344 a-a-CH3DCH2OH
758608.7263 0.1897 -3.1047 3 600.2970 95 47517 30347 345 46 244 a-a-CH3DCH2OH
759399.5048 0.1186 -3.2878 3 600.0414 93 47517 30346 442 45 541 a-a-CH3DCH2OH
759814.0938 0.0888 -2.7120 3 158.5520 39 47517 303191010 18 9 9 a-a-CH3DCH2OH
759814.0939 0.0888 -2.7120 3 158.5520 39 47517 3031910 9 18 910 a-a-CH3DCH2OH
759857.9006 0.0661 -3.0794 3 264.1861 61 47517 30330 624 29 525 a-a-CH3DCH2OH
760207.6495 0.1736 -3.1888 3 337.4142 69 47517 30334 629 33 528 a-a-CH3DCH2OH
760449.3412 0.0121 -4.4912 3 111.9389 41 47517 30320 516 19 217 a-a-CH3DCH2OH
761023.8452 0.1264 -4.9390 3 256.8225 59 47517 30329 723 29 426 a-a-CH3DCH2OH
761218.9116 0.3648 -3.4910 3 636.4522 95 47517 30347 542 46 641 a-a-CH3DCH2OH
762109.9260 0.0728 -3.3133 3 256.8225 61 47517 30330 525 29 426 a-a-CH3DCH2OH
762150.5962 0.0492 -3.6179 3 217.9152 57 47517 30328 424 27 325 a-a-CH3DCH2OH
763420.8078 0.0599 -2.7666 3 179.0585 45 47517 30322 914 21 813 a-a-CH3DCH2OH
763420.8877 0.0599 -2.7666 3 179.0585 45 47517 30322 913 21 814 a-a-CH3DCH2OH
763740.5990 0.2310 -3.0534 3 611.0184 97 47517 30348 147 47 246 a-a-CH3DCH2OH
763741.3126 0.2310 -3.0534 3 611.0184 97 47517 30348 247 47 146 a-a-CH3DCH2OH
764686.3800 0.1522 -4.9102 3 273.5955 61 47517 30330 724 30 427 a-a-CH3DCH2OH
765304.3221 3.7583 -4.9107 3 801.9549105 47517 30352 844 52 547 a-a-CH3DCH2OH
765559.8869 0.2078 -3.2137 3 357.0011 71 47517 30335 630 34 529 a-a-CH3DCH2OH
765653.4536 0.0670 -2.9401 3 240.3422 57 47517 30328 722 27 621 a-a-CH3DCH2OH
766171.6975 0.0564 -2.8387 3 206.2614 51 47517 30325 818 24 717 a-a-CH3DCH2OH
766192.1783 0.0564 -2.8386 3 206.2608 51 47517 30325 817 24 718 a-a-CH3DCH2OH
767320.8712 0.0652 -2.9388 3 240.2919 57 47517 30328 721 27 622 a-a-CH3DCH2OH
768807.4468 0.1835 -3.1910 3 613.4921 95 47517 30347 344 46 443 a-a-CH3DCH2OH
768951.7896 2.6543 -4.8935 3 842.3727107 47517 30353 944 53 647 a-a-CH3DCH2OH
768986.4934 0.3243 -3.0106 3 620.6285 99 47517 30349 049 48 148 a-a-CH3DCH2OH
768986.4997 0.3243 -3.0106 3 620.6285 99 47517 30349 149 48 048 a-a-CH3DCH2OH
769288.8158 2.4912 -4.8721 3 812.3209105 47517 30352 943 52 646 a-a-CH3DCH2OH
769377.6126 0.1817 -4.8873 3 290.9042 63 47517 30331 725 31 428 a-a-CH3DCH2OH
769482.6642 0.1943 -3.1902 3 613.4791 95 47517 30347 444 46 343 a-a-CH3DCH2OH
769793.5946 0.5462 -4.8307 3 397.9304 73 47517 30336 828 36 531 a-a-CH3DCH2OH
770145.3662 0.2464 -3.2374 3 377.1759 73 47517 30336 631 35 530 a-a-CH3DCH2OH
770237.5979 1.2950 -3.7871 3 728.0033101 47517 30350 644 49 743 a-a-CH3DCH2OH
770338.1725 0.2520 -3.2746 3 599.8344 93 47517 30346 542 45 441 a-a-CH3DCH2OH
771742.7309 2.8084 -4.9170 3 677.9697 97 47517 30348 741 48 444 a-a-CH3DCH2OH
771959.3118 2.9575 -4.9241 3 872.9129109 47517 30354 945 54 648 a-a-CH3DCH2OH
772752.5383 2.4093 -4.8592 3 782.7603103 47517 30351 942 51 645 a-a-CH3DCH2OH
772896.4111 5.2625 -4.4711 3 992.8531117 47517 30358 850 57 949 a-a-CH3DCH2OH
773009.4902 0.2773 -4.9618 3 336.9872 69 47517 30334 629 34 332 a-a-CH3DCH2OH
773416.4121 0.0127 -4.3705 3 123.3351 43 47517 30321 517 20 218 a-a-CH3DCH2OH
774054.0817 0.2146 -3.1280 3 625.6015 97 47517 30348 246 47 345 a-a-CH3DCH2OH
774078.4705 0.2151 -3.1280 3 625.6010 97 47517 30348 346 47 245 a-a-CH3DCH2OH
774135.0687 0.2891 -3.2597 3 397.9304 75 47517 30337 632 36 531 a-a-CH3DCH2OH
774428.1821 0.0231 -4.4057 3 135.5993 47 47517 30323 321 22 022 a-a-CH3DCH2OH
775190.3842 0.2152 -4.8705 3 308.7457 65 47517 30332 726 32 429 a-a-CH3DCH2OH
776066.3478 0.1431 -3.3018 3 625.5301 95 47517 30347 443 46 542 a-a-CH3DCH2OH
776540.8323 0.0942 -2.7100 3 169.2018 41 47517 303201011 19 910 a-a-CH3DCH2OH
776540.8325 0.0942 -2.7100 3 169.2018 41 47517 303201010 19 911 a-a-CH3DCH2OH
777716.1527 0.3353 -3.2801 3 419.2560 77 47517 30338 633 37 532 a-a-CH3DCH2OH
777903.8083 0.7551 -5.0892 3 437.6335 79 47517 30339 534 39 237 a-a-CH3DCH2OH
778479.0485 3.4513 -4.9643 3 903.9403111 47517 30355 946 55 649 a-a-CH3DCH2OH
779076.6771 2.3587 -4.8541 3 753.6957101 47517 30350 941 50 644 a-a-CH3DCH2OH
779224.5973 0.2622 -3.0790 3 636.4941 99 47517 30349 148 48 247 a-a-CH3DCH2OH
779225.0862 0.2622 -3.0790 3 636.4940 99 47517 30349 248 48 147 a-a-CH3DCH2OH
779351.5776 0.0798 -3.1033 3 281.1035 63 47517 30331 625 30 526 a-a-CH3DCH2OH
780049.4222 0.0680 -2.7680 3 191.4025 47 47517 30323 915 22 814 a-a-CH3DCH2OH
780049.5927 0.0680 -2.7680 3 191.4025 47 47517 30323 914 22 815 a-a-CH3DCH2OH
780269.8325 2.9590 -4.1219 3 855.3760109 47517 30354 747 53 846 a-a-CH3DCH2OH
780974.2762 0.0799 -2.9531 3 256.1570 59 47517 30329 723 28 622 a-a-CH3DCH2OH
781086.8190 0.3837 -3.2988 3 441.1430 79 47517 30339 634 38 533 a-a-CH3DCH2OH
781622.7200 0.0396 -3.9697 3 181.5847 53 47517 30326 323 25 224 a-a-CH3DCH2OH
