16576.4570 0.0600 -6.7011 3 0.0000 6 42522 202 1 0 0 0 CH3C-13-C-13-H 33152.2277 0.1200 -5.9352 3 5.5847 10 42522 202 2 1 1 1 CH3C-13-C-13-H 33152.8478 0.1200 -5.7997 3 0.5529 10 42522 202 2 0 1 0 CH3C-13-C-13-H 49725.3863 0.1800 -5.5716 3 21.7847 14 42522 202 3 2 2 2 CH3C-13-C-13-H 49728.1763 0.1800 -5.3360 3 6.6906 14 42522 202 3 1 2 1 CH3C-13-C-13-H 49729.1064 0.1800 -5.2744 3 1.6588 14 42522 202 3 0 2 0 CH3C-13-C-13-H 66294.0089 0.2400 -5.3570 3 48.5961 18 42522 202 4-3 3 3 CH3C-13-C-13-H 66294.0089 0.2400 -5.3570 3 48.5961 18 42522 202 4 3 3-3 CH3C-13-C-13-H 66300.2068 0.2400 -5.0705 3 23.4433 18 42522 202 4 2 3 2 CH3C-13-C-13-H 66303.9266 0.2400 -4.9421 3 8.3493 18 42522 202 4 1 3 1 CH3C-13-C-13-H 66305.1666 0.2400 -4.9036 3 3.3176 18 42522 202 4 0 3 0 CH3C-13-C-13-H 82856.1753 0.3000 -5.2297 3 86.0130 22 42522 202 5 4 4 4 CH3C-13-C-13-H 82867.0165 0.3000 -4.9063 3 50.8075 22 42522 202 5-3 4 3 CH3C-13-C-13-H 82867.0165 0.3000 -4.9063 3 50.8075 22 42522 202 5 3 4-3 CH3C-13-C-13-H 82874.7632 0.3000 -4.7358 3 25.6549 22 42522 202 5 2 4 2 CH3C-13-C-13-H 82879.4124 0.3000 -4.6463 3 10.5610 22 42522 202 5 1 4 1 CH3C-13-C-13-H 82880.9623 0.3000 -4.6180 3 5.5293 22 42522 202 5 0 4 0 CH3C-13-C-13-H 99409.9706 0.3600 -5.1640 3 134.0265 26 42522 202 6 5 5 5 CH3C-13-C-13-H 99426.6865 0.3600 -4.8100 3 88.7767 26 42522 202 6 4 5 4 CH3C-13-C-13-H 99439.6944 0.3600 -4.6062 3 53.5716 26 42522 202 6-3 5 3 CH3C-13-C-13-H 99439.6944 0.3600 -4.6062 3 53.5716 26 42522 202 6 3 5-3 CH3C-13-C-13-H 99448.9893 0.3600 -4.4800 3 28.4193 26 42522 202 6 2 5 2 CH3C-13-C-13-H 99454.5676 0.3600 -4.4096 3 13.3255 26 42522 202 6 1 5 1 CH3C-13-C-13-H 99456.4273 0.3600 -4.3868 3 8.2939 26 42522 202 6 0 5 0 CH3C-13-C-13-H 115953.4868 0.4200 -5.1473 3 192.6258 30 42522 202 7-6 6 6 CH3C-13-C-13-H 115953.4868 0.4200 -5.1473 3 192.6258 30 42522 202 7 6 6-6 CH3C-13-C-13-H 115977.3038 0.4200 -4.7658 3 137.3425 30 42522 202 7 5 6 5 CH3C-13-C-13-H 115996.8029 0.4200 -4.5331 3 92.0933 30 42522 202 7 4 6 4 CH3C-13-C-13-H 116011.9766 0.4200 -4.3761 3 56.8886 30 42522 202 7-3 6 3 CH3C-13-C-13-H 116011.9766 0.4200 -4.3761 3 56.8886 30 42522 202 7 3 6-3 CH3C-13-C-13-H 116022.8191 0.4200 -4.2725 3 31.7365 30 42522 202 7 2 6 2 CH3C-13-C-13-H 116029.3263 0.4200 -4.2130 3 16.6430 30 42522 202 7 1 6 1 CH3C-13-C-13-H 116031.4956 0.4200 -4.1935 3 11.6114 30 42522 202 7 0 6 0 CH3C-13-C-13-H 132484.8242 0.4800 -5.1721 3 261.7973 34 42522 202 8 7 7 7 CH3C-13-C-13-H 132516.9627 0.4800 -4.7648 3 196.4936 34 42522 202 8-6 7 6 CH3C-13-C-13-H 132516.9627 0.4800 -4.7648 3 196.4936 34 42522 202 8 6 7-6 CH3C-13-C-13-H 132544.1777 0.4800 -4.5056 3 141.2111 34 42522 202 8 5 7 5 CH3C-13-C-13-H 132566.4587 0.4800 -4.3210 3 95.9625 34 42522 202 8 4 7 4 CH3C-13-C-13-H 132583.7972 0.4800 -4.1884 3 60.7583 34 42522 202 8-3 7 3 CH3C-13-C-13-H 132583.7972 0.4800 -4.1884 3 60.7583 34 42522 202 8 3 7-3 CH3C-13-C-13-H 132596.1866 0.4800 -4.0982 3 35.6066 34 42522 202 8 2 7 2 CH3C-13-C-13-H 132603.6221 0.4800 -4.0455 3 20.5133 34 42522 202 8 1 7 1 CH3C-13-C-13-H 132606.1009 0.4800 -4.0281 3 15.4818 34 42522 202 8 0 7 0 CH3C-13-C-13-H 149002.0931 0.5400 -5.2335 3 341.5253 38 42522 202 9 8 8 8 CH3C-13-C-13-H 149043.7663 0.5400 -4.8017 3 266.2165 38 42522 202 9 7 8 7 CH3C-13-C-13-H 149079.9155 0.5400 -4.5173 3 200.9139 38 42522 202 9-6 8 6 CH3C-13-C-13-H 149079.9155 0.5400 -4.5173 3 200.9139 38 42522 202 9 6 8-6 CH3C-13-C-13-H 149110.5266 0.5400 -4.3071 3 145.6323 38 42522 202 9 5 8 5 CH3C-13-C-13-H 149135.5881 0.5400 -4.1480 3 100.3844 38 42522 202 9 4 8 4 CH3C-13-C-13-H 149155.0902 0.5400 -4.0301 3 65.1808 38 42522 202 9-3 8 3 CH3C-13-C-13-H 149155.0902 0.5400 -4.0301 3 65.1808 38 42522 202 9 3 8-3 CH3C-13-C-13-H 149169.0257 0.5400 -3.9485 3 40.0296 38 42522 202 9 2 8 2 CH3C-13-C-13-H 149177.3891 0.5400 -3.9004 3 24.9365 38 42522 202 9 1 8 1 CH3C-13-C-13-H 149180.1773 0.5400 -3.8845 3 19.9051 38 42522 202 9 0 8 0 CH3C-13-C-13-H 165503.4156 0.6000 -5.3282 3 431.7916 42 42522 20210-9 9 9 CH3C-13-C-13-H 165503.4156 0.6000 -5.3282 3 431.7916 42 42522 20210 9 9-9 CH3C-13-C-13-H 165555.8284 0.6000 -4.8728 3 346.4955 42 42522 20210 8 9 8 CH3C-13-C-13-H 165602.1223 0.6000 -4.5644 3 271.1881 42 42522 20210 7 9 7 CH3C-13-C-13-H 165642.2796 0.6000 -4.3296 3 205.8866 42 42522 20210-6 9 6 CH3C-13-C-13-H 165642.2796 0.6000 -4.3296 3 205.8866 42 42522 20210 6 9-6 CH3C-13-C-13-H 165676.2849 0.6000 -4.1454 3 150.6061 42 42522 20210 5 9 5 CH3C-13-C-13-H 165704.1252 0.6000 -4.0018 3 105.3591 42 42522 20210 4 9 4 CH3C-13-C-13-H 165725.7898 0.6000 -3.8936 3 70.1561 42 42522 20210-3 9 3 CH3C-13-C-13-H 165725.7898 0.6000 -3.8936 3 70.1561 42 42522 20210 3 9-3 CH3C-13-C-13-H 165741.2704 0.6000 -3.8179 3 45.0053 42 42522 20210 2 9 2 CH3C-13-C-13-H 165750.5611 0.6000 -3.7730 3 29.9125 42 42522 20210 1 9 1 CH3C-13-C-13-H 165753.6584 0.6000 -3.7582 3 24.8812 42 42522 20210 0 9 0 CH3C-13-C-13-H 181986.9269 0.6600 -5.4542 3 532.5757 46 42522 2021110 1010 CH3C-13-C-13-H 182051.2747 0.6600 -4.9756 3 437.3122 46 42522 20211-9 10 9 CH3C-13-C-13-H 182051.2747 0.6600 -4.9756 3 437.3122 46 42522 20211 9 10-9 CH3C-13-C-13-H 182108.9155 0.6600 -4.6439 3 352.0178 46 42522 20211 8 10 8 CH3C-13-C-13-H 182159.8270 0.6600 -4.3854 3 276.7120 46 42522 20211 7 10 7 CH3C-13-C-13-H 182203.9899 0.6600 -4.1770 3 211.4119 46 42522 20211-6 10 6 CH3C-13-C-13-H 182203.9899 0.6600 -4.1770 3 211.4119 46 42522 20211 6 10-6 CH3C-13-C-13-H 182241.3870 0.6600 -4.0089 3 156.1324 46 42522 20211 5 10 5 CH3C-13-C-13-H 182272.0043 0.6600 -3.8756 3 110.8864 46 42522 20211 4 10 4 CH3C-13-C-13-H 182295.8298 0.6600 -3.7741 3 75.6841 46 42522 20211-3 10 3 CH3C-13-C-13-H 182295.8298 0.6600 -3.7741 3 75.6841 46 42522 20211 3 10-3 CH3C-13-C-13-H 182312.8545 0.6600 -3.7027 3 50.5338 46 42522 20211 2 10 2 CH3C-13-C-13-H 182323.0720 0.6600 -3.6602 3 35.4413 46 42522 20211 1 10 1 CH3C-13-C-13-H 182326.4783 0.6600 -3.6461 3 30.4101 46 42522 20211 0 10 0 CH3C-13-C-13-H 198450.7769 0.7200 -5.6096 3 643.8548 50 42522 2021211 1111 CH3C-13-C-13-H 198528.2447 0.7200 -5.1084 3 538.6461 50 42522 2021210 1110 CH3C-13-C-13-H 198598.4245 0.7200 -4.7538 3 443.3848 50 42522 20212-9 11 9 CH3C-13-C-13-H 198598.4245 0.7200 -4.7538 3 443.3848 50 42522 20212 9 11-9 CH3C-13-C-13-H 198661.2894 0.7200 -4.4721 3 358.0923 50 42522 20212 8 11 8 CH3C-13-C-13-H 198716.8153 0.7200 -4.2404 3 282.7882 50 42522 20212 7 11 7 CH3C-13-C-13-H 198764.9807 0.7200 -4.0485 3 217.4895 50 42522 20212-6 11 6 CH3C-13-C-13-H 198764.9807 0.7200 -4.0485 3 217.4895 50 42522 20212 6 11-6 CH3C-13-C-13-H 198805.7673 0.7200 -3.8911 3 162.2113 50 42522 20212 5 11 5 CH3C-13-C-13-H 198839.1595 0.7200 -3.7650 3 116.9663 50 42522 20212 4 11 4 CH3C-13-C-13-H 198865.1444 0.7200 -3.6684 3 81.7649 50 42522 20212-3 11 3 CH3C-13-C-13-H 198865.1444 0.7200 -3.6684 3 81.7649 50 42522 20212 3 11-3 CH3C-13-C-13-H 198883.7122 0.7200 -3.6002 3 56.6151 50 42522 20212 2 11 2 CH3C-13-C-13-H 198894.8557 0.7200 -3.5595 3 41.5230 50 42522 20212 1 11 1 CH3C-13-C-13-H 198898.5707 0.7200 -3.5460 3 36.4919 50 42522 20212 0 11 0 CH3C-13-C-13-H 214893.1321 0.7800 -5.7932 3 765.6040 54 42522 2021312 12a2 CH3C-13-C-13-H 214893.1321 0.7800 -5.7932 3 765.6040 54 42522 20213a2 1212 CH3C-13-C-13-H 214984.8932 0.7800 -5.2697 3 650.4744 54 42522 2021311 1211 CH3C-13-C-13-H 215068.7934 0.7800 -4.8926 3 545.2683 54 42522 2021310 1210 CH3C-13-C-13-H 215144.8006 0.7800 -4.5883 3 450.0093 54 42522 20213-9 12 9 CH3C-13-C-13-H 215144.8006 0.7800 -4.5883 3 450.0093 54 42522 20213 9 12-9 CH3C-13-C-13-H 215212.8855 0.7800 -4.3337 3 364.7190 54 42522 20213 8 12 8 CH3C-13-C-13-H 215273.0219 0.7800 -4.1186 3 289.4167 54 42522 20213 7 12 7 CH3C-13-C-13-H 215325.1868 0.7800 -3.9377 3 224.1196 54 42522 20213-6 12 6 CH3C-13-C-13-H 215325.1868 0.7800 -3.9377 3 224.1196 54 42522 20213 6 12-6 CH3C-13-C-13-H 215369.3602 0.7800 -3.7879 3 168.8428 54 42522 20213 5 12 5 CH3C-13-C-13-H 215405.5251 0.7800 -3.6672 3 123.5989 54 42522 20213 4 12 4 CH3C-13-C-13-H 215433.6677 0.7800 -3.5743 3 88.3983 54 42522 20213-3 12 3 CH3C-13-C-13-H 215433.6677 0.7800 -3.5743 3 88.3983 54 42522 20213 3 12-3 CH3C-13-C-13-H 215453.7773 0.7800 -3.5085 3 63.2492 54 42522 20213 2 12 2 CH3C-13-C-13-H 215465.8461 0.7800 -3.4692 3 48.1574 54 42522 20213 1 12 1 CH3C-13-C-13-H 215469.8695 0.7800 -3.4561 3 43.1264 54 42522 20213 0 12 0 CH3C-13-C-13-H 231312.1769 0.8400 -6.0039 3 897.7960 58 42522 2021413 1313 CH3C-13-C-13-H 231419.3917 0.8400 -5.4584 3 772.7720 58 42522 2021412 13a2 CH3C-13-C-13-H 231419.3917 0.8400 -5.4584 3 772.7720 58 42522 20214a2 1312 CH3C-13-C-13-H 231518.1818 0.8400 -5.0592 3 657.6455 58 42522 2021411 1311 CH3C-13-C-13-H 231608.5090 0.8400 -4.7326 3 552.4422 58 42522 2021410 1310 CH3C-13-C-13-H 231690.3385 0.8400 -4.4554 3 457.1858 58 42522 20214-9 13 9 CH3C-13-C-13-H 231690.3385 0.8400 -4.4554 3 457.1858 58 42522 20214 9 13-9 CH3C-13-C-13-H 231763.6389 0.8400 -4.2176 3 371.8977 58 42522 20214 8 13 8 CH3C-13-C-13-H 231828.3819 0.8400 -4.0138 3 296.5974 58 42522 20214 7 13 7 CH3C-13-C-13-H 231884.5428 0.8400 -3.8408 3 231.3021 58 42522 20214-6 13 6 CH3C-13-C-13-H 231884.5428 0.8400 -3.8408 3 231.3021 58 42522 20214 6 13-6 CH3C-13-C-13-H 231932.1000 0.8400 -3.6966 3 176.0267 58 42522 20214 5 13 5 CH3C-13-C-13-H 231971.0352 0.8400 -3.5800 3 130.7840 58 42522 20214 4 13 4 CH3C-13-C-13-H 232001.3337 0.8400 -3.4899 3 95.5844 58 42522 20214-3 13 3 CH3C-13-C-13-H 232001.3337 0.8400 -3.4899 3 95.5844 58 42522 20214 3 13-3 CH3C-13-C-13-H 232022.9837 0.8400 -3.4261 3 70.4360 58 42522 20214 2 13 2 CH3C-13-C-13-H 232035.9771 0.8400 -3.3878 3 55.3446 58 42522 20214 1 13 1 CH3C-13-C-13-H 232040.3087 0.8400 -3.3751 3 50.3137 58 42522 20214 0 13 0 CH3C-13-C-13-H 247829.9305 0.9000 -5.6738 3 905.5117 62 42522 2021513 1413 CH3C-13-C-13-H 247944.7666 0.9000 -5.2526 3 780.4914 62 42522 2021512 14a2 CH3C-13-C-13-H 247944.7666 0.9000 -5.2526 3 780.4914 62 42522 20215a2 1412 CH3C-13-C-13-H 248050.5791 0.9000 -4.9040 3 665.3682 62 42522 2021511 1411 CH3C-13-C-13-H 248147.3273 0.9000 -4.6046 3 560.1679 62 42522 2021510 1410 CH3C-13-C-13-H 248234.9737 0.9000 -4.3445 3 464.9141 62 42522 20215-9 14 9 CH3C-13-C-13-H 248234.9737 0.9000 -4.3445 3 464.9141 62 42522 20215 9 14-9 CH3C-13-C-13-H 248313.4846 0.9000 -4.1181 3 379.6285 62 42522 20215 8 14 8 CH3C-13-C-13-H 248382.8300 0.9000 -3.9224 3 304.3304 62 42522 20215 7 14 7 CH3C-13-C-13-H 248442.9832 0.9000 -3.7552 3 239.0369 62 42522 20215-6 14 6 CH3C-13-C-13-H 248442.9832 0.9000 -3.7552 3 239.0369 62 42522 20215 6 14-6 CH3C-13-C-13-H 248493.9211 0.9000 -3.6153 3 183.7632 62 42522 20215 5 14 5 CH3C-13-C-13-H 248535.6241 0.9000 -3.5018 3 138.5217 62 42522 20215 4 14 4 CH3C-13-C-13-H 248568.0764 0.9000 -3.4141 3 103.3231 62 42522 20215-3 14 3 CH3C-13-C-13-H 248568.0764 0.9000 -3.4141 3 103.3231 62 42522 20215 3 14-3 CH3C-13-C-13-H 248591.2655 0.9000 -3.3517 3 78.1754 62 42522 20215 2 14 2 CH3C-13-C-13-H 248605.1825 0.9000 -3.3144 3 63.0845 62 42522 20215 1 14 1 CH3C-13-C-13-H 248609.8221 0.9000 -3.3019 3 58.0537 62 42522 20215 0 14 0 CH3C-13-C-13-H 264214.7195 0.9600 -5.9150 3 1048.6641 66 42522 2021614 1514 CH3C-13-C-13-H 264346.7438 0.9600 -5.4722 3 913.7785 66 42522 2021613 1513 CH3C-13-C-13-H 264469.1936 0.9600 -5.1017 3 788.7619 66 42522 2021612 15a2 CH3C-13-C-13-H 264469.1936 0.9600 -5.1017 3 788.7619 66 42522 20216a2 1512 CH3C-13-C-13-H 264582.0215 0.9600 -4.7805 3 673.6422 66 42522 2021611 1511 CH3C-13-C-13-H 264685.1841 0.9600 -4.4982 3 568.4452 66 42522 2021610 1510 CH3C-13-C-13-H 264778.6416 0.9600 -4.2496 3 473.1944 66 42522 20216-9 15 9 CH3C-13-C-13-H 264778.6416 0.9600 -4.2496 3 473.1944 66 42522 20216 9 15-9 CH3C-13-C-13-H 264862.3580 0.9600 -4.0315 3 387.9113 66 42522 20216 8 15 8 CH3C-13-C-13-H 264936.3012 0.9600 -3.8417 3 312.6155 66 42522 20216 7 15 7 CH3C-13-C-13-H 265000.4427 0.9600 -3.6790 3 247.3241 66 42522 20216-6 15 6 CH3C-13-C-13-H 265000.4427 0.9600 -3.6790 3 247.3241 66 42522 20216 6 15-6 CH3C-13-C-13-H 265054.7579 0.9600 -3.5426 3 192.0520 66 42522 20216 5 15 5 CH3C-13-C-13-H 265099.2260 0.9600 -3.4316 3 146.8120 66 42522 20216 4 15 4 CH3C-13-C-13-H 265133.8300 0.9600 -3.3457 3 111.6144 66 42522 20216-3 15 3 CH3C-13-C-13-H 265133.8300 0.9600 -3.3457 3 111.6144 66 42522 20216 3 15-3 CH3C-13-C-13-H 265158.5566 0.9600 -3.2845 3 86.4675 66 42522 20216 2 15 2 CH3C-13-C-13-H 265173.3963 0.9600 -3.2479 3 71.3770 66 42522 20216 1 15 1 CH3C-13-C-13-H 265178.3435 0.9600 -3.2357 3 66.3465 66 42522 20216 0 15 0 CH3C-13-C-13-H 280571.9907 1.0200 -6.1814 3 1202.1978 70 42522 2021715 16a5 CH3C-13-C-13-H 280571.9907 1.0200 -6.1814 3 1202.1978 70 42522 20217a5 1615 CH3C-13-C-13-H 280722.3298 1.0200 -5.7172 3 1057.4774 70 42522 2021714 1614 CH3C-13-C-13-H 280862.5541 1.0200 -5.3252 3 922.5961 70 42522 2021713 1613 CH3C-13-C-13-H 280992.6094 1.0200 -4.9822 3 797.5837 70 42522 2021712 16a2 CH3C-13-C-13-H 280992.6094 1.0200 -4.9822 3 797.5837 70 42522 20217a2 1612 CH3C-13-C-13-H 281112.4453 1.0200 -4.6781 3 682.4677 70 42522 2021711 1611 