RDKit 3D 44 47 0 0 0 0 0 0 0 0999 V2000 -0.2563 0.4974 3.0382 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.3423 0.0617 2.2874 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.1560 -0.3064 0.9536 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1345 -0.2473 0.3907 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2478 0.1893 1.1302 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0193 0.5592 2.4662 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5562 0.2560 0.5522 N 0 0 0 0 0 0 0 0 0 0 0 0 2.8457 0.0489 -0.7827 C 0 0 0 0 0 0 0 0 0 0 0 0 2.1548 -0.2009 -1.7526 O 0 0 0 0 0 0 0 0 0 0 0 0 4.2869 0.2081 -0.9435 C 0 0 0 0 0 0 0 0 0 0 0 0 5.0764 0.1023 -2.0756 C 0 0 0 0 0 0 0 0 0 0 0 0 6.4522 0.3148 -1.9270 C 0 0 0 0 0 0 0 0 0 0 0 0 6.9926 0.6266 -0.6549 C 0 0 0 0 0 0 0 0 0 0 0 0 6.1707 0.7292 0.4783 C 0 0 0 0 0 0 0 0 0 0 0 0 4.8165 0.5121 0.2893 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7162 0.5420 1.2467 C 0 0 0 0 0 0 0 0 0 0 0 0 3.9430 0.7759 2.4202 O 0 0 0 0 0 0 0 0 0 0 0 0 8.4396 0.8467 -0.5206 N 0 0 0 0 0 4 0 0 0 0 0 0 8.8739 1.1470 0.5994 O 0 0 0 0 0 0 0 0 0 0 0 0 9.1371 0.7184 -1.5362 O 0 0 0 0 0 1 0 0 0 0 0 0 -2.2811 -0.8045 0.1007 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.0116 -1.5803 -0.8119 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.5259 -0.3217 0.4293 N 0 0 0 0 0 0 0 0 0 0 0 0 -4.7866 -0.6110 -0.1368 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.9381 -1.4945 -1.2127 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.2008 -1.7574 -1.7502 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.3226 -1.1374 -1.2127 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.1933 -0.2584 -0.1414 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.9281 0.0205 0.4175 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.8426 0.9788 1.5956 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.9238 1.5000 2.0101 O 0 0 0 0 0 0 0 0 0 0 0 0 -4.6835 1.1905 2.0892 O 0 0 0 0 0 1 0 0 0 0 0 0 -9.0305 -1.4950 -1.9418 Br 0 0 0 0 0 0 0 0 0 0 0 0 -0.4048 0.7943 4.0741 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.3200 0.0099 2.7634 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2291 -0.5627 -0.6450 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8159 0.9207 3.1091 H 0 0 0 0 0 0 0 0 0 0 0 0 4.6376 -0.1360 -3.0408 H 0 0 0 0 0 0 0 0 0 0 0 0 7.0934 0.2370 -2.8046 H 0 0 0 0 0 0 0 0 0 0 0 0 6.5559 0.9663 1.4663 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.6033 0.3728 1.1890 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.0823 -1.9928 -1.6553 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.2897 -2.4454 -2.5849 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.0723 0.2254 0.2824 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 1 0 8 9 2 0 8 10 1 0 10 11 2 0 11 12 1 0 12 13 2 0 13 14 1 0 14 15 2 0 15 16 1 0 16 17 2 0 13 18 1 0 18 19 2 0 18 20 1 0 3 21 1 0 21 22 2 0 21 23 1 0 23 24 1 0 24 25 2 0 25 26 1 0 26 27 2 0 27 28 1 0 28 29 2 0 29 30 1 0 30 31 2 0 30 32 1 0 27 33 1 0 6 1 1 0 16 7 1 0 15 10 1 0 29 24 1 0 1 34 1 0 2 35 1 0 4 36 1 0 6 37 1 0 11 38 1 0 12 39 1 0 14 40 1 0 23 41 1 0 25 42 1 0 26 43 1 0 28 44 1 0 M CHG 3 18 1 20 -1 32 -1 M END