RDKit 3D 40 41 0 0 0 0 0 0 0 0999 V2000 0.2463 3.4473 1.6485 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0949 2.2172 1.3832 C 0 0 0 0 0 0 0 0 0 0 0 0 0.4436 1.4406 0.3806 O 0 0 0 0 0 0 0 0 0 0 0 0 0.9595 0.2152 0.0566 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2017 -0.2615 0.4976 C 0 0 0 0 0 0 0 0 0 0 0 0 2.6843 -1.5153 0.0807 C 0 0 0 0 0 0 0 0 0 0 0 0 1.9065 -2.2871 -0.7937 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6700 -1.8153 -1.2426 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1843 -0.5775 -0.8094 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.0010 -0.1219 -1.3304 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.0348 0.0237 -0.3507 C 0 0 1 0 0 0 0 0 0 0 0 0 -2.7553 1.3586 -0.5265 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.1612 1.1269 0.0276 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.3275 -0.3907 0.1730 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.1595 -0.9903 -0.5971 C 0 0 1 0 0 0 0 0 0 0 0 0 -3.5048 -1.0640 -1.9796 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.3032 -2.9006 -2.4571 Br 0 0 0 0 0 0 0 0 0 0 0 0 4.0434 -1.9926 0.5031 C 0 0 0 0 0 0 0 0 0 0 0 0 5.0677 -1.6371 -0.5030 N 0 0 0 0 0 4 0 0 0 0 0 0 0.7100 4.0850 2.4062 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1114 4.0285 0.7303 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7525 3.1589 1.9928 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1915 1.6413 2.3109 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0836 2.5315 1.0307 H 0 0 0 0 0 0 0 0 0 0 0 0 2.8109 0.3448 1.1631 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2547 -3.2608 -1.1361 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.6786 -0.0744 0.6847 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.8016 1.6434 -1.5849 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.2411 2.1721 -0.0059 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.9117 1.5431 -0.6532 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.2906 1.6184 0.9979 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.2578 -0.6604 1.2333 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.3007 -0.7188 -0.2052 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.8991 -1.9975 -0.2595 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.6643 -1.0732 -2.4751 H 0 0 0 0 0 0 0 0 0 0 0 0 4.0671 -3.0813 0.6182 H 0 0 0 0 0 0 0 0 0 0 0 0 4.3537 -1.5407 1.4509 H 0 0 0 0 0 0 0 0 0 0 0 0 6.0029 -1.9534 -0.2202 H 0 0 0 0 0 0 0 0 0 0 0 0 5.1051 -0.6203 -0.6475 H 0 0 0 0 0 0 0 0 0 0 0 0 4.8524 -2.0621 -1.4138 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 2 0 5 6 1 0 6 7 2 0 7 8 1 0 8 9 2 0 9 10 1 0 10 11 1 0 11 12 1 0 12 13 1 0 13 14 1 0 14 15 1 0 15 16 1 0 8 17 1 0 6 18 1 0 18 19 1 0 9 4 1 0 15 11 1 0 1 20 1 0 1 21 1 0 1 22 1 0 2 23 1 0 2 24 1 0 5 25 1 0 7 26 1 0 11 27 1 1 12 28 1 0 12 29 1 0 13 30 1 0 13 31 1 0 14 32 1 0 14 33 1 0 15 34 1 1 16 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 19 1 M END