RDKit 3D 41 43 0 0 0 0 0 0 0 0999 V2000 4.8389 0.7217 1.3305 C 0 0 0 0 0 0 0 0 0 0 0 0 4.6315 -0.6353 1.0936 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7051 -1.0445 0.1326 C 0 0 0 0 0 0 0 0 0 0 0 0 2.9699 -0.1013 -0.5979 C 0 0 0 0 0 0 0 0 0 0 0 0 3.1980 1.2613 -0.3584 C 0 0 0 0 0 0 0 0 0 0 0 0 4.1238 1.6702 0.6030 C 0 0 0 0 0 0 0 0 0 0 0 0 1.9675 -0.5403 -1.6387 C 0 0 0 0 0 0 0 0 0 0 0 0 0.5130 -0.7277 -1.1784 C 0 0 1 0 0 0 0 0 0 0 0 0 0.2716 -1.8502 -0.1551 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.7759 -1.3186 0.8352 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4018 -0.0684 0.1633 C 0 0 1 0 0 0 0 0 0 0 0 0 -0.1635 0.5089 -0.5692 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.4934 -0.5666 -0.8765 C 0 0 1 0 0 0 0 0 0 0 0 0 -3.8927 -0.5868 -0.2647 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.2961 0.7881 0.2653 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.1070 1.6418 0.7109 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.0135 0.8090 1.1942 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.8927 1.6978 2.3909 Br 0 0 0 0 0 0 0 0 0 0 0 0 -2.5342 0.2092 -2.0791 O 0 0 0 0 0 0 0 0 0 0 0 0 5.5595 1.0397 2.0789 H 0 0 0 0 0 0 0 0 0 0 0 0 5.1925 -1.3767 1.6562 H 0 0 0 0 0 0 0 0 0 0 0 0 3.5629 -2.1083 -0.0435 H 0 0 0 0 0 0 0 0 0 0 0 0 2.6508 2.0157 -0.9194 H 0 0 0 0 0 0 0 0 0 0 0 0 4.2869 2.7293 0.7832 H 0 0 0 0 0 0 0 0 0 0 0 0 1.9835 0.1903 -2.4590 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3195 -1.4786 -2.0885 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0469 -0.9980 -2.0851 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1718 -2.1509 0.3859 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1030 -2.7450 -0.6658 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2545 -1.0649 1.7657 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.5177 -2.0836 1.0898 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4124 1.2598 -1.3252 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5222 0.9853 0.1343 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.2677 -1.5889 -1.2007 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.6334 -0.9138 -1.0040 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.9187 -1.3125 0.5577 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.9912 0.6466 1.1023 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.8502 1.3350 -0.5074 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.7636 2.2936 -0.1015 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.4751 2.3156 1.4959 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.6641 1.1423 -1.8484 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 1 0 8 9 1 0 9 10 1 0 10 11 1 0 11 12 1 0 11 13 1 0 13 14 1 0 14 15 1 0 15 16 1 0 16 17 1 0 17 18 1 0 13 19 1 0 6 1 1 0 12 8 1 0 11 17 1 1 1 20 1 0 2 21 1 0 3 22 1 0 5 23 1 0 6 24 1 0 7 25 1 0 7 26 1 0 8 27 1 6 9 28 1 0 9 29 1 0 10 30 1 0 10 31 1 0 12 32 1 0 12 33 1 0 13 34 1 6 14 35 1 0 14 36 1 0 15 37 1 0 15 38 1 0 16 39 1 0 16 40 1 0 19 41 1 0 M END