782209.2430 0.2533 -4.8596 3 327.1176 67 47517 30333 727 33 430 a-a-CH3DCH2OH
782554.8744 0.3216 -3.4913 3 662.7734 97 47517 30348 543 47 642 a-a-CH3DCH2OH
782558.3397 0.0670 -2.8446 3 220.3159 53 47517 30326 819 25 718 a-a-CH3DCH2OH
782594.4691 0.0669 -2.8445 3 220.3148 53 47517 30326 818 25 719 a-a-CH3DCH2OH
783500.0589 0.0771 -2.9511 3 256.0813 59 47517 30329 722 28 623 a-a-CH3DCH2OH
783922.7902 0.0268 -4.0269 3 154.9426 49 47517 30324 421 23 122 a-a-CH3DCH2OH
784042.9391 0.4796 -4.8669 3 377.1759 71 47517 30335 827 35 530 a-a-CH3DCH2OH
784344.0039 0.2084 -3.2128 3 639.1463 97 47517 30348 345 47 444 a-a-CH3DCH2OH
784388.6752 0.2640 -3.2920 3 625.3722 95 47517 30347 543 46 442 a-a-CH3DCH2OH
784452.1349 0.4329 -3.3156 3 463.5815 81 47517 30340 635 39 534 a-a-CH3DCH2OH
784474.1021 0.3663 -3.0380 3 646.2791101 47517 30350 050 49 149 a-a-CH3DCH2OH
784474.1064 0.3663 -3.0380 3 646.2791101 47517 30350 150 49 049 a-a-CH3DCH2OH
784834.8989 0.2174 -3.2122 3 639.1368 97 47517 30348 445 47 344 a-a-CH3DCH2OH
787571.3602 0.0144 -4.2618 3 135.2601 45 47517 30322 518 21 219 a-a-CH3DCH2OH
787951.4561 2.3067 -4.8555 3 725.1337 99 47517 30349 940 49 643 a-a-CH3DCH2OH
788019.4210 0.4809 -3.3308 3 486.5616 83 47517 30341 636 40 535 a-a-CH3DCH2OH
788628.1995 4.1640 -5.0140 3 935.4550113 47517 30356 947 56 650 a-a-CH3DCH2OH
789527.0957 0.2428 -3.1531 3 651.4215 99 47517 30349 247 48 346 a-a-CH3DCH2OH
789544.2488 0.2431 -3.1531 3 651.4212 99 47517 30349 347 48 246 a-a-CH3DCH2OH
790508.7464 0.2968 -4.8547 3 346.0178 69 47517 30334 728 34 431 a-a-CH3DCH2OH
790638.0553 4.5461 -4.9869 3 831.4703107 47517 30353 845 53 548 a-a-CH3DCH2OH
790909.1877 0.0263 -4.4138 3 147.7640 49 47517 30324 222 23 123 a-a-CH3DCH2OH
791991.8754 0.5257 -3.3449 3 510.0731 85 47517 30342 637 41 536 a-a-CH3DCH2OH
792442.5555 0.1716 -3.3188 3 651.5366 97 47517 30348 444 47 543 a-a-CH3DCH2OH
792509.2107 0.0968 -3.3604 3 273.5955 63 47517 30331 526 30 427 a-a-CH3DCH2OH
793151.9188 0.3310 -4.9869 3 356.0807 71 47517 30335 630 35 333 a-a-CH3DCH2OH
793253.4718 0.1007 -2.7095 3 180.4136 43 47517 303211012 20 911 a-a-CH3DCH2OH
793253.4724 0.1007 -2.7095 3 180.4136 43 47517 303211011 20 912 a-a-CH3DCH2OH
793756.1958 1.7132 -5.0027 3 563.7075 89 47517 30344 638 44 341 a-a-CH3DCH2OH
794702.6208 0.2967 -3.1063 3 662.4862101 47517 30350 149 49 248 a-a-CH3DCH2OH
794702.9555 0.2967 -3.1063 3 662.4862101 47517 30350 249 49 148 a-a-CH3DCH2OH
795953.1140 0.0947 -2.9685 3 272.5526 61 47517 30330 724 29 623 a-a-CH3DCH2OH
796559.7303 0.5649 -3.3582 3 534.1064 87 47517 30343 638 42 537 a-a-CH3DCH2OH
796649.5554 0.0775 -2.7711 3 204.3102 49 47517 30324 916 23 815 a-a-CH3DCH2OH
796649.9063 0.0775 -2.7711 3 204.3102 49 47517 30324 915 23 816 a-a-CH3DCH2OH
797762.2343 1.2745 -3.7782 3 756.1498103 47517 30351 645 50 744 a-a-CH3DCH2OH
798030.0772 0.4170 -4.9029 3 357.0011 69 47517 30334 826 34 529 a-a-CH3DCH2OH
798741.2578 0.2787 -3.3115 3 651.4169 97 47517 30348 544 47 443 a-a-CH3DCH2OH
798879.5865 0.0791 -2.8524 3 234.9378 55 47517 30327 820 26 719 a-a-CH3DCH2OH
798941.7802 0.0789 -2.8524 3 234.9358 55 47517 30327 819 26 720 a-a-CH3DCH2OH
799032.1559 2.2366 -4.8623 3 697.0825 97 47517 30348 939 48 642 a-a-CH3DCH2OH
799709.0142 0.0904 -2.9657 3 272.4408 61 47517 30330 723 29 624 a-a-CH3DCH2OH
799852.4038 0.2358 -3.2365 3 665.3161 99 47517 30349 346 48 445 a-a-CH3DCH2OH
799903.4869 0.0972 -3.1314 3 298.5776 65 47517 30332 626 31 527 a-a-CH3DCH2OH
799955.7374 0.4124 -3.0670 3 672.4463103 47517 30351 051 50 150 a-a-CH3DCH2OH
799955.7403 0.4124 -3.0670 3 672.4463103 47517 30351 151 50 050 a-a-CH3DCH2OH
800151.9850 0.3466 -4.8555 3 365.4441 71 47517 30335 729 35 432 a-a-CH3DCH2OH
800208.3248 0.2432 -3.2361 3 665.3092 99 47517 30349 446 48 345 a-a-CH3DCH2OH
800583.8194 0.0661 -3.6631 3 233.3568 59 47517 30329 425 28 326 a-a-CH3DCH2OH
801889.3163 0.5969 -3.3712 3 558.6528 89 47517 30344 639 43 538 a-a-CH3DCH2OH
802472.7422 5.1031 -5.0730 3 967.4584115 47517 30357 948 57 651 a-a-CH3DCH2OH
802879.3283 0.2768 -3.4967 3 689.6215 99 47517 30349 544 48 643 a-a-CH3DCH2OH
803118.2568 0.0174 -4.1662 3 147.7072 47 47517 30323 519 22 220 a-a-CH3DCH2OH
804993.3937 0.2738 -3.1800 3 677.7575101 47517 30350 248 49 347 a-a-CH3DCH2OH
805005.4397 0.2740 -3.1799 3 677.7573101 47517 30350 348 49 247 a-a-CH3DCH2OH
805540.1358 3.3055 -4.9985 3 705.0316 99 47517 30349 742 49 445 a-a-CH3DCH2OH
807705.8550 5.7337 -4.4765 3 1025.5867119 47517 30359 851 58 950 a-a-CH3DCH2OH
808111.6807 0.6205 -3.3846 3 583.7047 91 47517 30345 640 44 539 a-a-CH3DCH2OH
808588.5311 0.2031 -3.3385 3 678.0600 99 47517 30349 445 48 544 a-a-CH3DCH2OH
