RDKit 3D 118120 0 0 0 0 0 0 0 0999 V2000 -2.2712 6.8045 -1.2153 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.5908 6.3067 -2.4405 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.5386 5.9491 -3.5820 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.5401 4.9241 -3.1487 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.4654 4.4054 -4.1754 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.9577 3.6649 -5.3593 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.1563 2.4396 -5.0957 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.7954 2.6044 -4.5793 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.1083 1.3331 -4.0850 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.8861 0.7871 -2.9065 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.2268 -0.3953 -2.2380 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1063 -0.0352 -1.7117 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3157 1.0522 -0.7864 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1074 1.1917 0.6107 C 0 0 2 0 0 0 0 0 0 0 0 0 0.4689 0.1643 1.4622 O 0 0 0 0 0 0 0 0 0 0 0 0 1.7815 0.3192 1.9684 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4151 1.3069 1.6199 O 0 0 0 0 0 0 0 0 0 0 0 0 2.3583 -0.7086 2.8803 C 0 0 2 0 0 0 0 0 0 0 0 0 3.8082 -0.4441 3.1726 C 0 0 0 0 0 0 0 0 0 0 0 0 4.1401 0.8321 3.8334 C 0 0 0 0 0 0 0 0 0 0 0 0 5.6494 0.9502 4.0603 C 0 0 0 0 0 0 0 0 0 0 0 0 6.4348 0.9315 2.7591 C 0 0 0 0 0 0 0 0 0 0 0 0 7.8515 0.9919 3.0442 N 0 0 0 0 0 0 0 0 0 0 0 0 8.4680 2.1763 3.1497 O 0 0 0 0 0 0 0 0 0 0 0 0 8.5946 -0.2197 3.2197 C 0 0 0 0 0 0 0 0 0 0 0 0 7.9383 -1.5604 3.1162 C 0 0 0 0 0 0 0 0 0 0 0 0 9.8276 -0.2089 3.4690 O 0 0 0 0 0 0 0 0 0 0 0 0 2.4332 -1.9057 1.9665 N 0 0 0 0 0 0 0 0 0 0 0 0 1.6410 -2.9977 2.3324 C 0 0 0 0 0 0 0 0 0 0 0 0 0.9494 -2.9544 3.3907 O 0 0 0 0 0 0 0 0 0 0 0 0 1.5584 -4.2100 1.5465 C 0 0 0 0 0 0 0 0 0 0 0 0 0.9381 -5.4016 1.9140 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0220 -6.2206 0.9199 O 0 0 0 0 0 0 0 0 0 0 0 0 1.6448 -5.6927 -0.0941 C 0 0 0 0 0 0 0 0 0 0 0 0 1.8938 -6.3538 -1.3594 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5601 -5.7317 -2.3920 C 0 0 0 0 0 0 0 0 0 0 0 0 2.7701 -6.3687 -3.6143 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3151 -7.6506 -3.8255 C 0 0 0 0 0 0 0 0 0 0 0 0 1.6478 -8.2745 -2.7883 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4341 -7.6532 -1.5774 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7688 -8.2602 -0.5273 O 0 0 0 0 0 0 0 0 0 0 0 0 1.9881 -4.4437 0.2785 N 0 0 0 0 0 0 0 0 0 0 0 0 -1.4897 1.4659 1.0198 C 0 0 1 0 0 0 0 0 0 0 0 0 -2.5268 0.4790 0.6495 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4987 1.6656 2.4954 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.4161 2.0929 3.0107 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.6009 1.4201 3.3111 N 0 0 0 0 0 0 0 0 0 0 0 0 -2.4612 1.6848 4.7611 C 0 0 1 0 0 0 0 0 0 0 0 0 -3.7863 2.0466 5.3335 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.1390 1.0192 6.3948 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.8218 -0.1496 5.7073 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.8617 -1.2813 5.4920 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.4910 -0.8842 5.3966 N 0 0 0 0 0 0 0 0 0 0 0 0 -1.9225 0.3985 5.3410 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.7650 0.5324 5.8583 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.5768 7.5321 -0.6969 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.3654 5.9755 -0.4450 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.2194 7.3027 -1.3896 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9503 7.1480 -2.8278 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9663 5.4326 -2.1667 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.0597 6.8914 -3.9254 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.9109 5.6597 -4.4394 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.1855 5.4259 -2.2986 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.0298 4.0885 -2.6413 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.0576 5.3194 -4.5460 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.2961 3.8181 -3.6527 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.8432 3.4617 -6.0234 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.3249 4.3714 -5.9531 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.7968 1.7307 -4.5055 