RDKit 3D 41 44 0 0 0 0 0 0 0 0999 V2000 1.9455 2.8467 0.9549 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3472 1.4154 0.6965 C 0 0 0 0 0 0 0 0 0 0 0 0 3.5999 0.9152 1.1122 C 0 0 0 0 0 0 0 0 0 0 0 0 3.9954 -0.4097 0.8947 C 0 0 0 0 0 0 0 0 0 0 0 0 3.1137 -1.2882 0.2799 C 0 0 0 0 0 0 0 0 0 0 0 0 1.8378 -0.8497 -0.0974 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4508 0.5140 0.0752 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1408 0.9251 -0.2282 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.8101 0.0132 -0.8829 C 0 0 1 0 0 0 0 0 0 0 0 0 -0.5454 -1.3952 -0.3780 C 0 0 2 0 0 0 0 0 0 0 0 0 0.8752 -1.7620 -0.8106 C 0 0 2 0 0 0 0 0 0 0 0 0 0.8379 -3.2412 -0.5743 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.4261 -3.6888 -0.6606 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.3948 -2.5576 -0.8772 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.2246 0.4791 -0.5883 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.6499 0.7331 0.7271 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.9580 1.1460 0.9889 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.8537 1.3068 -0.0647 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.4534 1.0594 -1.3759 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.1440 0.6466 -1.6364 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.6253 1.8649 0.2857 Br 0 0 0 0 0 0 0 0 0 0 0 0 4.5482 1.7638 1.8161 N 0 0 0 0 0 4 0 0 0 0 0 0 5.6517 1.9370 1.2809 O 0 0 0 0 0 0 0 0 0 0 0 0 4.1932 2.2326 2.9060 O 0 0 0 0 0 1 0 0 0 0 0 0 1.4002 3.2668 0.1043 H 0 0 0 0 0 0 0 0 0 0 0 0 2.8084 3.5059 1.0871 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3185 2.9034 1.8499 H 0 0 0 0 0 0 0 0 0 0 0 0 4.9766 -0.7600 1.2084 H 0 0 0 0 0 0 0 0 0 0 0 0 3.4259 -2.3146 0.1061 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0397 1.8903 -0.5221 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6368 0.0690 -1.9661 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6120 -1.3965 0.7256 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0298 -1.6074 -1.8892 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7023 -3.8769 -0.4496 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7220 -4.7269 -0.5927 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.2994 -2.6796 -0.2745 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.6662 -2.4739 -1.9342 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.9537 0.6140 1.5565 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.2636 1.3391 2.0137 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.1509 1.1843 -2.2002 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.8492 0.4563 -2.6665 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 2 0 5 6 1 0 6 7 2 0 7 8 1 0 8 9 1 0 9 10 1 0 10 11 1 0 11 12 1 0 12 13 2 0 13 14 1 0 9 15 1 0 15 16 2 0 16 17 1 0 17 18 2 0 18 19 1 0 19 20 2 0 18 21 1 0 3 22 1 0 22 23 2 0 22 24 1 0 7 2 1 0 11 6 1 0 14 10 1 0 20 15 1 0 1 25 1 0 1 26 1 0 1 27 1 0 4 28 1 0 5 29 1 0 8 30 1 0 9 31 1 6 10 32 1 1 11 33 1 6 12 34 1 0 13 35 1 0 14 36 1 0 14 37 1 0 16 38 1 0 17 39 1 0 19 40 1 0 20 41 1 0 M CHG 2 22 1 24 -1 M END