RDKit 3D 151153 0 0 0 0 0 0 0 0999 V2000 14.0327 0.5691 -0.0148 C 0 0 0 0 0 0 0 0 0 0 0 0 13.8749 -0.7682 0.1912 C 0 0 0 0 0 0 0 0 0 0 0 0 13.1282 -1.3091 1.3204 C 0 0 0 0 0 0 0 0 0 0 0 0 12.1520 -2.3557 0.9819 C 0 0 0 0 0 0 0 0 0 0 0 0 11.0390 -1.9965 0.0951 C 0 0 0 0 0 0 0 0 0 0 0 0 11.3855 -1.5283 -1.2585 C 0 0 0 0 0 0 0 0 0 0 0 0 10.2421 -1.2739 -2.2014 C 0 0 1 0 0 0 0 0 0 0 0 0 9.3917 -2.4675 -2.4792 C 0 0 0 0 0 0 0 0 0 0 0 0 9.5696 -0.0209 -1.8892 C 0 0 0 0 0 0 0 0 0 0 0 0 10.1911 1.0365 -2.3758 O 0 0 0 0 0 0 0 0 0 0 0 0 8.3975 0.2515 -1.1757 N 0 0 0 0 0 0 0 0 0 0 0 0 7.9969 1.6786 -1.0708 C 0 0 0 0 0 0 0 0 0 0 0 0 7.5736 -0.6895 -0.5105 C 0 0 1 0 0 0 0 0 0 0 0 0 7.6881 -0.4307 1.0124 C 0 0 0 0 0 0 0 0 0 0 0 0 6.1429 -0.7454 -0.8638 C 0 0 0 0 0 0 0 0 0 0 0 0 5.4041 -1.2229 0.0999 O 0 0 0 0 0 0 0 0 0 0 0 0 5.4498 -0.3934 -2.0054 N 0 0 0 0 0 0 0 0 0 0 0 0 6.2149 0.1413 -3.1615 C 0 0 0 0 0 0 0 0 0 0 0 0 4.0253 -0.4716 -2.2758 C 0 0 2 0 0 0 0 0 0 0 0 0 3.3016 0.4418 -1.3744 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7038 0.6882 -0.1979 O 0 0 0 0 0 0 0 0 0 0 0 0 2.0900 1.1339 -1.7696 N 0 0 0 0 0 0 0 0 0 0 0 0 1.4254 0.9296 -3.0546 C 0 0 0 0 0 0 0 0 0 0 0 0 0.8012 2.2797 -3.4163 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0007 3.1566 -2.2258 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4533 2.1838 -1.0857 C 0 0 1 0 0 0 0 0 0 0 0 0 0.3926 2.0845 -0.1217 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1483 3.2619 0.1381 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.1422 1.0231 0.5645 N 0 0 0 0 0 0 0 0 0 0 0 0 0.3953 -0.3345 0.2183 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.0668 0.9816 1.6696 C 0 0 2 0 0 0 0 0 0 0 0 0 -2.1580 1.8781 1.7592 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.9245 3.1643 1.6393 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.5399 1.6574 1.9799 N 0 0 0 0 0 0 0 0 0 0 0 0 -4.4030 2.7885 2.2532 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.1798 0.3585 1.8212 C 0 0 2 0 0 0 0 0 0 0 0 0 -5.1510 0.3123 0.7731 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.5832 0.6448 -0.4120 O 0 0 0 0 0 0 0 0 0 0 0 0 -6.5092 0.0384 0.5730 N 0 0 0 0 0 0 0 0 0 0 0 0 -6.9655 0.1421 -0.8302 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.4928 -0.3242 1.5271 C 0 0 1 0 0 0 0 0 0 0 0 0 -8.3692 0.8248 2.0055 C 0 0 0 0 0 0 0 0 0 0 0 0 -9.2002 1.5924 1.1411 C 0 0 0 0 0 0 0 0 0 0 0 0 -10.5392 1.3169 0.9845 C 0 0 0 0 0 0 0 0 0 0 0 0 -11.3452 2.0833 0.1866 C 0 0 0 0 0 0 0 0 0 0 0 0 -10.8713 3.1808 -0.5135 C 0 0 0 0 0 0 0 0 0 0 0 0 -11.6691 3.9686 -1.3253 O 0 0 0 0 0 0 0 0 0 0 0 0 -13.0366 3.7574 -1.5378 C 0 0 0 0 0 0 0 0 0 0 0 0 -9.5151 3.4470 -0.3451 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.7084 2.6792 0.4528 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.1776 -1.6192 1.4488 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.6886 -2.4928 2.3659 O 0 0 0 0 0 0 0 0 0 0 0 0 -9.1750 -2.1878 0.7191 N 0 0 0 0 0 0 0 0 0 0 0 0 -9.5894 -3.5788 1.1779 C 0 0 0 0 0 0 0 0 0 0 0 0 -9.8772 -1.7958 -0.4398 C 0 0 0 0 0 0 0 0 0 0 0 0 -9.3000 -2.3460 -1.7297 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.7620 -1.7572 -2.7667 N 0 0 0 0 0 0 0 0 0 0 0 0 -8.3356 -2.4404 -3.7774 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.4691 -3.8121 -3.7171 C 0 0 0 0 0 0 0 0 0 0 0 0 -9.2081 -4.0163 -2.1933 S 0 0 0 0 0 0 0 0 0 0 0 0 -4.2801 -0.4099 3.0980 C 0 0 1 0 0 0 0 0 0 0 0 0 -5.0161 0.2110 4.2255 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.5900 -1.8648 2.8155 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1150 1.1625 2.9301 C 0 0 1 0 0 0 0 0 0 0 0 0 0.6553 2.4286 2.8868 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.0061 1.1345 4.1651 C 0 0 0 0 0 0 0 0 0 0 0 0 3.4230 -1.8120 -2.3279 C 0 0 1 0 0 0 0 0 0 0 0 0 4.0666 -2.6998 -3.3930 C 0 0 0 0 0 0 0 0 0 0 0 0 3.1633 -2.5736 -1.0871 C 0 0 0 0 0 0 0 0 0 0 0 0 14.5942 0.9286 -0.8654 H 0 0 0 0 0 0 0 0 0 0 0 0 13.5734 1.2308 0.7030 H 0 0 0 0 0 0 0 0 0 0 0 0 14.3364 -1.4492 -0.5341 H 0 0 0 0 0 0 0 0 0 0 0 0 12.6527 -0.4259 1.8427 H 0 0 0 0 0 0 0 0 0 0 0 0 13.8437 -1.7417 2.0951 H 0 0 0 0 0 0 0 0 0 0 0 0 11.6759 -2.7851 1.9311 H 0 0 0 0 0 0 0 0 0 0 0 0 12.6731 -3.2618 0.5058 H 0 0 0 0 0 0 0 0 0 0 0 0 10.3054 -2.8598 0.0488 H 0 0 0 0 0 0 0 0 0 0 0 0 10.4541 -1.1667 0.6400 H 0 0 0 0 0 0 0 0 0 0 0 0 12.1807 -2.1577 -1.7216 H 0 0 0 0 0 0 0 0 0 0 0 0 11.8650 -0.5008 -1.1265 H 0 0 0 0 0 0 0 0 0 0 0 0 10.7900 -1.0635 -3.2133 H 0 0 0 0 0 0 0 0 0 0 0 0 9.9188 -3.0479 -3.3208 H 0 0 0 0 0 0 0 0 0 0 0 0 8.4060 -2.1962 -2.8749 H 0 0 0 0 0 0 0 0 0 0 0 0 9.3765 -3.2167 -1.6676 H 0 0 0 0 0 0 0 0 0 0 0 0 7.0624 1.8050 -0.5262 H 0 0 0 0 0 0 0 0 0 0 0 0 8.0523 2.0746 -2.0770 H 0 0 0 0 0 0 0 0 0 0 0 0 8.8035 2.1369 -0.4369 H 0 0 0 0 0 0 0 0 0 0 0 0 8.0071 -1.7400 -0.6058 H 0 0 0 0 0 0 0 0 0 0 0 0 6.6636 -0.2400 1.4281 H 0 0 0 0 0 0 0 0 0 0 0 0 8.3461 0.4225 1.1837 H 0 0 0 0 0 0 0 0 0 0 0 0 8.0702 -1.3403 1.4959 H 0 0 0 0 0 0 0 0 0 0 0 0 6.0725 1.2284 -3.2716 H 0 0 0 0 0 0 0 0 0 0 0 0 5.7005 -0.3118 -4.0681 H 0 0 0 0 0 0 0 0 0 0 0 0 7.2465 -0.1276 -3.1620 H 0 0 0 0 0 0 0 0 0 0 0 0 3.8610 -0.0591 -3.3469 H 0 0 0 0 0 0 0 0 0 0 0 0 2.1057 0.6410 -3.8678 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6046 0.2141 -3.0426 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2742 2.1838 -3.6584 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2916 2.6839 -4.3336 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0702 3.6511 -1.8980 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7649 3.9042 -2.4417 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3079 2.8659 -0.6053 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3045 -1.1227 0.6195 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3841 -0.4609 0.6439 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4047 -0.3999 -0.8638 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.3224 -0.1089 1.8328 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.6428 2.8994 3.3563 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.3855 2.6749 1.7491 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.8563 3.7018 1.9949 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.2576 -0.2520 1.3408 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.9929 0.3703 -0.9620 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.2788 0.8135 -1.4117 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.7441 -0.8868 -1.2395 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.9041 -0.4692 2.5569 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.9570 0.3545 2.8731 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.6629 1.5082 2.5824 H 0 0 0 0 0 0 0 0 0 0 0 0 -10.9910 0.4535 1.5165 H 0 0 0 0 0 0 0 0 0 0 0 0 -12.4007 1.8377 0.0792 H 0 0 0 0 0 0 0 0 0 0 0 0 -13.5259 3.6395 -0.5311 H 0 0 0 0 0 0 0 0 0 0 0 0 -13.5149 4.6066 -2.0855 H 0 0 0 0 0 0 0 0 0 0 0 0 -13.2036 2.8280 -2.1369 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.1281 4.2988 -0.8831 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.6571 