RDKit 3D 54 56 0 0 0 0 0 0 0 0999 V2000 -0.6751 -1.8244 -0.1185 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2990 -0.7007 -0.1079 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0432 0.6604 -0.1000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.5254 1.5178 -0.2066 S 0 0 0 0 0 0 0 0 0 0 0 0 2.4073 0.0408 -0.1908 C 0 0 0 0 0 0 0 0 0 0 0 0 1.6429 -1.0343 -0.1320 N 0 0 0 0 0 0 0 0 0 0 0 0 3.8850 -0.0024 -0.2441 C 0 0 0 0 0 0 0 0 0 0 0 0 4.6931 1.1429 -0.2718 C 0 0 0 0 0 0 0 0 0 0 0 0 6.0895 1.0427 -0.3182 C 0 0 0 0 0 0 0 0 0 0 0 0 6.7112 -0.2074 -0.3377 C 0 0 0 0 0 0 0 0 0 0 0 0 5.9199 -1.3703 -0.3130 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5236 -1.2568 -0.2662 C 0 0 0 0 0 0 0 0 0 0 0 0 6.6011 -2.5624 -0.3334 O 0 0 0 0 0 0 0 0 0 0 0 0 5.8405 -3.7613 -0.3569 C 0 0 0 0 0 0 0 0 0 0 0 0 8.0687 -0.3998 -0.3813 O 0 0 0 0 0 0 0 0 0 0 0 0 8.9007 0.7511 -0.4033 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.1960 1.4075 -0.0466 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.3644 2.5051 -0.5720 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.2203 0.8049 0.6680 N 0 0 0 0 0 0 0 0 0 0 0 0 -3.4210 1.5476 0.9843 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.6252 0.6433 1.0213 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.8473 -0.1148 2.1878 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.9390 -0.9702 2.2833 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.7997 -1.0628 1.2052 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.5652 -0.3368 0.1097 N 0 0 0 0 0 4 0 0 0 0 0 0 -5.5311 0.5048 -0.0446 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.5333 1.1151 -1.2787 N 0 0 0 0 0 0 0 0 0 0 0 0 -6.0546 2.4896 -1.2622 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.3187 0.9539 -2.0892 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.0319 -2.0293 0.8951 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2093 -2.7370 -0.5038 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.5339 -1.5966 -0.7573 H 0 0 0 0 0 0 0 0 0 0 0 0 4.2636 2.1418 -0.2576 H 0 0 0 0 0 0 0 0 0 0 0 0 6.6623 1.9643 -0.3383 H 0 0 0 0 0 0 0 0 0 0 0 0 3.9005 -2.1464 -0.2445 H 0 0 0 0 0 0 0 0 0 0 0 0 5.2138 -3.8146 -1.2531 H 0 0 0 0 0 0 0 0 0 0 0 0 5.2411 -3.8660 0.5532 H 0 0 0 0 0 0 0 0 0 0 0 0 6.5408 -4.6014 -0.3910 H 0 0 0 0 0 0 0 0 0 0 0 0 8.7724 1.3488 0.5054 H 0 0 0 0 0 0 0 0 0 0 0 0 8.7210 1.3515 -1.3014 H 0 0 0 0 0 0 0 0 0 0 0 0 9.9406 0.4115 -0.4332 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.9453 0.0682 1.3046 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.5678 2.3840 0.2982 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.2664 2.0026 1.9706 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.1658 -0.0330 3.0361 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.1123 -1.5520 3.1859 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.6734 -1.7048 1.1905 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.1782 -0.4006 -0.6999 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.1800 2.8523 -2.2883 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.3855 3.1784 -0.7371 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.0402 2.5243 -0.7846 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.5819 1.0511 -3.1481 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.5709 1.7192 -1.8676 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.8741 -0.0393 -1.9569 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 1 0 5 6 2 0 5 7 1 0 7 8 2 0 8 9 1 0 9 10 2 0 10 11 1 0 11 12 2 0 11 13 1 0 13 14 1 0 10 15 1 0 15 16 1 0 3 17 1 0 17 18 2 0 17 19 1 0 19 20 1 0 20 21 1 0 21 22 2 0 22 23 1 0 23 24 2 0 24 25 1 0 25 26 2 0 26 27 1 0 27 28 1 0 27 29 1 0 6 2 1 0 12 7 1 0 26 21 1 0 1 30 1 0 1 31 1 0 1 32 1 0 8 33 1 0 9 34 1 0 12 35 1 0 14 36 1 0 14 37 1 0 14 38 1 0 16 39 1 0 16 40 1 0 16 41 1 0 19 42 1 0 20 43 1 0 20 44 1 0 22 45 1 0 23 46 1 0 24 47 1 0 25 48 1 0 28 49 1 0 28 50 1 0 28 51 1 0 29 52 1 0 29 53 1 0 29 54 1 0 M CHG 1 25 1 M END