RDKit 3D 36 38 0 0 0 0 0 0 0 0999 V2000 3.7443 1.8615 0.6418 C 0 0 0 0 0 0 0 0 0 0 0 0 4.6735 2.5497 -0.1270 C 0 0 0 0 0 0 0 0 0 0 0 0 4.8125 2.2424 -1.4782 C 0 0 0 0 0 0 0 0 0 0 0 0 4.0171 1.2485 -2.0727 C 0 0 0 0 0 0 0 0 0 0 0 0 3.0639 0.5446 -1.3134 C 0 0 0 0 0 0 0 0 0 0 0 0 2.9495 0.8741 0.0548 C 0 0 0 0 0 0 0 0 0 0 0 0 2.1886 -0.4888 -1.8679 C 0 0 0 0 0 0 0 0 0 0 0 0 1.8922 -0.8189 -3.1079 N 0 0 0 0 0 0 0 0 0 0 0 0 0.9807 -1.8550 -3.0410 N 0 0 0 0 0 0 0 0 0 0 0 0 0.7842 -2.0977 -1.7631 C 0 0 0 0 0 0 0 0 0 0 0 0 1.5300 -1.2818 -0.9608 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.3091 -3.3099 -1.1673 S 0 0 0 0 0 0 0 0 0 0 0 0 -0.1191 -3.1054 0.6240 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.6168 -1.7498 1.1065 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1302 -0.9974 1.7290 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.9466 -1.5182 0.8189 N 0 0 0 0 0 0 0 0 0 0 0 0 -2.7315 -0.3990 1.1560 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.2784 0.6891 1.9000 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.1420 1.7504 2.1865 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.4603 1.7319 1.7314 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.9248 0.6501 0.9855 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.0597 -0.4038 0.7039 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.4916 -1.4829 -0.0280 O 0 0 0 0 0 0 0 0 0 0 0 0 4.3581 0.9191 -3.9159 Br 0 0 0 0 0 0 0 0 0 0 0 0 3.6321 2.0885 1.6996 H 0 0 0 0 0 0 0 0 0 0 0 0 5.2908 3.3228 0.3235 H 0 0 0 0 0 0 0 0 0 0 0 0 5.5488 2.7851 -2.0685 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2270 0.3607 0.6934 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6934 -3.8849 1.1368 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9317 -3.2324 0.9029 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.4453 -2.2054 0.2577 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2621 0.7418 2.2741 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.7800 2.5915 2.7707 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.1247 2.5600 1.9625 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.9526 0.6451 0.6387 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.4171 -1.3256 -0.2826 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 5 7 1 0 7 8 2 0 8 9 1 0 9 10 2 0 10 11 1 0 10 12 1 0 12 13 1 0 13 14 1 0 14 15 2 0 14 16 1 0 16 17 1 0 17 18 2 0 18 19 1 0 19 20 2 0 20 21 1 0 21 22 2 0 22 23 1 0 4 24 1 0 6 1 1 0 11 7 1 0 22 17 1 0 1 25 1 0 2 26 1 0 3 27 1 0 6 28 1 0 13 29 1 0 13 30 1 0 16 31 1 0 18 32 1 0 19 33 1 0 20 34 1 0 21 35 1 0 23 36 1 0 M END