809267.2856 0.0256 -4.4097 3 147.7617 49 47517 30324 322 23 023 a-a-CH3DCH2OH
809950.1822 0.1086 -2.7107 3 192.1874 45 47517 303221013 21 912 a-a-CH3DCH2OH
809950.1837 0.1086 -2.7107 3 192.1874 45 47517 303221012 21 913 a-a-CH3DCH2OH
810174.5531 0.3346 -3.1353 3 688.9946103 47517 30351 150 50 249 a-a-CH3DCH2OH
810174.7821 0.3346 -3.1353 3 688.9946103 47517 30351 250 50 149 a-a-CH3DCH2OH
810505.7608 0.1117 -2.9865 3 289.5323 63 47517 30331 725 30 624 a-a-CH3DCH2OH
811189.3612 0.4036 -4.8620 3 385.3948 73 47517 30336 730 36 433 a-a-CH3DCH2OH
811484.5771 0.3592 -4.9390 3 337.4142 67 47517 30333 825 33 528 a-a-CH3DCH2OH
811950.2627 2.1429 -4.8731 3 669.5516 95 47517 30347 938 47 641 a-a-CH3DCH2OH
812475.0594 3.0885 -4.1161 3 885.8370111 47517 30355 748 54 847 a-a-CH3DCH2OH
813217.9929 0.0886 -2.7760 3 217.7820 51 47517 30325 917 24 816 a-a-CH3DCH2OH
813218.6913 0.0886 -2.7760 3 217.7819 51 47517 30325 916 24 817 a-a-CH3DCH2OH
813333.0590 0.2966 -3.3332 3 677.9697 99 47517 30349 545 48 444 a-a-CH3DCH2OH
814144.9586 0.0341 -4.0181 3 167.9863 51 47517 30325 422 24 123 a-a-CH3DCH2OH
814594.4776 0.3932 -5.0163 3 375.6932 73 47517 30336 631 36 334 a-a-CH3DCH2OH
815125.8549 0.0927 -2.8622 3 250.1278 57 47517 30328 821 27 720 a-a-CH3DCH2OH
815230.5102 0.0925 -2.8621 3 250.1246 57 47517 30328 820 27 721 a-a-CH3DCH2OH
815313.3204 0.6353 -3.3988 3 609.2563 93 47517 30346 641 45 540 a-a-CH3DCH2OH
815338.6118 0.2657 -3.2621 3 692.0013101 47517 30350 347 49 446 a-a-CH3DCH2OH
815431.2819 0.4628 -3.0976 3 699.1300105 47517 30352 052 51 151 a-a-CH3DCH2OH
815431.2838 0.4628 -3.0976 3 699.1300105 47517 30352 152 51 051 a-a-CH3DCH2OH
815596.0189 0.2718 -3.2618 3 691.9963101 47517 30350 447 49 346 a-a-CH3DCH2OH
815992.1873 0.1051 -2.9826 3 289.3701 63 47517 30331 724 30 625 a-a-CH3DCH2OH
819165.7178 5.4305 -5.0686 3 861.4878109 47517 30354 846 54 549 a-a-CH3DCH2OH
820218.2530 0.0221 -4.0845 3 160.6705 49 47517 30324 520 23 221 a-a-CH3DCH2OH
820453.1075 0.3078 -3.2085 3 704.6094103 47517 30351 249 50 348 a-a-CH3DCH2OH
820461.5550 0.3080 -3.2085 3 704.6092103 47517 30351 349 50 248 a-a-CH3DCH2OH
821730.3546 0.1200 -3.1642 3 316.6057 67 47517 30333 627 32 528 a-a-CH3DCH2OH
822305.3716 0.2369 -3.5069 3 716.9940101 47517 30350 545 49 644 a-a-CH3DCH2OH
822782.5795 0.0506 -3.9919 3 195.6524 55 47517 30327 324 26 225 a-a-CH3DCH2OH
823531.5736 0.6423 -3.4143 3 635.3034 95 47517 30347 642 46 541 a-a-CH3DCH2OH
823657.6478 0.4691 -4.8740 3 405.8683 75 47517 30337 731 37 434 a-a-CH3DCH2OH
823882.6236 0.0124 -5.0955 3 87.8815 37 47517 30318 513 17 216 a-a-CH3DCH2OH
824031.5746 1.2226 -3.7742 3 784.8342105 47517 30352 646 51 745 a-a-CH3DCH2OH
824171.7402 0.3068 -4.9755 3 318.4223 65 47517 30332 824 32 527 a-a-CH3DCH2OH
824531.8026 0.1314 -3.0071 3 307.0998 65 47517 30332 726 31 625 a-a-CH3DCH2OH
824553.6155 0.2372 -3.3608 3 705.0995101 47517 30350 446 49 545 a-a-CH3DCH2OH
824972.3102 0.1277 -3.4114 3 290.9042 65 47517 30332 527 31 428 a-a-CH3DCH2OH
825640.2756 0.3762 -3.1659 3 716.0191105 47517 30352 151 51 250 a-a-CH3DCH2OH
825640.4322 0.3762 -3.1659 3 716.0191105 47517 30352 251 51 150 a-a-CH3DCH2OH
826325.3214 2.0268 -4.8867 3 642.5511 93 47517 30346 937 46 640 a-a-CH3DCH2OH
826629.0197 0.1180 -2.7134 3 204.5235 47 47517 303231014 22 913 a-a-CH3DCH2OH
826629.0232 0.1180 -2.7134 3 204.5235 47 47517 303231013 22 914 a-a-CH3DCH2OH
828111.9909 0.3177 -3.3569 3 705.0316101 47517 30350 546 49 445 a-a-CH3DCH2OH
829751.2778 0.1013 -2.7827 3 231.8182 53 47517 30326 918 25 817 a-a-CH3DCH2OH
829752.6261 0.1013 -2.7827 3 231.8182 53 47517 30326 917 25 818 a-a-CH3DCH2OH
829970.1443 0.0292 -4.4211 3 160.4459 51 47517 30325 223 24 124 a-a-CH3DCH2OH
830807.0212 0.2984 -3.2896 3 719.2016103 47517 30351 348 50 447 a-a-CH3DCH2OH
830900.6182 0.5178 -3.1298 3 726.3299107 47517 30353 053 52 152 a-a-CH3DCH2OH
830900.6195 0.5178 -3.1298 3 726.3299107 47517 30353 153 52 052 a-a-CH3DCH2OH
830992.7437 0.3033 -3.2894 3 719.1980103 47517 30351 448 50 347 a-a-CH3DCH2OH
831285.4440 0.1081 -2.8740 3 265.8870 59 47517 30329 822 28 721 a-a-CH3DCH2OH
831457.8546 0.1078 -2.8738 3 265.8816 59 47517 30329 821 28 722 a-a-CH3DCH2OH
832095.8572 1.9829 -5.0759 3 588.3360 91 47517 30345 639 45 342 a-a-CH3DCH2OH
832408.4070 0.1213 -3.0018 3 306.8688 65 47517 30332 725 31 626 a-a-CH3DCH2OH
832756.0655 0.6430 -3.4314 3 661.8437 97 47517 30348 643 47 542 a-a-CH3DCH2OH
835901.2939 0.2601 -5.0129 3 300.0308 63 47517 30331 823 31 526 a-a-CH3DCH2OH
835906.2870 0.3452 -3.2387 3 731.9769105 47517 30352 250 51 349 a-a-CH3DCH2OH
835912.2034 0.3454 -3.2387 3 731.9767105 47517 30352 350 51 249 a-a-CH3DCH2OH
837277.3751 0.4649 -5.0495 3 395.8242 75 47517 30337 632 37 335 a-a-CH3DCH2OH
