RDKit 3D 48 52 0 0 0 0 0 0 0 0999 V2000 -3.1034 4.2566 2.7588 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.9824 3.2575 2.3526 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.5010 2.1383 1.6652 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.1324 1.9876 1.3662 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.2687 3.0169 1.7905 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.7459 4.1377 2.4782 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.6257 0.8041 0.6409 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.5077 -0.1529 0.3068 N 0 0 0 0 0 0 0 0 0 0 0 0 -2.0381 -1.2184 -0.3699 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.6960 -1.3410 -0.6773 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1587 -0.3278 -0.2789 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.3110 0.7526 0.3623 N 0 0 0 0 0 0 0 0 0 0 0 0 1.5289 -0.4197 -0.5950 N 0 0 0 0 0 0 0 0 0 0 0 0 2.2102 -1.5481 0.0590 C 0 0 0 0 0 0 0 0 0 0 0 0 3.5523 -1.7960 -0.6371 C 0 0 0 0 0 0 0 0 0 0 0 0 4.3565 -0.5309 -0.8013 C 0 0 0 0 0 0 0 0 0 0 0 0 5.7287 -0.6063 -1.0789 C 0 0 0 0 0 0 0 0 0 0 0 0 6.4751 0.5562 -1.2677 C 0 0 0 0 0 0 0 0 0 0 0 0 5.8571 1.8014 -1.1887 C 0 0 0 0 0 0 0 0 0 0 0 0 4.4898 1.8864 -0.9249 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7230 0.7246 -0.7406 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2454 0.8563 -0.4150 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.0478 -2.2260 -0.7392 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.1934 -2.4376 0.0469 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.1341 -3.3971 -0.3186 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.9162 -4.1326 -1.4700 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.8364 -3.9666 -2.2661 N 0 0 0 0 0 0 0 0 0 0 0 0 -2.9422 -3.0186 -1.8855 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.6689 -3.6875 0.7365 Br 0 0 0 0 0 0 0 0 0 0 0 0 -3.4760 5.1269 3.2924 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.0443 3.3451 2.5675 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.2125 1.3733 1.3576 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2015 2.9500 1.5847 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0543 4.9152 2.7924 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3108 -2.1926 -1.2221 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3688 -1.3235 1.1226 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6286 -2.4759 0.0076 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3736 -2.2149 -1.6354 H 0 0 0 0 0 0 0 0 0 0 0 0 4.1219 -2.5328 -0.0589 H 0 0 0 0 0 0 0 0 0 0 0 0 6.2220 -1.5728 -1.1513 H 0 0 0 0 0 0 0 0 0 0 0 0 7.5390 0.4902 -1.4797 H 0 0 0 0 0 0 0 0 0 0 0 0 6.4395 2.7074 -1.3349 H 0 0 0 0 0 0 0 0 0 0 0 0 4.0211 2.8664 -0.8653 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8110 1.6130 -1.0812 H 0 0 0 0 0 0 0 0 0 0 0 0 2.1719 1.2065 0.6238 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.3450 -1.8482 0.9493 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.6167 -4.8939 -1.8008 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.1105 -2.9084 -2.5777 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 2 0 2 3 1 0 3 4 2 0 4 5 1 0 5 6 2 0 4 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 14 15 1 0 15 16 1 0 16 17 2 0 17 18 1 0 18 19 2 0 19 20 1 0 20 21 2 0 21 22 1 0 9 23 1 0 23 24 2 0 24 25 1 0 25 26 2 0 26 27 1 0 27 28 2 0 25 29 1 0 6 1 1 0 12 7 1 0 22 13 1 0 21 16 1 0 28 23 1 0 1 30 1 0 2 31 1 0 3 32 1 0 5 33 1 0 6 34 1 0 10 35 1 0 14 36 1 0 14 37 1 0 15 38 1 0 15 39 1 0 17 40 1 0 18 41 1 0 19 42 1 0 20 43 1 0 22 44 1 0 22 45 1 0 24 46 1 0 26 47 1 0 28 48 1 0 M END