RDKit 3D 31 33 0 0 0 0 0 0 0 0999 V2000 0.1190 -2.0662 0.1534 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.2834 -0.6034 -0.1191 C 0 0 2 0 0 0 0 0 0 0 0 0 0.0138 -0.2450 -1.4888 N 0 0 0 0 0 0 0 0 0 0 0 0 1.2836 0.0274 -1.9029 C 0 0 0 0 0 0 0 0 0 0 0 0 1.6092 -0.0248 -3.0805 O 0 0 0 0 0 0 0 0 0 0 0 0 2.2182 0.4196 -0.8384 C 0 0 0 0 0 0 0 0 0 0 0 0 3.5494 0.7289 -1.1299 C 0 0 0 0 0 0 0 0 0 0 0 0 4.3980 1.1481 -0.1048 C 0 0 0 0 0 0 0 0 0 0 0 0 3.9123 1.2651 1.1993 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5798 0.9562 1.4830 C 0 0 0 0 0 0 0 0 0 0 0 0 1.7350 0.5201 0.4635 C 0 0 0 0 0 0 0 0 0 0 0 0 0.4443 0.2309 0.8091 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.7718 -0.3167 0.1272 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.7320 -1.3222 0.3365 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.0798 -1.0019 0.5386 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.4886 0.3286 0.5288 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.5639 1.3445 0.3165 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.2192 1.0225 0.1154 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.3093 0.7548 0.8018 Br 0 0 0 0 0 0 0 0 0 0 0 0 -0.3816 -2.7614 -0.5298 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1135 -2.3533 1.1856 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1972 -2.2205 0.0298 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6069 -0.5740 -2.2152 H 0 0 0 0 0 0 0 0 0 0 0 0 3.9193 0.6550 -2.1501 H 0 0 0 0 0 0 0 0 0 0 0 0 5.4345 1.3936 -0.3241 H 0 0 0 0 0 0 0 0 0 0 0 0 4.5721 1.6007 1.9960 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2044 1.0510 2.4985 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.4597 -2.3744 0.3488 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.8006 -1.7994 0.7017 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.8733 2.3862 0.3040 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.5065 1.8297 -0.0539 H 0 0 0 0 0 0 0 0 0 0 0 0 2 1 1 6 2 3 1 0 3 4 1 0 4 5 2 0 4 6 1 0 6 7 2 0 7 8 1 0 8 9 2 0 9 10 1 0 10 11 2 0 11 12 1 0 2 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 12 2 1 0 11 6 1 0 18 13 1 0 1 20 1 0 1 21 1 0 1 22 1 0 3 23 1 0 7 24 1 0 8 25 1 0 9 26 1 0 10 27 1 0 14 28 1 0 15 29 1 0 17 30 1 0 18 31 1 0 M END