837579.3436 0.5445 -4.8912 3 426.8632 77 47517 30338 732 38 435 a-a-CH3DCH2OH
837915.7057 0.1543 -3.0304 3 325.2595 67 47517 30333 727 32 626 a-a-CH3DCH2OH
838978.6276 0.0285 -4.0168 3 174.1459 51 47517 30325 521 24 222 a-a-CH3DCH2OH
840353.4746 0.0870 -3.7068 3 249.3232 61 47517 30330 426 29 327 a-a-CH3DCH2OH
840377.4919 0.2738 -3.3854 3 732.6545103 47517 30351 447 50 546 a-a-CH3DCH2OH
840953.0731 0.2108 -3.5214 3 744.8887103 47517 30351 546 50 645 a-a-CH3DCH2OH
841099.6685 0.4218 -3.1981 3 743.5595107 47517 30353 152 52 251 a-a-CH3DCH2OH
841099.7754 0.4218 -3.1981 3 743.5595107 47517 30353 252 52 151 a-a-CH3DCH2OH
841557.2938 3.8415 -5.0810 3 732.6037101 47517 30350 743 50 446 a-a-CH3DCH2OH
841775.6841 1.8926 -4.9020 3 616.0918 91 47517 30345 936 45 639 a-a-CH3DCH2OH
842449.7327 6.1518 -4.4821 3 1058.8762121 47517 30360 852 59 951 a-a-CH3DCH2OH
842935.8046 0.6398 -3.4503 3 688.8767 99 47517 30349 644 48 543 a-a-CH3DCH2OH
843035.6742 0.3423 -3.3825 3 732.6037103 47517 30351 547 50 446 a-a-CH3DCH2OH
843287.9234 0.1290 -2.7178 3 217.4221 49 47517 303241015 23 914 a-a-CH3DCH2OH
843287.9315 0.1290 -2.7178 3 217.4221 49 47517 303241014 23 915 a-a-CH3DCH2OH
843837.9143 3.1619 -4.1128 3 916.8453113 47517 30356 749 55 848 a-a-CH3DCH2OH
844471.6588 0.0282 -4.4165 3 160.4444 51 47517 30325 323 24 024 a-a-CH3DCH2OH
845053.7511 0.1504 -3.2018 3 335.1849 69 47517 30334 628 33 529 a-a-CH3DCH2OH
845361.3816 0.0431 -4.0154 3 181.5470 53 47517 30326 423 25 124 a-a-CH3DCH2OH
846245.6759 0.1158 -2.7911 3 246.4193 55 47517 30327 919 26 818 a-a-CH3DCH2OH
846248.2065 0.1158 -2.7911 3 246.4192 55 47517 30327 918 26 819 a-a-CH3DCH2OH
846260.8367 0.3340 -3.3189 3 746.9170105 47517 30352 349 51 448 a-a-CH3DCH2OH
846363.6293 0.5778 -3.1636 3 754.0457109 47517 30354 054 53 153 a-a-CH3DCH2OH
846363.6302 0.5778 -3.1636 3 754.0457109 47517 30354 154 53 053 a-a-CH3DCH2OH
846394.5437 0.3380 -3.3188 3 746.9144105 47517 30352 449 51 348 a-a-CH3DCH2OH
846536.1952 0.2189 -5.0519 3 282.2437 61 47517 30330 822 30 525 a-a-CH3DCH2OH
847343.8376 0.1254 -2.8877 3 282.2160 61 47517 30330 823 29 722 a-a-CH3DCH2OH
847622.2760 0.1248 -2.8875 3 282.2075 61 47517 30330 822 29 723 a-a-CH3DCH2OH
848733.0355 0.0129 -5.0234 3 97.7527 39 47517 30319 514 18 217 a-a-CH3DCH2OH
849001.1238 1.1419 -3.7752 3 814.0531107 47517 30353 647 52 746 a-a-CH3DCH2OH
849033.3043 0.1391 -3.0235 3 324.9362 67 47517 30333 726 32 627 a-a-CH3DCH2OH
850530.6083 0.1813 -3.0565 3 344.0157 69 47517 30334 728 33 627 a-a-CH3DCH2OH
851352.9252 0.3861 -3.2706 3 759.8598107 47517 30353 251 52 350 a-a-CH3DCH2OH
851357.0637 0.3862 -3.2706 3 759.8597107 47517 30353 351 52 250 a-a-CH3DCH2OH
852962.3389 0.6312 -4.9135 3 448.3785 79 47517 30339 733 39 436 a-a-CH3DCH2OH
853989.9812 0.6351 -3.4712 3 716.4027101 47517 30350 645 49 544 a-a-CH3DCH2OH
856091.6576 0.3128 -3.4123 3 760.7243105 47517 30352 448 51 547 a-a-CH3DCH2OH
856552.6109 0.4716 -3.2318 3 771.6156109 47517 30354 153 53 252 a-a-CH3DCH2OH
856552.6839 0.4716 -3.2318 3 771.6156109 47517 30354 253 53 152 a-a-CH3DCH2OH
857927.1524 1.7463 -4.9180 3 590.1843 89 47517 30344 935 44 638 a-a-CH3DCH2OH
858070.1292 0.3706 -3.4102 3 760.6865105 47517 30352 548 51 447 a-a-CH3DCH2OH
858940.5437 0.2078 -3.5398 3 773.3038105 47517 30352 547 51 646 a-a-CH3DCH2OH
859449.1297 0.0366 -3.9627 3 188.1308 53 47517 30326 522 25 223 a-a-CH3DCH2OH
859461.7503 0.1664 -3.4654 3 308.7457 67 47517 30333 528 32 429 a-a-CH3DCH2OH
859924.7105 0.1418 -2.7238 3 230.8836 51 47517 303251016 24 915 a-a-CH3DCH2OH
859924.7281 0.1418 -2.7238 3 230.8836 51 47517 303251015 24 916 a-a-CH3DCH2OH
861702.3703 0.3729 -3.3500 3 775.1470107 47517 30353 350 52 449 a-a-CH3DCH2OH
861798.4324 0.3761 -3.3499 3 775.1452107 47517 30353 450 52 349 a-a-CH3DCH2OH
861820.1981 0.6430 -3.1988 3 782.2774111 47517 30355 055 54 154 a-a-CH3DCH2OH
861820.1987 0.6430 -3.1988 3 782.2774111 47517 30355 155 54 054 a-a-CH3DCH2OH
862245.5476 0.2134 -3.0854 3 363.3729 71 47517 30335 729 34 628 a-a-CH3DCH2OH
862697.1258 0.1323 -2.8013 3 261.5857 57 47517 30328 920 27 819 a-a-CH3DCH2OH
862701.7541 0.1323 -2.8013 3 261.5855 57 47517 30328 919 27 820 a-a-CH3DCH2OH
863282.8020 0.1447 -2.9034 3 299.1162 63 47517 30331 824 30 723 a-a-CH3DCH2OH
863724.1245 0.1437 -2.9030 3 299.1027 63 47517 30331 823 30 724 a-a-CH3DCH2OH
864105.0950 0.0637 -4.0123 3 210.2410 57 47517 30328 325 27 226 a-a-CH3DCH2OH
865819.8959 0.6310 -3.4940 3 744.4231103 47517 30351 646 50 545 a-a-CH3DCH2OH
865961.6767 0.1589 -3.0478 3 343.5710 69 47517 30334 727 33 628 a-a-CH3DCH2OH
866792.9746 0.4308 -3.3042 3 788.2579109 47517 30354 252 53 351 a-a-CH3DCH2OH
866795.8663 0.4309 -3.3042 3 788.2579109 47517 30354 352 53 251 a-a-CH3DCH2OH
