RDKit 3D 50 53 0 0 0 0 0 0 0 0999 V2000 -4.8303 -0.4898 2.4411 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.4028 0.5585 1.4823 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.3471 1.9287 1.6302 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.8585 2.4131 0.4070 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.6185 1.4337 -0.4675 N 0 0 0 0 0 0 0 0 0 0 0 0 -3.9519 0.3049 0.2096 N 0 0 0 0 0 0 0 0 0 0 0 0 -3.8050 -0.9861 -0.4588 C 0 0 1 0 0 0 0 0 0 0 0 0 -4.7152 -1.0998 -1.6790 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.3543 -1.2517 -0.8418 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.8146 -2.3341 -0.6071 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.7315 -0.2372 -1.5542 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.3207 -0.3114 -1.6531 N 0 0 0 0 0 0 0 0 0 0 0 0 0.2677 -0.8522 -2.7911 C 0 0 0 0 0 0 0 0 0 0 0 0 1.5526 -0.9619 -2.9607 N 0 0 0 0 0 0 0 0 0 0 0 0 2.3057 -0.5143 -1.9231 C 0 0 0 0 0 0 0 0 0 0 0 0 1.8520 0.0447 -0.7452 C 0 0 0 0 0 0 0 0 0 0 0 0 0.4169 0.1745 -0.5660 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0903 0.6806 0.4340 O 0 0 0 0 0 0 0 0 0 0 0 0 2.9213 0.4145 0.1337 C 0 0 0 0 0 0 0 0 0 0 0 0 4.1474 0.0944 -0.4193 C 0 0 0 0 0 0 0 0 0 0 0 0 4.0103 -0.6031 -1.9657 S 0 0 0 0 0 0 0 0 0 0 0 0 5.4808 0.3421 0.2192 C 0 0 0 0 0 0 0 0 0 0 0 0 5.3321 0.6172 1.7327 C 0 0 1 0 0 0 0 0 0 0 0 0 4.1455 1.5672 2.0069 C 0 0 0 0 0 0 0 0 0 0 0 0 2.7985 1.0278 1.4971 C 0 0 0 0 0 0 0 0 0 0 0 0 5.2119 -0.6852 2.5310 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.6496 -1.3312 -3.8894 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.6683 -1.0664 2.0368 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.0046 -1.1740 2.6605 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.1562 -0.0442 3.3867 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.6183 2.4999 2.5070 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.6672 3.4389 0.1183 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.0907 -1.7576 0.2644 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.6222 -2.0901 -2.1378 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.4660 -0.3599 -2.4479 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.7636 -0.9496 -1.3992 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.0895 0.7088 -1.3661 H 0 0 0 0 0 0 0 0 0 0 0 0 5.9286 1.2238 -0.2574 H 0 0 0 0 0 0 0 0 0 0 0 0 6.1627 -0.4996 0.0502 H 0 0 0 0 0 0 0 0 0 0 0 0 6.2500 1.1144 2.0730 H 0 0 0 0 0 0 0 0 0 0 0 0 4.3512 2.5258 1.5116 H 0 0 0 0 0 0 0 0 0 0 0 0 4.0691 1.7828 3.0792 H 0 0 0 0 0 0 0 0 0 0 0 0 2.4177 0.2697 2.1919 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0731 1.8490 1.4813 H 0 0 0 0 0 0 0 0 0 0 0 0 6.1080 -1.3004 2.3962 H 0 0 0 0 0 0 0 0 0 0 0 0 4.3494 -1.2844 2.2235 H 0 0 0 0 0 0 0 0 0 0 0 0 5.1126 -0.4736 3.6009 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.3305 -0.5299 -4.1899 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0672 -1.6387 -4.7630 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2305 -2.1886 -3.5383 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 2 3 2 0 3 4 1 0 4 5 2 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 12 13 1 0 13 14 2 0 14 15 1 0 15 16 2 0 16 17 1 0 17 18 2 0 16 19 1 0 19 20 2 0 20 21 1 0 20 22 1 0 22 23 1 0 23 24 1 0 24 25 1 0 23 26 1 0 13 27 1 0 6 2 1 0 17 12 1 0 21 15 1 0 25 19 1 0 1 28 1 0 1 29 1 0 1 30 1 0 3 31 1 0 4 32 1 0 7 33 1 1 8 34 1 0 8 35 1 0 8 36 1 0 11 37 1 0 22 38 1 0 22 39 1 0 23 40 1 1 24 41 1 0 24 42 1 0 25 43 1 0 25 44 1 0 26 45 1 0 26 46 1 0 26 47 1 0 27 48 1 0 27 49 1 0 27 50 1 0 M END