RDKit 3D 100104 0 0 0 0 0 0 0 0999 V2000 9.1212 3.8181 3.1187 C 0 0 0 0 0 0 0 0 0 0 0 0 8.1328 2.7028 2.9741 C 0 0 0 0 0 0 0 0 0 0 0 0 7.8552 1.8405 3.9646 C 0 0 0 0 0 0 0 0 0 0 0 0 6.9503 0.6892 3.7740 C 0 0 0 0 0 0 0 0 0 0 0 0 6.8579 -0.1760 4.6351 O 0 0 0 0 0 0 0 0 0 0 0 0 6.2817 0.6232 2.5972 O 0 0 0 0 0 0 0 0 0 0 0 0 6.1106 1.8356 1.8380 C 0 0 2 0 0 0 0 0 0 0 0 0 5.5151 1.4377 0.5133 C 0 0 0 0 0 0 0 0 0 0 0 0 4.4668 1.9952 -0.1274 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7155 3.2054 0.3589 C 0 0 0 0 0 0 0 0 0 0 0 0 3.9852 1.4204 -1.4473 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5951 0.7723 -1.3812 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5605 -0.4655 -0.4696 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2102 -1.2157 -0.4265 C 0 0 1 0 0 0 0 0 0 0 0 0 0.1308 -0.3825 0.3008 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.2900 -0.9384 0.1034 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.7330 -1.1267 -1.3899 C 0 0 1 0 0 0 0 0 0 0 0 0 -2.8456 -2.2304 -1.4204 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.0513 -1.9831 -0.4958 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.1307 -3.0517 -0.7074 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.3228 -2.8570 0.2103 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.2964 -1.7929 -0.2219 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.4633 -3.6287 1.3080 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.5908 -3.6272 2.3069 C 0 0 2 0 0 0 0 0 0 0 0 0 -7.2048 -2.8524 3.5689 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.2359 -3.0861 4.6356 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.3803 -2.0384 5.6953 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.9711 -4.2089 4.6143 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.7480 -5.2753 3.6174 C 0 0 0 0 0 0 0 0 0 0 0 0 -9.3013 -6.3607 3.7372 O 0 0 0 0 0 0 0 0 0 0 0 0 -7.8770 -5.0053 2.6150 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.1866 0.2038 -2.0041 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.2739 0.4304 -2.7448 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.1625 1.8386 -3.0924 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.0053 2.4319 -3.7477 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.8907 2.4129 -2.5283 C 0 0 1 0 0 0 0 0 0 0 0 0 -0.9270 2.8245 -3.6315 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.1732 3.5406 -1.5475 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.3294 1.2935 -1.8090 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.5435 -1.6146 -2.1605 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7299 -1.6801 -1.7725 C 0 0 0 0 0 0 0 0 0 0 0 0 1.6657 -2.1940 -2.6629 O 0 0 0 0 0 0 0 0 0 0 0 0 0.9388 -2.4844 -3.8788 C 0 0 1 0 0 0 0 0 0 0 0 0 1.4818 -1.6125 -5.0021 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0559 -3.9701 -4.1855 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.4829 -2.1058 -3.5316 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4516 -2.1806 -4.2727 O 0 0 0 0 0 0 0 0 0 0 0 0 7.4471 2.5559 1.6457 C 0 0 0 0 0 0 0 0 0 0 0 0 9.5845 3.8287 4.1109 H 0 0 0 0 0 0 0 0 0 0 0 0 8.6289 4.7844 2.9690 H 0 0 0 0 0 0 0 0 0 0 0 0 9.9200 3.7154 2.3773 H 0 0 0 0 0 0 0 0 0 0 0 0 8.3327 1.8947 4.9365 H 0 0 0 0 0 0 0 0 0 0 0 0 5.4136 2.4627 2.4058 H 0 0 0 0 0 0 0 0 0 0 0 0 5.9956 0.5706 0.0587 H 0 0 0 0 0 0 0 0 0 0 0 0 4.2416 3.7457 1.1498 H 0 0 0 0 0 0 0 0 0 0 0 0 3.5720 3.9172 -0.4612 H 0 0 0 0 0 0 0 0 0 0 0 0 2.7319 2.9158 0.7415 H 0 0 0 0 0 0 0 0 0 0 0 0 3.9657 2.2273 -2.1911 H 0 0 0 0 0 0 0 0 0 0 0 0 4.7005 0.6825 -1.8330 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3125 0.4900 -2.4016 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8611 1.5148 -1.0521 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3412 -1.1646 -0.7980 H 0 0 0 0 0 0 0 0 0 0 0 0 2.8236 -0.1756 0.5552 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3726 -2.1236 0.1719 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3581 -0.3685 1.3746 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1576 0.6633 -0.0149 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.3244 -1.9080 0.6203 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.9983 -0.2848 0.6292 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.4002 -3.1962 -1.1402 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.2157 -2.3677 -2.4444 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.4730 -0.9896 -0.6753 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.7298 -2.0068 0.5519 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.6889 -4.0441 -0.5484 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.4744 -3.0414 -1.7495 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.7863 -0.8323 -0.3435 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.7499 -2.0658 -1.1803 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.1046 -1.6301 0.4947 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.6887 -4.3662 1.5217 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.5027 -3.2128 1.8619 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.1321 -1.7844 3.3306 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.2298 -3.1761 3.9552 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.4305 -1.8974 6.2210 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.1374 -2.3092 6.4387 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.6764 -1.0838 5.2486 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.7179 -4.4322 5.3679 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.0607 -0.2224 -3.0713 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7326 1.9906 -4.3163 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.3226 3.6586 -4.2202 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0421 3.1174 -3.2124 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2529 3.8604 -1.0463 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.8621 3.2134 -0.7599 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.6202 4.4060 -2.0476 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9493 -1.7903 -5.9422 H 0 0 0 0 0 0 0 0 0 0 0 0 2.5491 -1.8017 -5.1609 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3842 -0.5485 -4.7567 H 0 0 0 0 0 0 0 0 0 0 0 0 2.1043 -4.2594 -4.3169 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6643 -4.5741 -3.3586 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5009 -4.2389 -5.0903 H 0 0 0 0 0 0 0 0 0 0 0 0 7.2672 3.5388 1.1938 H 0 0 0 0 0 0 0 0 0 0 0 0 8.1115 1.9958 0.9754 H 0 0 0 0 0 0 0 0 0 0 0 0 42 41 1 0 17 18 1 1 14 13 1 0 18 19 1 0 7 48 1 0 19 20 1 0 9 10 1 0 20 21 1 0 21 23 2 0 23 24 1 0 4 5 2 0 17 32 1 0 32 39 1 0 7 8 1 0 2 1 1 0 14 15 1 0 2 3 2 0 39 36 1 0 36 34 1 0 34 33 1 0 33 32 2 0 8 9 2 0 43 44 1 6 2 48 1 0 43 45 1 0 14 41 1 0 46 47 2 0 25 24 1 0 15 16 1 0 16 17 1 0 17 40 1 0 41 40 2 0 9 11 1 0 3 4 1 0 25 26 1 0 24 31 1 0 31 29 1 0 29 28 1 0 28 26 2 0 11 12 1 0 26 27 1 0 4 6 1 0 29 30 2 0 12 13 1 0 21 22 1 0 40 46 1 0 34 35 2 0 46 43 1 0 36 37 1 6 43 42 1 0 36 38 1 0 7 6 1 0 3 52 1 0 7 53 1 1 48 99 1 0 48100 1 0 8 54 1 0 11 58 1 0 11 59 1 0 12 60 1 0 12 61 1 0 13 62 1 0 13 63 1 0 14 64 1 1 10 55 1 0 10 56 1 0 10 57 1 0 1 49 1 0 1 50 1 0 1 51 1 0 15 65 1 0 15 66 1 0 16 67 1 0 16 68 1 0 18 69 1 0 18 70 1 0 19 71 1 0 19 72 1 0 20 73 1 0 20 74 1 0 23 78 1 0 33 86 1 0 44 93 1 0 44 94 1 0 44 95 1 0 45 96 1 0 45 97 1 0 45 98 1 0 25 80 1 0 25 81 1 0 24 79 1 6 28 85 1 0 27 82 1 0 27 83 1 0 27 84 1 0 22 75 1 0 22 76 1 0 22 77 1 0 37 87 1 0 37 88 1 0 37 89 1 0 38 90 1 0 38 91 1 0 38 92 1 0 M END