868667.7373 0.0321 -4.4300 3 173.6482 53 47517 30326 224 25 125 a-a-CH3DCH2OH
869799.8950 0.7308 -4.9405 3 470.4132 81 47517 30340 734 40 437 a-a-CH3DCH2OH
870086.6084 0.1912 -3.2447 3 354.3122 71 47517 30335 629 34 530 a-a-CH3DCH2OH
871720.8277 0.3544 -3.4413 3 789.3086107 47517 30353 449 52 548 a-a-CH3DCH2OH
871998.9819 0.5260 -3.2672 3 800.1871111 47517 30355 154 54 253 a-a-CH3DCH2OH
871999.0317 0.5260 -3.2672 3 800.1871111 47517 30355 254 54 153 a-a-CH3DCH2OH
872678.8107 1.0376 -3.7815 3 843.8035109 47517 30354 648 53 747 a-a-CH3DCH2OH
872936.2494 0.2521 -3.1169 3 383.3351 73 47517 30336 730 35 629 a-a-CH3DCH2OH
873188.4305 0.4028 -3.4397 3 789.2805107 47517 30353 549 52 448 a-a-CH3DCH2OH
874158.5000 3.1714 -4.1124 3 948.3975115 47517 30357 750 56 849 a-a-CH3DCH2OH
874419.5391 1.5935 -4.9341 3 564.8393 87 47517 30343 934 43 637 a-a-CH3DCH2OH
874882.1637 0.0137 -4.9645 3 108.1529 41 47517 30320 515 19 218 a-a-CH3DCH2OH
876377.8458 0.2306 -3.5617 3 802.2375107 47517 30353 548 52 647 a-a-CH3DCH2OH
876537.0703 0.1565 -2.7314 3 244.9080 53 47517 303261017 25 916 a-a-CH3DCH2OH
876537.1076 0.1565 -2.7314 3 244.9080 53 47517 303261016 25 917 a-a-CH3DCH2OH
877133.2682 0.4152 -3.3828 3 803.8917109 47517 30354 351 53 450 a-a-CH3DCH2OH
877202.1520 0.4178 -3.3827 3 803.8903109 47517 30354 451 53 350 a-a-CH3DCH2OH
877270.2077 0.7138 -3.2356 3 811.0246113 47517 30356 056 55 155 a-a-CH3DCH2OH
877270.2081 0.7138 -3.2356 3 811.0246113 47517 30356 156 55 055 a-a-CH3DCH2OH
877467.0204 0.0538 -4.0179 3 195.6252 55 47517 30327 424 26 125 a-a-CH3DCH2OH
878216.8213 0.3226 -4.9533 3 335.1849 67 47517 30333 826 33 529 a-a-CH3DCH2OH
878319.8156 0.6296 -3.5190 3 772.9399105 47517 30352 647 51 546 a-a-CH3DCH2OH
878482.3521 0.3709 -4.9309 3 354.3122 69 47517 30334 827 34 530 a-a-CH3DCH2OH
878568.3887 0.2790 -4.9802 3 316.6057 65 47517 30332 825 32 528 a-a-CH3DCH2OH
879079.2443 0.1663 -2.9211 3 316.5887 65 47517 30332 825 31 724 a-a-CH3DCH2OH
879101.1709 0.1508 -2.8132 3 277.3178 59 47517 30329 921 28 820 a-a-CH3DCH2OH
879109.4349 0.1507 -2.8132 3 277.3175 59 47517 30329 920 28 821 a-a-CH3DCH2OH
879429.8409 0.2397 -5.0115 3 298.5776 63 47517 30331 824 31 527 a-a-CH3DCH2OH
879474.0377 0.4242 -4.9130 3 373.9843 71 47517 30335 828 35 531 a-a-CH3DCH2OH
879766.4378 0.1646 -2.9206 3 316.5678 65 47517 30332 824 31 725 a-a-CH3DCH2OH
879975.8033 0.0312 -4.4256 3 173.6471 53 47517 30326 324 25 025 a-a-CH3DCH2OH
880697.7680 0.2045 -5.0471 3 281.1035 61 47517 30330 823 30 526 a-a-CH3DCH2OH
881239.0536 0.1122 -3.7484 3 265.8131 63 47517 30331 427 30 328 a-a-CH3DCH2OH
881300.7248 0.4830 -4.8996 3 394.1981 73 47517 30336 829 36 532 a-a-CH3DCH2OH
881625.9615 0.0465 -3.9214 3 202.6239 55 47517 30327 523 26 224 a-a-CH3DCH2OH
882226.3603 0.4795 -3.3393 3 817.1711111 47517 30355 253 54 352 a-a-CH3DCH2OH
882228.3786 0.4796 -3.3393 3 817.1710111 47517 30355 353 54 252 a-a-CH3DCH2OH
882498.5215 0.2987 -3.1508 3 403.9055 75 47517 30337 731 36 630 a-a-CH3DCH2OH
883309.6099 0.1810 -3.0748 3 362.7720 71 47517 30335 728 34 629 a-a-CH3DCH2OH
884068.9582 0.5479 -4.8909 3 414.9507 75 47517 30337 830 37 533 a-a-CH3DCH2OH
887284.1989 0.3988 -3.4722 3 818.4069109 47517 30354 450 53 549 a-a-CH3DCH2OH
887438.6603 0.5851 -3.3041 3 829.2739113 47517 30356 155 55 254 a-a-CH3DCH2OH
887438.6943 0.5851 -3.3041 3 829.2739113 47517 30356 255 55 154 a-a-CH3DCH2OH
887880.9034 0.6198 -4.8869 3 436.2389 77 47517 30338 831 38 534 a-a-CH3DCH2OH
888070.9410 0.8449 -4.9720 3 492.9665 83 47517 30341 735 41 438 a-a-CH3DCH2OH
888369.4471 0.4389 -3.4711 3 818.3861109 47517 30354 550 53 449 a-a-CH3DCH2OH
890862.0409 0.3546 -3.1868 3 425.0859 77 47517 30338 732 37 631 a-a-CH3DCH2OH
890911.9965 1.4398 -4.9498 3 540.0668 85 47517 30342 933 42 636 a-a-CH3DCH2OH
891385.4547 0.6325 -3.5460 3 801.9549107 47517 30353 648 52 547 a-a-CH3DCH2OH
892554.6837 0.4612 -3.4173 3 833.1507111 47517 30355 352 54 451 a-a-CH3DCH2OH
892603.9900 0.4633 -3.4172 3 833.1497111 47517 30355 452 54 351 a-a-CH3DCH2OH
892713.5413 0.7904 -3.2739 3 840.2872115 47517 30357 057 56 156 a-a-CH3DCH2OH
892713.5415 0.7904 -3.2739 3 840.2872115 47517 30357 157 56 056 a-a-CH3DCH2OH
892832.3390 0.6996 -4.8877 3 458.0599 79 47517 30339 832 39 535 a-a-CH3DCH2OH
893122.5575 0.1734 -2.7407 3 259.4957 55 47517 303271018 26 917 a-a-CH3DCH2OH
893122.6339 0.1734 -2.7407 3 259.4957 55 47517 303271017 26 918 a-a-CH3DCH2OH
893363.4894 0.2735 -3.5868 3 831.6884109 47517 30354 549 53 648 a-a-CH3DCH2OH
894703.8051 0.1903 -2.9409 3 334.6350 67 47517 30333 826 32 725 a-a-CH3DCH2OH
895118.9277 0.9164 -3.7929 3 874.0823111 47517 30355 649 54 748 a-a-CH3DCH2OH
895452.8658 0.1714 -2.8269 3 293.6161 61 47517 30330 922 29 821 a-a-CH3DCH2OH