CH3C-13-C-13-H 281222.0155 1.0200 -4.4075 3 577.2741 70 42522 2021710 1610 CH3C-13-C-13-H 281321.2779 1.0200 -4.1672 3 482.0264 70 42522 20217-9 16 9 CH3C-13-C-13-H 281321.2779 1.0200 -4.1672 3 482.0264 70 42522 20217 9 16-9 CH3C-13-C-13-H 281410.1942 1.0200 -3.9552 3 396.7462 70 42522 20217 8 16 8 CH3C-13-C-13-H 281488.7302 1.0200 -3.7701 3 321.4529 70 42522 20217 7 16 7 CH3C-13-C-13-H 281556.8558 1.0200 -3.6110 3 256.1636 70 42522 20217-6 16 6 CH3C-13-C-13-H 281556.8558 1.0200 -3.6110 3 256.1636 70 42522 20217 6 16-6 CH3C-13-C-13-H 281614.5448 1.0200 -3.4773 3 200.8933 70 42522 20217 5 16 5 CH3C-13-C-13-H 281661.7750 1.0200 -3.3683 3 155.6547 70 42522 20217 4 16 4 CH3C-13-C-13-H 281698.5284 1.0200 -3.2839 3 120.4584 70 42522 20217-3 16 3 CH3C-13-C-13-H 281698.5284 1.0200 -3.2839 3 120.4584 70 42522 20217 3 16-3 CH3C-13-C-13-H 281724.7909 1.0200 -3.2238 3 95.3123 70 42522 20217 2 16 2 CH3C-13-C-13-H 281740.5524 1.0200 -3.1877 3 80.2223 70 42522 20217 1 16 1 CH3C-13-C-13-H 281745.8069 1.0200 -3.1757 3 75.1919 70 42522 20217 0 16 0 CH3C-13-C-13-H 297069.7632 1.0800 -5.9872 3 1211.5566 74 42522 2021815 17a5 CH3C-13-C-13-H 297069.7632 1.0800 -5.9872 3 1211.5566 74 42522 20218a5 1715 CH3C-13-C-13-H 297228.8837 1.0800 -5.5738 3 1066.8413 74 42522 2021814 1714 CH3C-13-C-13-H 297377.2988 1.0800 -5.2093 3 931.9647 74 42522 2021813 1713 CH3C-13-C-13-H 297514.9509 1.0800 -4.8836 3 806.9566 74 42522 2021812 17a2 CH3C-13-C-13-H 297514.9509 1.0800 -4.8836 3 806.9566 74 42522 20218a2 1712 CH3C-13-C-13-H 297641.7867 1.0800 -4.5912 3 691.8446 74 42522 2021811 1711 CH3C-13-C-13-H 297757.7574 1.0800 -4.3291 3 586.6547 74 42522 2021810 1710 CH3C-13-C-13-H 297862.8181 1.0800 -4.0950 3 491.4103 74 42522 20218-9 17 9 CH3C-13-C-13-H 297862.8181 1.0800 -4.0950 3 491.4103 74 42522 20218 9 17-9 CH3C-13-C-13-H 297956.9284 1.0800 -3.8878 3 406.1330 74 42522 20218 8 17 8 CH3C-13-C-13-H 298040.0521 1.0800 -3.7063 3 330.8423 74 42522 20218 7 17 7 CH3C-13-C-13-H 298112.1572 1.0800 -3.5501 3 265.5553 74 42522 20218-6 17 6 CH3C-13-C-13-H 298112.1572 1.0800 -3.5501 3 265.5553 74 42522 20218 6 17-6 CH3C-13-C-13-H 298173.2161 1.0800 -3.4185 3 210.2869 74 42522 20218 5 17 5 CH3C-13-C-13-H 298223.2053 1.0800 -3.3113 3 165.0500 74 42522 20218 4 17 4 CH3C-13-C-13-H 298262.1057 1.0800 -3.2281 3 129.8548 74 42522 20218-3 17 3 CH3C-13-C-13-H 298262.1057 1.0800 -3.2281 3 129.8548 74 42522 20218 3 17-3 CH3C-13-C-13-H 298289.9023 1.0800 -3.1688 3 104.7096 74 42522 20218 2 17 2 CH3C-13-C-13-H 298306.5846 1.0800 -3.1333 3 89.6201 74 42522 20218 1 17 1 CH3C-13-C-13-H 298312.1460 1.0800 -3.1214 3 84.5899 74 42522 20218 0 17 0 CH3C-13-C-13-H 313566.4279 1.1400 -5.8470 3 1221.4658 78 42522 2021915 18a5 CH3C-13-C-13-H 313566.4279 1.1400 -5.8470 3 1221.4658 78 42522 20219a5 1815 CH3C-13-C-13-H 313734.3192 1.1400 -5.4613 3 1076.7558 78 42522 2021914 1814 CH3C-13-C-13-H 313890.9151 1.1400 -5.1141 3 941.8841 78 42522 2021913 1813 CH3C-13-C-13-H 314036.1549 1.1400 -4.8002 3 816.8806 78 42522 2021912 18a2 CH3C-13-C-13-H 314036.1549 1.1400 -4.8002 3 816.8806 78 42522 20219a2 1812 CH3C-13-C-13-H 314169.9822 1.1400 -4.5163 3 701.7729 78 42522 2021911 1811 CH3C-13-C-13-H 314292.3456 1.1400 -4.2605 3 596.5868 78 42522 2021910 1810 CH3C-13-C-13-H 314403.1976 1.1400 -4.0312 3 501.3459 78 42522 20219-9 18 9 CH3C-13-C-13-H 314403.1976 1.1400 -4.0312 3 501.3459 78 42522 20219 9 18-9 CH3C-13-C-13-H 314502.4957 1.1400 -3.8278 3 416.0718 78 42522 20219 8 18 8 CH3C-13-C-13-H 314590.2015 1.1400 -3.6493 3 340.7839 78 42522 20219 7 18 7 CH3C-13-C-13-H 314666.2815 1.1400 -3.4954 3 275.4992 78 42522 20219-6 18 6 CH3C-13-C-13-H 314666.2815 1.1400 -3.4954 3 275.4992 78 42522 20219 6 18-6 CH3C-13-C-13-H 314730.7063 1.1400 -3.3657 3 220.2329 78 42522 20219 5 18 5 CH3C-13-C-13-H 314783.4512 1.1400 -3.2598 3 174.9976 78 42522 20219 4 18 4 CH3C-13-C-13-H 314824.4960 1.1400 -3.1777 3 139.8038 78 42522 20219-3 18 3 CH3C-13-C-13-H 314824.4960 1.1400 -3.1777 3 139.8038 78 42522 20219 3 18-3 CH3C-13-C-13-H 314853.8249 1.1400 -3.1191 3 114.6595 78 42522 20219 2 18 2 CH3C-13-C-13-H 314871.4268 1.1400 -3.0840 3 99.5706 78 42522 20219 1 18 1 CH3C-13-C-13-H 314877.2948 1.1400 -3.0723 3 94.5405 78 42522 20219 0 18 0 CH3C-13-C-13-H 330061.9233 1.2000 -5.7376 3 1231.9253 82 42522 2022015 19a5 CH3C-13-C-13-H 330061.9233 1.2000 -5.7376 