RDKit 3D 40 41 0 0 0 0 0 0 0 0999 V2000 -4.7475 1.0134 0.7866 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.3096 0.6851 1.1508 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.4902 0.4418 -0.1150 N 0 0 0 0 0 4 0 0 0 0 0 0 -2.8205 -0.9005 -0.7619 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.4141 -0.6592 -2.1378 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.9734 0.6471 0.1598 C 0 0 2 0 0 0 0 0 0 0 0 0 -0.1730 0.7354 -1.1369 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1746 1.1232 -0.8578 O 0 0 0 0 0 0 0 0 0 0 0 0 1.8280 0.2797 0.0102 C 0 0 0 0 0 0 0 0 0 0 0 0 3.2359 0.2645 -0.0326 C 0 0 0 0 0 0 0 0 0 0 0 0 3.9485 -0.6226 0.8199 C 0 0 0 0 0 0 0 0 0 0 0 0 3.2264 -1.4172 1.7368 C 0 0 0 0 0 0 0 0 0 0 0 0 1.8330 -1.3673 1.7931 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1422 -0.5186 0.9327 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.3312 -0.4331 1.0099 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.9820 -1.1817 1.7315 O 0 0 0 0 0 0 0 0 0 0 0 0 4.0840 -2.5851 2.9699 Br 0 0 0 0 0 0 0 0 0 0 0 0 5.4585 -0.6939 0.7855 C 0 0 0 0 0 0 0 0 0 0 0 0 3.9736 1.1592 -1.0015 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.3147 1.2557 1.6910 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.7992 1.8772 0.1159 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.2465 0.1704 0.2999 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.2480 -0.2015 1.7877 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.8644 1.5395 1.6705 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.7607 1.1918 -0.7635 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.5237 -1.4401 -0.1199 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.9065 -1.4951 -0.8419 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.6568 -1.6138 -2.6149 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.3339 -0.0691 -2.0781 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.7091 -0.1284 -2.7856 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8906 1.5954 0.7055 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5988 1.5036 -1.7915 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1633 -0.2056 -1.7013 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2923 -1.9809 2.5120 H 0 0 0 0 0 0 0 0 0 0 0 0 5.8855 -0.2399 -0.1122 H 0 0 0 0 0 0 0 0 0 0 0 0 5.7995 -1.7342 0.7732 H 0 0 0 0 0 0 0 0 0 0 0 0 5.8768 -0.1801 1.6568 H 0 0 0 0 0 0 0 0 0 0 0 0 4.4104 0.5594 -1.8062 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3258 1.9114 -1.4612 H 0 0 0 0 0 0 0 0 0 0 0 0 4.7626 1.7140 -0.4830 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 1 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