895467.2951 0.1714 -2.8269 3 293.6156 61 47517 30330 921 29 822 a-a-CH3DCH2OH
895755.9432 0.1876 -2.9401 3 334.6033 67 47517 30333 825 32 726 a-a-CH3DCH2OH
895883.4511 0.2135 -3.5211 3 327.1176 69 47517 30334 529 33 430 a-a-CH3DCH2OH
897017.0576 0.2451 -3.2927 3 373.9843 73 47517 30336 630 35 531 a-a-CH3DCH2OH
897652.9881 0.5325 -3.3761 3 846.5990113 47517 30356 254 55 353 a-a-CH3DCH2OH
897654.3955 0.5326 -3.3761 3 846.5990113 47517 30356 354 55 253 a-a-CH3DCH2OH
898001.5461 0.4210 -3.2243 3 446.8762 79 47517 30339 733 38 632 a-a-CH3DCH2OH
899010.7724 0.7889 -4.8933 3 480.4110 81 47517 30340 833 40 536 a-a-CH3DCH2OH
901216.0905 0.2063 -3.1047 3 382.5374 73 47517 30336 729 35 630 a-a-CH3DCH2OH
902448.8897 0.0155 -4.9187 3 119.0805 43 47517 30321 516 20 219 a-a-CH3DCH2OH
902796.5441 0.4462 -3.5052 3 848.0189111 47517 30355 451 54 550 a-a-CH3DCH2OH
902871.5251 0.6493 -3.3425 3 858.8757115 47517 30357 156 56 255 a-a-CH3DCH2OH
902871.5483 0.6493 -3.3425 3 858.8757115 47517 30357 256 56 155 a-a-CH3DCH2OH
903273.2662 3.1127 -4.1158 3 980.4901117 47517 30358 751 57 850 a-a-CH3DCH2OH
903596.7254 0.4793 -3.5044 3 848.0035111 47517 30355 551 54 450 a-a-CH3DCH2OH
903942.7960 0.4984 -3.2627 3 469.2743 81 47517 30340 734 39 633 a-a-CH3DCH2OH
904919.7077 0.6406 -3.5749 3 831.4703109 47517 30354 649 53 548 a-a-CH3DCH2OH
905377.2998 0.0790 -4.0314 3 225.3500 59 47517 30329 326 28 227 a-a-CH3DCH2OH
905461.2481 0.0586 -3.8918 3 217.6252 57 47517 30328 524 27 225 a-a-CH3DCH2OH
906493.7264 0.8893 -4.9037 3 503.2899 83 47517 30341 834 41 537 a-a-CH3DCH2OH
907004.6778 0.0355 -4.4407 3 187.3708 55 47517 30327 225 26 126 a-a-CH3DCH2OH
907088.3510 1.2893 -4.9650 3 515.8763 83 47517 30341 932 41 635 a-a-CH3DCH2OH
907740.6799 0.9751 -5.0075 3 516.0377 85 47517 30342 736 42 439 a-a-CH3DCH2OH
907967.4066 0.5112 -3.4535 3 862.9238113 47517 30356 353 55 452 a-a-CH3DCH2OH
908002.6404 0.5128 -3.4534 3 862.9231113 47517 30356 453 55 352 a-a-CH3DCH2OH
908150.0822 0.8733 -3.3137 3 870.0649117 47517 30358 058 57 157 a-a-CH3DCH2OH
908150.0823 0.8733 -3.3137 3 870.0649117 47517 30358 158 57 057 a-a-CH3DCH2OH
908762.2072 0.5868 -3.3013 3 492.2763 83 47517 30341 735 40 634 a-a-CH3DCH2OH
909678.5830 0.1926 -2.7516 3 274.6470 57 47517 303281019 27 918 a-a-CH3DCH2OH
909678.7348 0.1926 -2.7516 3 274.6470 57 47517 303281018 27 919 a-a-CH3DCH2OH
909982.9561 0.3290 -3.6148 3 861.6552111 47517 30355 550 54 649 a-a-CH3DCH2OH
910119.1826 0.2170 -2.9627 3 353.2569 69 47517 30334 827 33 726 a-a-CH3DCH2OH
910359.2851 0.0665 -4.0247 3 210.2215 57 47517 30328 425 27 126 a-a-CH3DCH2OH
911704.2853 0.2128 -2.9616 3 353.2093 69 47517 30334 826 33 727 a-a-CH3DCH2OH
911746.6461 0.1945 -2.8424 3 310.4811 63 47517 30331 923 30 822 a-a-CH3DCH2OH
911771.3191 0.1944 -2.8424 3 310.4804 63 47517 30331 922 30 823 a-a-CH3DCH2OH
912581.0908 0.6856 -3.3395 3 515.8763 85 47517 30342 736 41 635 a-a-CH3DCH2OH
913072.7512 0.5901 -3.4144 3 876.5415115 47517 30357 255 56 354 a-a-CH3DCH2OH
913073.7316 0.5901 -3.4144 3 876.5415115 47517 30357 355 56 254 a-a-CH3DCH2OH
915347.2421 1.0028 -4.9189 3 526.6942 85 47517 30342 835 42 538 a-a-CH3DCH2OH
915556.8251 0.7936 -3.3767 3 540.0668 87 47517 30343 737 42 636 a-a-CH3DCH2OH
915721.1892 0.0347 -4.4369 3 187.3701 55 47517 30327 325 26 026 a-a-CH3DCH2OH
916411.7562 0.7870 -3.8091 3 904.8868113 47517 30356 650 55 749 a-a-CH3DCH2OH
917873.5145 0.9086 -3.4125 3 564.8393 89 47517 30344 738 43 637 a-a-CH3DCH2OH
918269.1335 0.4969 -3.5399 3 878.1443113 47517 30356 452 55 551 a-a-CH3DCH2OH
918297.4556 0.7190 -3.3824 3 888.9922117 47517 30358 157 57 256 a-a-CH3DCH2OH
918297.4714 0.7190 -3.3824 3 888.9922117 47517 30358 257 57 156 a-a-CH3DCH2OH
918835.8919 0.6549 -3.6059 3 861.4878111 47517 30355 650 54 549 a-a-CH3DCH2OH
918857.5352 0.5240 -3.5394 3 878.1329113 47517 30356 552 55 451 a-a-CH3DCH2OH
919733.8695 1.0281 -3.4465 3 590.1843 91 47517 30345 739 44 638 a-a-CH3DCH2OH
919843.7172 0.2363 -3.1378 3 402.8651 75 47517 30337 730 36 631 a-a-CH3DCH2OH
920450.2217 0.0136 -4.9888 3 115.0055 41 47517 30320 615 19 316 a-a-CH3DCH2OH
921352.8185 1.1487 -3.4787 3 616.0918 93 47517 30346 740 45 639 a-a-CH3DCH2OH
922663.5743 1.1458 -4.9798 3 492.2763 81 47517 30340 931 40 634 a-a-CH3DCH2OH
922952.2969 1.2660 -3.5091 3 642.5511 95 47517 30347 741 46 640 a-a-CH3DCH2OH
923001.0130 0.1418 -3.7876 3 282.8253 65 47517 30332 428 31 329 a-a-CH3DCH2OH
923371.9609 0.5654 -3.4913 3 893.2108115 47517 30357 354 56 453 a-a-CH3DCH2OH
923397.0992 0.5666 -3.4913 3 893.2103115 47517 30357 454 56 353 a-a-CH3DCH2OH
923579.7138 0.9628 -3.3550 3 900.3575119 47517 30359 059 58 158 a-a-CH3DCH2OH
923579.7139 0.9628 -3.3550 3 900.3575119 47517 30359 159 58 058 a-a-CH3DCH2OH