3 1231.9253 82 42522 20220a5 1915 CH3C-13-C-13-H 330238.5742 1.2000 -5.3692 3 1087.2208 82 42522 2022014 1914 CH3C-13-C-13-H 330403.3404 1.2000 -5.0339 3 952.3544 82 42522 2022013 1913 CH3C-13-C-13-H 330556.1581 1.2000 -4.7285 3 827.3557 82 42522 2022012 19a2 CH3C-13-C-13-H 330556.1581 1.2000 -4.7285 3 827.3557 82 42522 20220a2 1912 CH3C-13-C-13-H 330696.9681 1.2000 -4.4511 3 712.2525 82 42522 2022011 1911 CH3C-13-C-13-H 330825.7160 1.2000 -4.2001 3 607.0705 82 42522 2022010 1910 CH3C-13-C-13-H 330942.3520 1.2000 -3.9748 3 511.8333 82 42522 20220-9 19 9 CH3C-13-C-13-H 330942.3520 1.2000 -3.9748 3 511.8333 82 42522 20220 9 19-9 CH3C-13-C-13-H 331046.8313 1.2000 -3.7744 3 426.5625 82 42522 20220 8 19 8 CH3C-13-C-13-H 331139.1135 1.2000 -3.5984 3 351.2775 82 42522 20220 7 19 7 CH3C-13-C-13-H 331219.1632 1.2000 -3.4464 3 285.9954 82 42522 20220-6 19 6 CH3C-13-C-13-H 331219.1632 1.2000 -3.4464 3 285.9954 82 42522 20220 6 19-6 CH3C-13-C-13-H 331286.9496 1.2000 -3.3182 3 230.7312 82 42522 20220 5 19 5 CH3C-13-C-13-H 331342.4468 1.2000 -3.2135 3 185.4977 82 42522 20220 4 19 4 CH3C-13-C-13-H 331385.6333 1.2000 -3.1322 3 150.3052 82 42522 20220-3 19 3 CH3C-13-C-13-H 331385.6333 1.2000 -3.1322 3 150.3052 82 42522 20220 3 19-3 CH3C-13-C-13-H 331416.4926 1.2000 -3.0743 3 125.1619 82 42522 20220 2 19 2 CH3C-13-C-13-H 331435.0130 1.2000 -3.0395 3 110.0735 82 42522 20220 1 19 1 CH3C-13-C-13-H 331441.1872 1.2000 -3.0279 3 105.0437 82 42522 20220 0 19 0 CH3C-13-C-13-H 346556.1877 1.2600 -5.6486 3 1242.9350 86 42522 2022115 20a5 CH3C-13-C-13-H 346556.1877 1.2600 -5.6486 3 1242.9350 86 42522 20221a5 2015 CH3C-13-C-13-H 346741.5864 1.2600 -5.2920 3 1098.2364 86 42522 2022114 2014 CH3C-13-C-13-H 346914.5120 1.2600 -4.9653 3 963.3755 86 42522 2022113 2013 CH3C-13-C-13-H 347074.8975 1.2600 -4.6664 3 838.3819 86 42522 2022112 20a2 CH3C-13-C-13-H 347074.8975 1.2600 -4.6664 3 838.3819 86 42522 20221a2 2012 CH3C-13-C-13-H 347222.6807 1.2600 -4.3939 3 723.2833 86 42522 2022111 2011 CH3C-13-C-13-H 347357.8046 1.2600 -4.1469 3 618.1056 86 42522 2022110 2010 CH3C-13-C-13-H 347480.2169 1.2600 -3.9247 3 522.8723 86 42522 20221-9 20 9 CH3C-13-C-13-H 347480.2169 1.2600 -3.9247 3 522.8723 86 42522 20221 9 20-9 CH3C-13-C-13-H 347589.8704 1.2600 -3.7268 3 437.6050 86 42522 20221 8 20 8 CH3C-13-C-13-H 347686.7229 1.2600 -3.5528 3 362.3231 86 42522 20221 7 20 7 CH3C-13-C-13-H 347770.7370 1.2600 -3.4024 3 297.0437 86 42522 20221-6 20 6 CH3C-13-C-13-H 347770.7370 1.2600 -3.4024 3 297.0437 86 42522 20221 6 20-6 CH3C-13-C-13-H 347841.8806 1.2600 -3.2755 3 241.7818 86 42522 20221 5 20 5 CH3C-13-C-13-H 347900.1263 1.2600 -3.1719 3 196.5501 86 42522 20221 4 20 4 CH3C-13-C-13-H 347945.4517 1.2600 -3.0913 3 161.3590 86 42522 20221-3 20 3 CH3C-13-C-13-H 347945.4517 1.2600 -3.0913 3 161.3590 86 42522 20221 3 20-3 CH3C-13-C-13-H 347977.8394 1.2600 -3.0339 3 136.2167 86 42522 20221 2 20 2 CH3C-13-C-13-H 347997.2769 1.2600 -2.9995 3 121.1290 86 42522 20221 1 20 1 CH3C-13-C-13-H 348003.7570 1.2600 -2.9880 3 116.0994 86 42522 20221 0 20 0 CH3C-13-C-13-H 363049.1597 1.3200 -5.5742 3 1254.4948 90 42522 2022215 21a5 CH3C-13-C-13-H 363049.1597 1.3200 -5.5742 3 1254.4948 90 42522 20222a5 2115 CH3C-13-C-13-H 363243.2937 1.3200 -5.2263 3 1109.8025 90 42522 2022214 2114 CH3C-13-C-13-H 363424.3672 1.3200 -4.9061 3 974.9473 90 42522 2022213 2113 CH3C-13-C-13-H 363592.3097 1.3200 -4.6121 3 849.9590 90 42522 2022212 21a2 CH3C-13-C-13-H 363592.3097 1.3200 -4.6121 3 849.9590 90 42522 20222a2 2112 CH3C-13-C-13-H 363747.0564 1.3200 -4.3436 3 734.8655 90 42522 2022211 2111 CH3C-13-C-13-H 363888.5473 1.3200 -4.0998 3 629.6922 90 42522 2022210 2110 CH3C-13-C-13-H 364016.7277 1.3200 -3.8802 3 534.4630 90 42522 20222-9 21 9 CH3C-13-C-13-H 364016.7277 1.3200 -3.8802 3 534.4630 90 42522 20222 9 21-9 CH3C-13-C-13-H 364131.5481 1.3200 -3.6844 3 449.1994 90 42522 20222 8 21 8 CH3C-13-C-13-H 364232.9645 1.3200 -3.5121 3 373.9207 90 42522 20222 7 21 7 CH3C-13-C-13-H 364320.9376 1.3200 -3.3631 3 308.6440 90 42522 20222-6 21 6 CH3C-13-C-13-H 364320.9376 1.3200 -3.3631 3 308.6440 90 42522 20222 6 21-6 CH3C-13-C-13-H 364395.4336 1.3200 -3.2374 3 253.3845 90 42522 20222 5 21 5 CH3C-13-C-13-H 364456.4239 1.3200 -3.1346 3 208.1548 90 42522 20222 4 21 4 CH3C-13-C-13-H 364503.8852 1.3200 -3.0547 3 172.9652 90 42522 20222-3 21 3 