RDKit 3D 45 47 0 0 0 0 0 0 0 0999 V2000 -3.1541 2.5219 3.3776 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.4460 2.3265 2.0704 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.1817 1.1490 1.4777 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4966 1.0502 0.1382 C 0 0 1 0 0 0 0 0 0 0 0 0 -1.3727 2.4148 -0.5208 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.6599 3.5527 0.1466 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.0957 3.5274 1.4666 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.5623 4.8287 -0.3564 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.9488 2.4606 -1.8813 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.5821 2.5402 -2.9793 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.1758 0.3289 0.2413 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1066 0.7181 0.5741 C 0 0 0 0 0 0 0 0 0 0 0 0 1.9136 -0.4404 0.4757 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0755 -1.4697 0.1008 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.2005 -1.0079 -0.0243 O 0 0 0 0 0 0 0 0 0 0 0 0 1.2973 -2.9131 -0.1808 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1330 -3.1693 -1.5839 O 0 0 0 0 0 0 0 0 0 0 0 0 2.1353 -2.6719 -2.3764 C 0 0 0 0 0 0 0 0 0 0 0 0 3.4627 -3.0754 -2.2043 C 0 0 0 0 0 0 0 0 0 0 0 0 4.4614 -2.5705 -3.0398 C 0 0 0 0 0 0 0 0 0 0 0 0 4.1356 -1.6760 -4.0590 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8078 -1.2941 -4.2542 C 0 0 0 0 0 0 0 0 0 0 0 0 1.8068 -1.7999 -3.4215 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0146 -1.2656 -3.7433 Br 0 0 0 0 0 0 0 0 0 0 0 0 -2.5814 -0.1369 2.0741 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.3653 -0.9083 1.5468 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.9225 -0.3195 3.2451 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.1985 -1.5748 3.8659 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.9405 3.2765 3.2676 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.6352 1.6132 3.7491 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.4480 2.8726 4.1368 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.1526 0.4542 -0.5151 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.4428 5.5240 0.3761 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9213 4.9504 -1.1370 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4246 1.7162 0.8424 H 0 0 0 0 0 0 0 0 0 0 0 0 2.9787 -0.5165 0.6450 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5357 -3.5025 0.3419 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2687 -3.2573 0.1899 H 0 0 0 0 0 0 0 0 0 0 0 0 3.7302 -3.7984 -1.4399 H 0 0 0 0 0 0 0 0 0 0 0 0 5.4937 -2.8836 -2.9029 H 0 0 0 0 0 0 0 0 0 0 0 0 4.9132 -1.2851 -4.7106 H 0 0 0 0 0 0 0 0 0 0 0 0 2.5604 -0.6060 -5.0588 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.9437 -2.4022 3.1960 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.2497 -1.6278 4.1657 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.5774 -1.6533 4.7622 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 6 7 1 0 6 8 1 0 5 9 1 0 9 10 3 0 4 11 1 0 11 12 2 0 12 13 1 0 13 14 2 0 14 15 1 0 14 16 1 0 16 17 1 0 17 18 1 0 18 19 2 0 19 20 1 0 20 21 2 0 21 22 1 0 22 23 2 0 23 24 1 0 3 25 1 0 25 26 2 0 25 27 1 0 27 28 1 0 7 2 1 0 15 11 1 0 23 18 1 0 1 29 1 0 1 30 1 0 1 31 1 0 4 32 1 6 8 33 1 0 8 34 1 0 12 35 1 0 13 36 1 0 16 37 1 0 16 38 1 0 19 39 1 0 20 40 1 0 21 41 1 0 22 42 1 0 28 43 1 0 28 44 1 0 28 45 1 0 M END