924756.0407 1.3755 -3.5378 3 669.5516 97 47517 30348 742 47 641 a-a-CH3DCH2OH
925278.2222 0.2467 -2.9867 3 372.4564 71 47517 30335 828 34 727 a-a-CH3DCH2OH
925624.6307 1.1318 -4.9388 3 550.6221 87 47517 30343 836 43 539 a-a-CH3DCH2OH
925991.9259 0.3146 -3.3456 3 394.1981 75 47517 30337 631 36 532 a-a-CH3DCH2OH
926202.4023 0.2142 -2.7642 3 290.3622 59 47517 303291020 28 919 a-a-CH3DCH2OH
926202.6961 0.2142 -2.7642 3 290.3622 59 47517 303291019 28 920 a-a-CH3DCH2OH
926308.6347 0.3920 -3.6455 3 892.1368113 47517 30356 551 55 650 a-a-CH3DCH2OH
926983.1345 1.4719 -3.5652 3 697.0825 99 47517 30349 743 48 642 a-a-CH3DCH2OH
927629.4883 0.2401 -2.9850 3 372.3863 71 47517 30335 827 34 728 a-a-CH3DCH2OH
927976.1511 0.2199 -2.8597 3 327.9135 65 47517 30332 924 31 823 a-a-CH3DCH2OH
928017.5211 0.2198 -2.8596 3 327.9122 65 47517 30332 923 31 824 a-a-CH3DCH2OH
928485.5340 0.6525 -3.4542 3 906.9983117 47517 30358 256 57 355 a-a-CH3DCH2OH
928486.2164 0.6525 -3.4542 3 906.9983117 47517 30358 356 57 255 a-a-CH3DCH2OH
928832.7513 0.0150 -4.8772 3 126.5330 43 47517 30321 616 20 317 a-a-CH3DCH2OH
929839.5113 1.5505 -3.5916 3 725.1337101 47517 30350 744 49 643 a-a-CH3DCH2OH
930874.7284 0.0732 -3.8725 3 233.1355 59 47517 30329 525 28 226 a-a-CH3DCH2OH
931064.7940 2.9865 -4.1234 3 1013.1197119 47517 30359 752 58 851 a-a-CH3DCH2OH
931558.9982 0.0185 -4.8858 3 130.5341 45 47517 30322 517 21 220 a-a-CH3DCH2OH
933059.0620 0.6756 -3.6388 3 892.0089113 47517 30356 651 55 550 a-a-CH3DCH2OH
933507.5057 1.6074 -3.6176 3 753.6957103 47517 30351 745 50 644 a-a-CH3DCH2OH
933710.4937 0.5512 -3.5766 3 908.7827115 47517 30357 453 56 552 a-a-CH3DCH2OH
933716.3312 0.7943 -3.4238 3 919.6233119 47517 30359 158 58 257 a-a-CH3DCH2OH
933716.3420 0.7943 -3.4238 3 919.6233119 47517 30359 258 58 157 a-a-CH3DCH2OH
934095.2956 0.2696 -3.5773 3 346.0178 71 47517 30335 530 34 431 a-a-CH3DCH2OH
934142.0774 0.5733 -3.5761 3 908.7744115 47517 30357 553 56 452 a-a-CH3DCH2OH
936671.2239 0.6597 -3.8299 3 936.2144115 47517 30357 651 56 750 a-a-CH3DCH2OH
936796.5130 0.0180 -4.7677 3 138.6417 45 47517 30322 617 21 318 a-a-CH3DCH2OH
937365.5034 1.2788 -4.9634 3 575.0716 89 47517 30344 837 44 540 a-a-CH3DCH2OH
937391.8917 1.0116 -4.9944 3 469.2743 79 47517 30339 930 39 633 a-a-CH3DCH2OH
938134.7105 1.6406 -3.6436 3 782.7603105 47517 30352 746 51 645 a-a-CH3DCH2OH
938768.6774 0.6240 -3.5307 3 924.0115117 47517 30358 355 57 454 a-a-CH3DCH2OH
938786.5865 0.6250 -3.5307 3 924.0112117 47517 30358 455 57 354 a-a-CH3DCH2OH
939002.3196 1.0592 -3.3977 3 931.1648121 47517 30360 060 59 159 a-a-CH3DCH2OH
939002.3197 1.0592 -3.3977 3 931.1648121 47517 30360 160 59 059 a-a-CH3DCH2OH
939377.9662 0.2738 -3.1743 3 423.7528 77 47517 30338 731 37 632 a-a-CH3DCH2OH
940121.8785 0.2800 -3.0129 3 392.2361 73 47517 30336 829 35 728 a-a-CH3DCH2OH
942400.6344 0.4598 -3.6786 3 923.1324115 47517 30357 552 56 651 a-a-CH3DCH2OH
942691.1017 0.2384 -2.7784 3 306.6415 61 47517 303301021 29 920 a-a-CH3DCH2OH
942691.6560 0.2384 -2.7784 3 306.6414 61 47517 303301020 29 921 a-a-CH3DCH2OH
943557.6563 0.2697 -3.0105 3 392.1343 73 47517 30336 828 35 729 a-a-CH3DCH2OH
943824.3328 1.6501 -3.6702 3 812.3209107 47517 30353 747 52 646 a-a-CH3DCH2OH
943891.2156 0.7201 -3.4956 3 937.9693119 47517 30359 257 58 356 a-a-CH3DCH2OH
943891.6903 0.7201 -3.4956 3 937.9693119 47517 30359 357 58 256 a-a-CH3DCH2OH
943939.2876 0.0813 -4.0352 3 225.3361 59 47517 30329 426 28 127 a-a-CH3DCH2OH
944133.9832 0.2481 -2.8787 3 345.9137 67 47517 30333 925 32 824 a-a-CH3DCH2OH
944202.0811 0.2478 -2.8787 3 345.9116 67 47517 30333 924 32 825 a-a-CH3DCH2OH
944553.5106 0.0229 -4.6603 3 151.3254 47 47517 30323 618 22 319 a-a-CH3DCH2OH
945006.1073 0.0399 -4.4533 3 201.6135 57 47517 30328 226 27 127 a-a-CH3DCH2OH
946420.9675 0.0966 -4.0501 3 240.9791 61 47517 30330 327 29 228 a-a-CH3DCH2OH
947526.0021 0.7031 -3.6736 3 923.0352115 47517 30357 652 56 551 a-a-CH3DCH2OH
949127.0223 0.6093 -3.6149 3 939.9341117 47517 30358 454 57 553 a-a-CH3DCH2OH
949128.0316 0.8758 -3.4667 3 950.7687121 47517 30360 159 59 258 a-a-CH3DCH2OH
949128.0389 0.8758 -3.4667 3 950.7687121 47517 30360 259 59 158 a-a-CH3DCH2OH
949442.8384 0.6272 -3.6146 3 939.9280117 47517 30358 554 57 453 a-a-CH3DCH2OH
950595.0958 1.4465 -4.9925 3 600.0414 91 47517 30345 838 45 541 a-a-CH3DCH2OH
950629.4785 1.6384 -3.6977 3 842.3727109 47517 30354 748 53 647 a-a-CH3DCH2OH
951656.4964 0.0394 -4.4502 3 201.6130 57 47517 30328 326 27 027 a-a-CH3DCH2OH
952335.9073 0.0297 -4.5553 3 164.5766 49 47517 30324 619 23 320 a-a-CH3DCH2OH
954157.7467 0.6874 -3.5718 3 955.3257119 47517 30359 356 58 455 a-a-CH3DCH2OH