CH3C-13-C-13-H 364503.8852 1.3200 -3.0547 3 172.9652 90 42522 20222 3 21-3 CH3C-13-C-13-H 364537.7991 1.3200 -2.9977 3 147.8240 90 42522 20222 2 21 2 CH3C-13-C-13-H 364558.1526 1.3200 -2.9636 3 132.7370 90 42522 20222 1 21 1 CH3C-13-C-13-H 364564.9380 1.3200 -2.9521 3 127.7075 90 42522 20222 0 21 0 CH3C-13-C-13-H 379540.7777 1.3800 -5.5111 3 1266.6048 94 42522 2022315 22a5 CH3C-13-C-13-H 379540.7777 1.3800 -5.5111 3 1266.6048 94 42522 20223a5 2215 CH3C-13-C-13-H 379743.6341 1.3800 -5.1698 3 1121.9189 94 42522 2022314 2214 CH3C-13-C-13-H 379932.8432 1.3800 -4.8546 3 987.0698 94 42522 2022313 2213 CH3C-13-C-13-H 380108.3317 1.3800 -4.5647 3 862.0872 94 42522 2022312 22a2 CH3C-13-C-13-H 380108.3317 1.3800 -4.5647 3 862.0872 94 42522 20223a2 2212 CH3C-13-C-13-H 380270.0315 1.3800 -4.2995 3 746.9987 94 42522 2022311 2211 CH3C-13-C-13-H 380417.8799 1.3800 -4.0583 3 641.8302 94 42522 2022310 2210 CH3C-13-C-13-H 380551.8199 1.3800 -3.8408 3 546.6053 94 42522 20223-9 22 9 CH3C-13-C-13-H 380551.8199 1.3800 -3.8408 3 546.6053 94 42522 20223 9 22-9 CH3C-13-C-13-H 380671.7997 1.3800 -3.6468 3 461.3455 94 42522 20223 8 22 8 CH3C-13-C-13-H 380777.7732 1.3800 -3.4760 3 386.0702 94 42522 20223 7 22 7 CH3C-13-C-13-H 380869.6993 1.3800 -3.3282 3 320.7965 94 42522 20223-6 22 6 CH3C-13-C-13-H 380869.6993 1.3800 -3.3282 3 320.7965 94 42522 20223 6 22-6 CH3C-13-C-13-H 380947.5429 1.3800 -3.2034 3 265.5394 94 42522 20223 5 22 5 CH3C-13-C-13-H 381011.2739 1.3800 -3.1013 3 220.3117 94 42522 20223 4 22 4 CH3C-13-C-13-H 381060.8679 1.3800 -3.0220 3 185.1238 94 42522 20223-3 22 3 CH3C-13-C-13-H 381060.8679 1.3800 -3.0220 3 185.1238 94 42522 20223 3 22-3 CH3C-13-C-13-H 381096.3057 1.3800 -2.9654 3 159.9837 94 42522 20223 2 22 2 CH3C-13-C-13-H 381117.5739 1.3800 -2.9315 3 144.8973 94 42522 20223 1 22 1 CH3C-13-C-13-H 381124.6642 1.3800 -2.9201 3 139.8681 94 42522 20223 0 22 0 CH3C-13-C-13-H 396030.9802 1.4400 -5.4572 3 1279.2650 98 42522 2022415 23a5 CH3C-13-C-13-H 396030.9802 1.4400 -5.4572 3 1279.2650 98 42522 20224a5 2315 CH3C-13-C-13-H 396242.5453 1.4400 -5.1209 3 1134.5858 98 42522 2022414 2314 CH3C-13-C-13-H 396439.8775 1.4400 -4.8098 3 999.7430 98 42522 2022413 2313 CH3C-13-C-13-H 396622.9002 1.4400 -4.5232 3 874.7662 98 42522 2022412 23a2 CH3C-13-C-13-H 396622.9002 1.4400 -4.5232 3 874.7662 98 42522 20224a2 2312 CH3C-13-C-13-H 396791.5422 1.4400 -4.2606 3 759.6832 98 42522 2022411 2311 CH3C-13-C-13-H 396945.7384 1.4400 -4.0217 3 654.5196 98 42522 2022410 2310 CH3C-13-C-13-H 397085.4291 1.4400 -3.8060 3 559.2992 98 42522 20224-9 23 9 CH3C-13-C-13-H 397085.4291 1.4400 -3.8060 3 559.2992 98 42522 20224 9 23-9 CH3C-13-C-13-H 397210.5604 1.4400 -3.6135 3 474.0433 98 42522 20224 8 23 8 CH3C-13-C-13-H 397321.0839 1.4400 -3.4440 3 398.7715 98 42522 20224 7 23 7 CH3C-13-C-13-H 397416.9570 1.4400 -3.2972 3 333.5009 98 42522 20224-6 23 6 CH3C-13-C-13-H 397416.9570 1.4400 -3.2972 3 333.5009 98 42522 20224 6 23-6 CH3C-13-C-13-H 397498.1430 1.4400 -3.1732 3 278.2465 98 42522 20224 5 23 5 CH3C-13-C-13-H 397564.6104 1.4400 -3.0718 3 233.0209 98 42522 20224 4 23 4 CH3C-13-C-13-H 397616.3338 1.4400 -2.9930 3 197.8346 98 42522 20224-3 23 3 CH3C-13-C-13-H 397616.3338 1.4400 -2.9930 3 197.8346 98 42522 20224 3 23-3 CH3C-13-C-13-H 397653.2933 1.4400 -2.9368 3 172.6957 98 42522 20224 2 23 2 CH3C-13-C-13-H 397675.4747 1.4400 -2.9031 3 157.6100 98 42522 20224 1 23 1 CH3C-13-C-13-H 397682.8694 1.4400 -2.8918 3 152.5811 98 42522 20224 0 23 0 CH3C-13-C-13-H 412519.7056 1.5000 -5.4108 3 1292.4751102 42522 2022515 24a5 CH3C-13-C-13-H 412519.7056 1.5000 -5.4108 3 1292.4751102 42522 20225a5 2415 CH3C-13-C-13-H 412739.9653 1.5000 -5.0786 3 1147.8031102 42522 2022514 2414 CH3C-13-C-13-H 412945.4073 1.5000 -4.7709 3 1012.9668102 42522 2022513 2413 CH3C-13-C-13-H 413135.9519 1.5000 -4.4870 3 887.9961102 42522 2022512 24a2 CH3C-13-C-13-H 413135.9519 1.5000 -4.4870 3 887.9961102 42522 20225a2 2412 CH3C-13-C-13-H 413311.5251 1.5000 -4.2267 3 772.9187102 42522 2022511 2411 CH3C-13-C-13-H 413472.0587 1.5000 -3.9896 3 667.7603102 42522 2022510 2410 CH3C-13-C-13-H 413617.4908 1.5000 -3.7755 3 572.5445102 42522 20225-9 24 9 CH3C-13-C-13-H 413617.4908 1.5000 -3.7755 3 572.5445102 42522 20225 9 24-9 CH3C-13-C-13-H 413747.7652 1.5000 -3.5843 3 487.2929102 42522 20225 8 24 8 CH3C-13-C-13-H 413862.8314 