2.9315 0.5521 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.8065 -4.0350 1.7634 H 0 0 0 0 0 0 0 0 0 0 0 0 -10.5056 -3.3764 1.7605 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.8542 -4.1754 0.2995 H 0 0 0 0 0 0 0 0 0 0 0 0 -10.9488 -2.1377 -0.3510 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.9163 -0.7199 -0.6045 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.8718 -1.9634 -4.6650 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.1625 -4.5431 -4.4862 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.1733 -0.4646 3.4626 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.3081 0.6886 4.9579 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.7889 0.9321 3.9650 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.4891 -0.6179 4.8206 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.6460 -2.4408 2.8315 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.0706 -1.9996 1.8215 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.2101 -2.2485 3.6342 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5220 0.2632 2.9575 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0377 3.3209 2.8198 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2561 2.4776 3.8466 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4154 2.3674 2.0851 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.0366 1.5093 3.9354 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5671 1.8044 4.9497 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1253 0.1180 4.5870 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3698 -1.6404 -2.7814 H 0 0 0 0 0 0 0 0 0 0 0 0 4.1634 -2.1805 -4.3438 H 0 0 0 0 0 0 0 0 0 0 0 0 5.0174 -3.1454 -3.0244 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3670 -3.5711 -3.5503 H 0 0 0 0 0 0 0 0 0 0 0 0 2.8983 -2.0094 -0.1969 H 0 0 0 0 0 0 0 0 0 0 0 0 4.0121 -3.2701 -0.8149 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2975 -3.3134 -1.2352 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 2 3 2 3 1 0 3 4 1 0 4 5 1 0 5 6 1 0 6 7 1 0 7 8 1 0 7 9 1 0 9 10 2 0 9 11 1 0 11 12 1 0 11 13 1 0 13 14 1 0 13 15 1 0 15 16 2 0 15 17 1 0 17 18 1 0 17 19 1 0 19 20 1 0 20 21 2 0 20 22 1 0 22 23 1 0 23 24 1 0 24 25 1 0 25 26 1 0 26 27 1 0 27 28 2 0 27 29 1 0 29 30 1 0 29 31 1 0 31 32 1 0 32 33 2 0 32 34 1 0 34 35 1 0 34 36 1 0 36 37 1 0 37 38 2 0 37 39 1 0 39 40 1 0 39 41 1 0 41 42 1 0 42 43 1 0 43 44 2 0 44 45 1 0 45 46 2 0 46 47 1 0 47 48 1 0 46 49 1 0 49 50 2 0 41 51 1 0 51 52 2 0 51 53 1 0 53 54 1 0 53 55 1 0 55 56 1 0 56 57 2 0 57 58 1 0 58 59 2 0 59 60 1 0 36 61 1 0 61 62 1 0 61 63 1 0 31 64 1 0 64 65 1 0 64 66 1 0 19 67 1 0 67 68 1 0 67 69 1 0 26 22 1 0 50 43 1 0 60 56 1 0 1 70 1 0 1 71 1 0 2 72 1 0 3 73 1 0 3 74 1 0 4 75 1 0 4 76 1 0 5 77 1 0 5 78 1 0 6 79 1 0 6 80 1 0 7 81 1 6 8 82 1 0 8 83 1 0 8 84 1 0 12 85 1 0 12 86 1 0 12 87 1 0 13 88 1 1 14 89 1 0 14 90 1 0 14 91 1 0 18 92 1 0 18 93 1 0 18 94 1 0 19 95 1 6 23 96 1 0 23 97 1 0 24 98 1 0 24 99 1 0 25100 1 0 25101 1 0 26102 1 1 30103 1 0 30104 1 0 30105 1 0 31106 1 1 35107 1 0 35108 1 0 35109 1 0 36110 1 6 40111 1 0 40112 1 0 40113 1 0 41114 1 1 42115 1 0 42116 1 0 44117 1 0 45118 1 0 48119 1 0 48120 1 0 48121 1 0 49122 1 0 50123 1 0 54124 1 0 54125 1 0 54126 1 0 55127 1 0 55128 1 0 58129 1 0 59130 1 0 61131 1 1 62132 1 0 62133 1 0 62134 1 0 63135 1 0 63136 1 0 63137 1 0 64138 1 1 65139 1 0 65140 1 0 65141 1 0 66142 1 0 66143 1 0 66144 1 0 67145 1 6 68146 1 0 68147 1 0 68148 1 0 69149 1 0 69150 1 0 69151 1 0 M END