954170.4880 0.6882 -3.5717 3 955.3255119 47517 30359 456 58 355 a-a-CH3DCH2OH
954577.2594 0.3175 -3.0413 3 412.5988 75 47517 30337 830 36 729 a-a-CH3DCH2OH
956022.9054 0.5478 -3.8549 3 968.0627117 47517 30358 652 57 751 a-a-CH3DCH2OH
957103.0171 0.4019 -3.4029 3 414.9507 77 47517 30338 632 37 533 a-a-CH3DCH2OH
957468.3529 2.7986 -4.1355 3 1046.2830121 47517 30360 753 59 852 a-a-CH3DCH2OH
957764.8659 0.0905 -3.8622 3 249.1559 61 47517 30330 526 29 227 a-a-CH3DCH2OH
958308.0671 0.5311 -3.7140 3 954.6412117 47517 30358 553 57 652 a-a-CH3DCH2OH
958553.0170 1.6098 -3.7266 3 872.9129111 47517 30355 749 54 648 a-a-CH3DCH2OH
959141.5787 0.2653 -2.7943 3 323.4852 63 47517 303311022 30 921 a-a-CH3DCH2OH
959142.6001 0.2653 -2.7943 3 323.4852 63 47517 303311021 30 922 a-a-CH3DCH2OH
959289.6717 0.7931 -3.5384 3 969.4541121 47517 30360 258 59 357 a-a-CH3DCH2OH
959290.0016 0.7931 -3.5384 3 969.4541121 47517 30360 358 59 257 a-a-CH3DCH2OH
959524.8959 0.3017 -3.0381 3 412.4531 75 47517 30337 829 36 730 a-a-CH3DCH2OH
960024.3133 0.3226 -3.2146 3 445.1978 79 47517 30339 732 38 633 a-a-CH3DCH2OH
960211.3841 0.2790 -2.8995 3 364.4825 69 47517 30334 926 33 825 a-a-CH3DCH2OH
960321.5404 0.2785 -2.8994 3 364.4791 69 47517 30334 925 33 826 a-a-CH3DCH2OH
960392.0231 0.0385 -4.4533 3 178.3879 51 47517 30325 620 24 321 a-a-CH3DCH2OH
962184.4156 0.7375 -3.7103 3 954.5675117 47517 30358 653 57 552 a-a-CH3DCH2OH
962346.7140 0.0231 -4.8659 3 142.5122 47 47517 30323 518 22 221 a-a-CH3DCH2OH
964523.4786 0.6717 -3.6550 3 971.5980119 47517 30359 455 58 554 a-a-CH3DCH2OH
964754.0727 0.6861 -3.6548 3 971.5935119 47517 30359 555 58 454 a-a-CH3DCH2OH
965386.9713 0.1756 -3.8242 3 300.3589 67 47517 30333 429 32 330 a-a-CH3DCH2OH
967553.1525 1.5701 -3.7571 3 903.9403113 47517 30356 750 55 649 a-a-CH3DCH2OH
968556.1148 0.3602 -3.0720 3 433.5478 77 47517 30338 831 37 730 a-a-CH3DCH2OH
968982.2394 0.0491 -4.3554 3 192.7508 53 47517 30326 621 25 322 a-a-CH3DCH2OH
969539.2591 0.7559 -3.6143 3 987.1532121 47517 30360 357 59 456 a-a-CH3DCH2OH
969548.3121 0.7565 -3.6143 3 987.1530121 47517 30360 457 59 356 a-a-CH3DCH2OH
973916.0468 0.3346 -3.6330 3 365.4441 73 47517 30336 531 35 432 a-a-CH3DCH2OH
974070.5173 0.6054 -3.7516 3 986.6626119 47517 30359 554 58 653 a-a-CH3DCH2OH
974593.9810 0.4696 -3.8837 3 1000.4296119 47517 30359 653 58 752 a-a-CH3DCH2OH
975550.5173 0.2952 -2.8118 3 340.8938 65 47517 303321023 31 922 a-a-CH3DCH2OH
975552.3586 0.2951 -2.8118 3 340.8937 65 47517 303321022 31 923 a-a-CH3DCH2OH
975579.4301 0.3359 -3.0677 3 433.3425 77 47517 30338 830 37 731 a-a-CH3DCH2OH
976197.8054 0.3129 -2.9221 3 383.6205 71 47517 30335 927 34 826 a-a-CH3DCH2OH
976373.0745 0.3121 -2.9220 3 383.6152 71 47517 30335 926 34 827 a-a-CH3DCH2OH
976991.7054 0.7790 -3.7488 3 986.6069119 47517 30359 654 58 553 a-a-CH3DCH2OH
977553.2728 1.5253 -3.7894 3 935.4550115 47517 30357 751 56 650 a-a-CH3DCH2OH
978112.9170 0.0984 -4.0488 3 240.9692 61 47517 30330 427 29 128 a-a-CH3DCH2OH
978373.1281 0.0615 -4.2628 3 207.6569 55 47517 30327 622 26 323 a-a-CH3DCH2OH
979903.3708 0.7385 -3.6968 3 1003.7743121 47517 30360 456 59 555 a-a-CH3DCH2OH
980071.3936 0.7501 -3.6966 3 1003.7710121 47517 30360 556 59 455 a-a-CH3DCH2OH
981954.3140 0.4094 -3.1052 3 455.0871 79 47517 30339 832 38 731 a-a-CH3DCH2OH
982002.4512 0.3879 -3.2591 3 467.1972 81 47517 30340 733 39 634 a-a-CH3DCH2OH
982709.2543 0.0462 -4.4679 3 216.3762 59 47517 30329 227 28 128 a-a-CH3DCH2OH
986017.8410 0.1111 -3.8596 3 265.6876 63 47517 30331 527 30 228 a-a-CH3DCH2OH
987103.1238 0.1168 -4.0690 3 257.1281 63 47517 30331 328 30 229 a-a-CH3DCH2OH
987737.5736 0.0460 -4.4654 3 216.3759 59 47517 30329 327 28 028 a-a-CH3DCH2OH
988453.7598 1.4809 -3.8235 3 967.4584117 47517 30358 752 57 651 a-a-CH3DCH2OH
988828.4880 0.0756 -4.1770 3 223.0975 57 47517 30328 623 27 324 a-a-CH3DCH2OH
989719.5189 0.6826 -3.7912 3 1019.1959121 47517 30360 555 59 654 a-a-CH3DCH2OH
990378.9439 0.5085 -3.4639 3 436.2389 79 47517 30339 633 38 534 a-a-CH3DCH2OH
991783.8505 0.3726 -3.0995 3 454.8019 79 47517 30339 831 38 732 a-a-CH3DCH2OH
991913.6069 0.8275 -3.7892 3 1019.1540121 47517 30360 655 59 554 a-a-CH3DCH2OH
991914.3554 0.3280 -2.8310 3 358.8675 67 47517 303331024 32 923 a-a-CH3DCH2OH
991917.6067 0.3280 -2.8310 3 358.8674 67 47517 303331023 32 924 a-a-CH3DCH2OH
992080.3447 0.3501 -2.9465 3 403.3287 73 47517 30336 928 35 827 a-a-CH3DCH2OH
992354.8626 0.3488 -2.9463 3 403.3204 73 47517 30336 927 35 828 a-a-CH3DCH2OH
992505.8793 0.4447 -3.9160 3 1033.3134121 47517 30360 654 59 753 a-a-CH3DCH2OH
994653.0380 0.4669 -3.1409 3 477.2208 81 47517 30340 833 39 732 a-a-CH3DCH2OH
994955.4016 0.0294 -4.8589 3 155.0140 49 47517 30324 519 23 222 a-a-CH3DCH2OH