1.5000 -3.4158 3 412.0247102 42522 20225 7 24 7 CH3C-13-C-13-H 413962.6452 1.5000 -3.2700 3 346.7573102 42522 20225-6 24 6 CH3C-13-C-13-H 413962.6452 1.5000 -3.2700 3 346.7573102 42522 20225 6 24-6 CH3C-13-C-13-H 414047.1681 1.5000 -3.1467 3 291.5056102 42522 20225 5 24 5 CH3C-13-C-13-H 414116.3676 1.5000 -3.0459 3 246.2822102 42522 20225 4 24 4 CH3C-13-C-13-H 414170.2170 1.5000 -2.9675 3 211.0976102 42522 20225-3 24 3 CH3C-13-C-13-H 414170.2170 1.5000 -2.9675 3 211.0976102 42522 20225 3 24-3 CH3C-13-C-13-H 414208.6957 1.5000 -2.9116 3 185.9600102 42522 20225 2 24 2 CH3C-13-C-13-H 414231.7888 1.5000 -2.8780 3 170.8750102 42522 20225 1 24 1 CH3C-13-C-13-H 414239.4875 1.5000 -2.8668 3 165.8463102 42522 20225 0 24 0 CH3C-13-C-13-H 429006.8924 1.5600 -5.3709 3 1306.2353106 42522 2022615 25a5 CH3C-13-C-13-H 429006.8924 1.5600 -5.3709 3 1306.2353106 42522 20226a5 2515 CH3C-13-C-13-H 429235.8319 1.5600 -5.0421 3 1161.5706106 42522 2022614 2514 CH3C-13-C-13-H 429449.3700 1.5600 -4.7371 3 1026.7412106 42522 2022613 2513 CH3C-13-C-13-H 429647.4238 1.5600 -4.4555 3 901.7769106 42522 2022612 25a2 CH3C-13-C-13-H 429647.4238 1.5600 -4.4555 3 901.7769106 42522 20226a2 2512 CH3C-13-C-13-H 429829.9163 1.5600 -4.1971 3 786.7053106 42522 2022611 2511 CH3C-13-C-13-H 429996.7768 1.5600 -3.9616 3 681.5522106 42522 2022610 2510 CH3C-13-C-13-H 430147.9406 1.5600 -3.7489 3 586.3413106 42522 20226-9 25 9 CH3C-13-C-13-H 430147.9406 1.5600 -3.7489 3 586.3413106 42522 20226 9 25-9 CH3C-13-C-13-H 430283.3493 1.5600 -3.5588 3 501.0940106 42522 20226 8 25 8 CH3C-13-C-13-H 430402.9507 1.5600 -3.3913 3 425.8297106 42522 20226 7 25 7 CH3C-13-C-13-H 430506.6985 1.5600 -3.2462 3 360.5656106 42522 20226-6 25 6 CH3C-13-C-13-H 430506.6985 1.5600 -3.2462 3 360.5656106 42522 20226 6 25-6 CH3C-13-C-13-H 430594.5528 1.5600 -3.1236 3 305.3167106 42522 20226 5 25 5 CH3C-13-C-13-H 430666.4797 1.5600 -3.0233 3 260.0957106 42522 20226 4 25 4 CH3C-13-C-13-H 430722.4516 1.5600 -2.9453 3 224.9129106 42522 20226-3 25 3 CH3C-13-C-13-H 430722.4516 1.5600 -2.9453 3 224.9129106 42522 20226 3 25-3 CH3C-13-C-13-H 430762.4469 1.5600 -2.8897 3 199.7765106 42522 20226 2 25 2 CH3C-13-C-13-H 430786.4502 1.5600 -2.8563 3 184.6923106 42522 20226 1 25 1 CH3C-13-C-13-H 430794.4524 1.5600 -2.8451 3 179.6639106 42522 20226 0 25 0 CH3C-13-C-13-H 445492.4790 1.6200 -5.3366 3 1320.5454110 42522 2022715 26a5 CH3C-13-C-13-H 445492.4790 1.6200 -5.3366 3 1320.5454110 42522 20227a5 2615 CH3C-13-C-13-H 445730.0829 1.6200 -5.0106 3 1175.8884110 42522 2022714 2614 CH3C-13-C-13-H 445951.7029 1.6200 -4.7079 3 1041.0661110 42522 2022713 2613 CH3C-13-C-13-H 446157.2526 1.6200 -4.4283 3 916.1084110 42522 2022712 26a2 CH3C-13-C-13-H 446157.2526 1.6200 -4.4283 3 916.1084110 42522 20227a2 2612 CH3C-13-C-13-H 446346.6523 1.6200 -4.1715 3 801.0429110 42522 2022711 2611 CH3C-13-C-13-H 446519.8284 1.6200 -3.9374 3 695.8954110 42522 2022710 2610 CH3C-13-C-13-H 446676.7139 1.6200 -3.7259 3 600.6895110 42522 20227-9 26 9 CH3C-13-C-13-H 446676.7139 1.6200 -3.7259 3 600.6895110 42522 20227 9 26-9 CH3C-13-C-13-H 446817.2480 1.6200 -3.5369 3 515.4467110 42522 20227 8 26 8 CH3C-13-C-13-H 446941.3765 1.6200 -3.3702 3 440.1864110 42522 20227 7 26 7 CH3C-13-C-13-H 447049.0515 1.6200 -3.2258 3 374.9258110 42522 20227-6 26 6 CH3C-13-C-13-H 447049.0515 1.6200 -3.2258 3 374.9258110 42522 20227 6 26-6 CH3C-13-C-13-H 447140.2313 1.6200 -3.1037 3 319.6798110 42522 20227 5 26 5 CH3C-13-C-13-H 447214.8809 1.6200 -3.0039 3 274.4611110 42522 20227 4 26 4 CH3C-13-C-13-H 447272.9716 1.6200 -2.9262 3 239.2802110 42522 20227-3 26 3 CH3C-13-C-13-H 447272.9716 1.6200 -2.9262 3 239.2802110 42522 20227 3 26-3 CH3C-13-C-13-H 447314.4808 1.6200 -2.8708 3 214.1452110 42522 20227 2 26 2 CH3C-13-C-13-H 447339.3928 1.6200 -2.8376 3 199.0618110 42522 20227 1 26 1 CH3C-13-C-13-H 447347.6978 1.6200 -2.8265 3 194.0336110 42522 20227 0 26 0 CH3C-13-C-13-H 461976.4039 1.6800 -5.3074 3 1335.4055114 42522 2022815 27a5 CH3C-13-C-13-H 461976.4039 1.6800 -5.3074 3 1335.4055114 42522 20228a5 2715 CH3C-13-C-13-H 462222.6563 1.6800 -4.9837 3 1190.7563114 42522 2022814 2714 CH3C-13-C-13-H 462452.3432 1.6800 -4.6830 3 1055.9414114 42522 2022813 2713 CH3C-13-C-13-H 462665.3751 1.6800 -4.4050 3 930.9906114 42522 2022812 27a2 CH3C-13-C-13-H 462665.3751 1.6800 -4.4050 3 930.9906114 