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.0952 1.9091 -6.1084 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1387 2.8345 -5.5321 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.5022 3.3839 -3.9263 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0784 1.6003 -3.8170 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0692 0.6444 -4.9497 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.0152 1.6403 -2.2196 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.8729 0.4752 -3.2567 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.9230 -0.9489 -1.6305 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0216 -1.1064 -3.1203 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5012 -0.9927 -1.2117 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8097 0.0106 -2.6173 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4866 1.1776 -0.7707 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0779 2.0785 -1.2582 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5325 2.1134 0.9781 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7354 -0.9114 3.7461 H 0 0 0 0 0 0 0 0 0 0 0 0 4.3235 -0.5555 2.1613 H 0 0 0 0 0 0 0 0 0 0 0 0 4.1410 -1.3159 3.8240 H 0 0 0 0 0 0 0 0 0 0 0 0 3.7494 1.7141 3.3305 H 0 0 0 0 0 0 0 0 0 0 0 0 3.6904 0.8232 4.8710 H 0 0 0 0 0 0 0 0 0 0 0 0 6.0022 0.1984 4.7906 H 0 0 0 0 0 0 0 0 0 0 0 0 5.7866 1.9562 4.5634 H 0 0 0 0 0 0 0 0 0 0 0 0 6.1814 1.8778 2.2083 H 0 0 0 0 0 0 0 0 0 0 0 0 6.1725 0.1089 2.0933 H 0 0 0 0 0 0 0 0 0 0 0 0 9.4404 2.1021 3.2927 H 0 0 0 0 0 0 0 0 0 0 0 0 8.7296 -2.3362 2.9113 H 0 0 0 0 0 0 0 0 0 0 0 0 7.5125 -1.8194 4.1083 H 0 0 0 0 0 0 0 0 0 0 0 0 7.2105 -1.5833 2.3066 H 0 0 0 0 0 0 0 0 0 0 0 0 3.0478 -1.8334 1.1632 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4711 -5.5651 2.8959 H 0 0 0 0 0 0 0 0 0 0 0 0 2.9320 -4.7275 -2.2569 H 0 0 0 0 0 0 0 0 0 0 0 0 3.2878 -5.8822 -4.4254 H 0 0 0 0 0 0 0 0 0 0 0 0 2.4558 -8.1865 -4.7659 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2791 -9.2975 -2.9436 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4124 -9.1991 -0.6428 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.8128 2.4655 0.5380 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.0471 0.7015 -0.3116 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.0833 -0.5318 0.6763 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.3367 0.4666 1.3892 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.5394 1.0731 3.0402 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.6888 2.4658 4.8717 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.7919 3.0792 5.7388 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.5809 1.9978 4.5318 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.1833 0.7208 6.8835 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.7941 1.4753 7.1734 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.6407 -0.5013 6.3610 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.2921 0.1716 4.7610 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.1574 -1.8492 4.5743 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.0181 -2.0197 6.3328 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.8106 -1.6917 5.3698 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 2 3 1 0 3 4 1 0 4 5 1 0 5 6 1 0 6 7 1 0 7 8 1 0 8 9 1 0 9 10 1 0 10 11 1 0 11 12 1 0 12 13 1 0 13 14 1 0 14 15 1 0 15 16 1 0 16 17 2 0 16 18 1 0 18 19 1 0 19 20 1 0 20 21 1 0 21 22 1 0 22 23 1 0 23 24 1 0 23 25 1 0 25 26 1 0 25 27 2 0 18 28 1 0 28 29 1 0 29 30 2 0 29 31 1 0 31 32 2 0 32 33 1 0 33 34 1 0 34 35 1 0 35 36 2 0 36 37 1 0 37 38 2 0 38 39 1 0 39 40 2 0 40 41 1 0 34 42 2 0 14 43 1 0 43 44 1 0 43 45 1 0 45 46 2 0 45 47 1 0 47 48 1 0 48 49 1 0 49 50 1 0 50 51 1 0 51 52 1 0 52 53 1 0 53 54 1 0 54 55 2 0 42 31 1 0 54 48 1 0 40 35 1 0 1 56 1 0 1 57 1 0 1 58 1 0 2 59 1 0 2 60 1 0 3 61 1 0 3 62 1 0 4 63 1 0 4 64 1 0 5 65 1 0 5 66 1 0 6 67 1 0 6 68 1 0 7 69 1 0 7 70 1 0 8 71 1 0 8 72 1 0 9 73 1 0 9 74 1 0 10 75 1 0 10 76 1 0 11 77 1 0 11 78 1 0 12 79 1 0 12 80 1 0 13 81 1 0 13 82 1 0 14 83 1 1 18 84 1 1 19 85 1 0 19 86 1 0 20 87 1 0 20 88 1 0 21 89 1 0 21 90 1 0 22 91 1 0 22 92 1 0 24 93 1 0 26 94 1 0 26 95 1 0 26 96 1 0 28 97 1 0 32 98 1 0 36 99 1 0 37100 1 0 38101 1 0 39102 1 0 41103 1 0 43104 1 6 44105 1 0 44106 1 0 44107 1 0 47108 1 0 48109 1 6 49110 1 0 49111 1 0 50112 1 0 50113 1 0 51114 1 0 51115 1 0 52116 1 0 52117 1 0 53118 1 0 M END