RDKit 3D 40 41 0 0 0 0 0 0 0 0999 V2000 -2.7576 -0.2890 2.1536 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.3382 0.0880 0.8058 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.6988 -0.6988 -0.3304 N 0 0 0 0 0 4 0 0 0 0 0 0 -3.4857 -0.5438 -1.6266 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.4026 0.8476 -2.2239 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.1607 -0.5497 -0.5555 C 0 0 2 0 0 0 0 0 0 0 0 0 -0.3809 -1.6146 0.2159 C 0 0 0 0 0 0 0 0 0 0 0 0 0.9887 -1.6174 -0.1936 O 0 0 0 0 0 0 0 0 0 0 0 0 1.6185 -0.4096 -0.0070 C 0 0 0 0 0 0 0 0 0 0 0 0 3.0200 -0.4204 0.1356 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7050 0.8033 0.3678 C 0 0 0 0 0 0 0 0 0 0 0 0 2.9678 2.0071 0.3792 C 0 0 0 0 0 0 0 0 0 0 0 0 1.5837 2.0067 0.2011 C 0 0 0 0 0 0 0 0 0 0 0 0 0.9157 0.8001 0.0080 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.5462 0.7968 -0.2208 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.1910 1.8385 -0.1762 O 0 0 0 0 0 0 0 0 0 0 0 0 3.7933 3.7058 0.6093 Br 0 0 0 0 0 0 0 0 0 0 0 0 5.2047 0.8344 0.5577 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7768 -1.7268 0.0760 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.7385 0.0868 2.2757 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.7558 -1.3735 2.3012 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.3599 0.1555 2.9530 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.4014 -0.1784 0.7969 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.2596 1.1576 0.6081 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.8534 -1.6836 -0.0821 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.5239 -0.8110 -1.4014 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.0942 -1.2936 -2.3230 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.7854 1.6120 -1.5425 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.3795 1.1102 -2.5065 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.0093 0.8910 -3.1347 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9954 -0.7123 -1.6285 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4243 -1.4857 1.3027 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7797 -2.6101 -0.0084 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0327 2.9459 0.2027 H 0 0 0 0 0 0 0 0 0 0 0 0 5.6885 1.2091 -0.3499 H 0 0 0 0 0 0 0 0 0 0 0 0 5.6250 -0.1485 0.7845 H 0 0 0 0 0 0 0 0 0 0 0 0 5.4773 1.4680 1.4079 H 0 0 0 0 0 0 0 0 0 0 0 0 3.1626 -2.5562 -0.2869 H 0 0 0 0 0 0 0 0 0 0 0 0 4.6204 -1.6475 -0.6178 H 0 0 0 0 0 0 0 0 0 0 0 0 4.1414 -1.9937 1.0730 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 2 3 1 0 3 4 1 0 4 5 1 0 3 6 1 0 6 7 1 0 7 8 1 0 8 9 1 0 9 10 2 0 10 11 1 0 11 12 2 0 12 13 1 0 13 14 2 0 14 15 1 0 15 16 2 0 12 17 1 0 11 18 1 0 10 19 1 0 15 6 1 0 14 9 1 0 1 20 1 0 1 21 1 0 1 22 1 0 2 23 1 0 2 24 1 0 3 25 1 0 4 26 1 0 4 27 1 0 5 28 1 0 5 29 1 0 5 30 1 0 6 31 1 6 7 32 1 0 7 33 1 0 13 34 1 0 18 35 1 0 18 36 1 0 18 37 1 0 19 38 1 0 19 39 1 0 19 40 1 0 M CHG 1 3 1 M END