42522 20228a2 2712 CH3C-13-C-13-H 462861.6693 1.6800 -4.1497 3 815.9314114 42522 2022811 2711 CH3C-13-C-13-H 463041.1495 1.6800 -3.9169 3 710.7897114 42522 2022810 2710 CH3C-13-C-13-H 463203.7462 1.6800 -3.7063 3 615.5890114 42522 20228-9 27 9 CH3C-13-C-13-H 463203.7462 1.6800 -3.7063 3 615.5890114 42522 20228 9 27-9 CH3C-13-C-13-H 463349.3964 1.6800 -3.5182 3 530.3509114 42522 20228 8 27 8 CH3C-13-C-13-H 463478.0438 1.6800 -3.3523 3 455.0948114 42522 20228 7 27 7 CH3C-13-C-13-H 463589.6388 1.6800 -3.2085 3 389.8378114 42522 20228-6 27 6 CH3C-13-C-13-H 463589.6388 1.6800 -3.2085 3 389.8378114 42522 20228 6 27-6 CH3C-13-C-13-H 463684.1381 1.6800 -3.0869 3 334.5948114 42522 20228 5 27 5 CH3C-13-C-13-H 463761.5055 1.6800 -2.9875 3 289.3786114 42522 20228 4 27 4 CH3C-13-C-13-H 463821.7110 1.6800 -2.9101 3 254.1996114 42522 20228-3 27 3 CH3C-13-C-13-H 463821.7110 1.6800 -2.9101 3 254.1996114 42522 20228 3 27-3 CH3C-13-C-13-H 463864.7315 1.6800 -2.8549 3 229.0660114 42522 20228 2 27 2 CH3C-13-C-13-H 463890.5504 1.6800 -2.8218 3 213.9835114 42522 20228 1 27 1 CH3C-13-C-13-H 463899.1578 1.6800 -2.8107 3 208.9556114 42522 20228 0 27 0 CH3C-13-C-13-H 478458.6055 1.7400 -5.2827 3 1350.8153118 42522 2022915 28a5 CH3C-13-C-13-H 478458.6055 1.7400 -5.2827 3 1350.8153118 42522 20229a5 2815 CH3C-13-C-13-H 478713.4899 1.7400 -4.9610 3 1206.1744118 42522 2022914 2814 CH3C-13-C-13-H 478951.2283 1.7400 -4.6620 3 1071.3672118 42522 2022913 2813 CH3C-13-C-13-H 479171.7282 1.7400 -4.3855 3 946.4234118 42522 2022912 28a2 CH3C-13-C-13-H 479171.7282 1.7400 -4.3855 3 946.4234118 42522 20229a2 2812 CH3C-13-C-13-H 479374.9038 1.7400 -4.1314 3 831.3708118 42522 2022911 2811 CH3C-13-C-13-H 479560.6761 1.7400 -3.8996 3 726.2351118 42522 2022910 2810 CH3C-13-C-13-H 479728.9732 1.7400 -3.6900 3 631.0398118 42522 20229-9 28 9 CH3C-13-C-13-H 479728.9732 1.7400 -3.6900 3 631.0398118 42522 20229 9 28-9 CH3C-13-C-13-H 479879.7297 1.7400 -3.5027 3 545.8066118 42522 20229 8 28 8 CH3C-13-C-13-H 480012.8875 1.7400 -3.3374 3 470.5547118 42522 20229 7 28 7 CH3C-13-C-13-H 480128.3950 1.7400 -3.1942 3 405.3014118 42522 20229-6 28 6 CH3C-13-C-13-H 480128.3950 1.7400 -3.1942 3 405.3014118 42522 20229 6 28-6 CH3C-13-C-13-H 480226.2075 1.7400 -3.0731 3 350.0616118 42522 20229 5 28 5 CH3C-13-C-13-H 480306.2875 1.7400 -2.9740 3 304.8480118 42522 20229 4 28 4 CH3C-13-C-13-H 480368.6039 1.7400 -2.8969 3 269.6711118 42522 20229-3 28 3 CH3C-13-C-13-H 480368.6039 1.7400 -2.8969 3 269.6711118 42522 20229 3 28-3 CH3C-13-C-13-H 480413.1328 1.7400 -2.8419 3 244.5388118 42522 20229 2 28 2 CH3C-13-C-13-H 480439.8570 1.7400 -2.8089 3 229.4572118 42522 20229 1 28 1 CH3C-13-C-13-H 480448.7662 1.7400 -2.7979 3 224.4296118 42522 20229 0 28 0 CH3C-13-C-13-H 494939.0224 1.8000 -5.2621 3 1366.7750122 42522 2023015 29a5 CH3C-13-C-13-H 494939.0224 1.8000 -5.2621 3 1366.7750122 42522 20230a5 2915 CH3C-13-C-13-H 495202.5215 1.8000 -4.9422 3 1222.1426122 42522 2023014 2914 CH3C-13-C-13-H 495448.2955 1.8000 -4.6446 3 1087.3433122 42522 2023013 2913 CH3C-13-C-13-H 495676.2486 1.8000 -4.3694 3 962.4069122 42522 2023012 29a2 CH3C-13-C-13-H 495676.2486 1.8000 -4.3694 3 962.4069122 42522 20230a2 2912 CH3C-13-C-13-H 495886.2919 1.8000 -4.1164 3 847.3611122 42522 2023011 2911 CH3C-13-C-13-H 496078.3440 1.8000 -3.8855 3 742.2315122 42522 2023010 2910 CH3C-13-C-13-H 496252.3302 1.8000 -3.6768 3 647.0419122 42522 20230-9 29 9 CH3C-13-C-13-H 496252.3302 1.8000 -3.6768 3 647.0419122 42522 20230 9 29-9 CH3C-13-C-13-H 496408.1831 1.8000 -3.4901 3 561.8137122 42522 20230 8 29 8 CH3C-13-C-13-H 496545.8423 1.8000 -3.3254 3 486.5662122 42522 20230 7 29 7 CH3C-13-C-13-H 496665.2547 1.8000 -3.1827 3 421.3168122 42522 20230-6 29 6 CH3C-13-C-13-H 496665.2547 1.8000 -3.1827 3 421.3168122 42522 20230 6 29-6 CH3C-13-C-13-H 496766.3740 1.8000 -3.0620 3 366.0803122 42522 20230 5 29 5 CH3C-13-C-13-H 496849.1612 1.8000 -2.9632 3 320.8693122 42522 20230 4 29 4 CH3C-13-C-13-H 496913.5844 1.8000 -2.8864 3 285.6944122 42522 20230-3 29 3 CH3C-13-C-13-H 496913.5844 1.8000 -2.8864 3 285.6944122 42522 20230 3 29-3 CH3C-13-C-13-H 496959.6187 1.8000 -2.8316 3 260.5637122 42522 20230 2 29 2 CH3C-13-C-13-H 496987.2464 1.8000 -2.7987 3 245.4829122 42522 20230 1 29 1 CH3C-13-C-13-H 496996.4568 1.8000 -2.7877 3 240.4556122 42522 20230 0 29 0 CH3C-13-C-13-H