RDKit 3D 28 30 0 0 0 0 0 0 0 0999 V2000 1.6126 -1.9301 -0.9657 C 0 0 0 0 0 0 0 0 0 0 0 0 3.0024 -2.0610 -0.8793 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7216 -0.9628 -0.4623 C 0 0 0 0 0 0 0 0 0 0 0 0 3.1085 0.2270 -0.1445 C 0 0 0 0 0 0 0 0 0 0 0 0 1.7406 0.3903 -0.2186 C 0 0 0 0 0 0 0 0 0 0 0 0 0.9771 -0.7138 -0.6256 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.5080 -0.6401 -0.7440 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.0606 -1.3365 -1.5873 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.1264 0.2009 0.1502 N 0 0 0 0 0 0 0 0 0 0 0 0 -2.4865 0.4891 0.2634 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.4664 0.0004 -0.5915 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.7970 0.3663 -0.3763 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.1048 1.2081 0.6821 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.0692 1.6533 1.4848 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.7700 1.3134 1.2968 N 0 0 0 0 0 0 0 0 0 0 0 0 -6.8836 1.7307 1.0145 Br 0 0 0 0 0 0 0 0 0 0 0 0 3.9991 1.1844 0.2303 O 0 0 0 0 0 0 0 0 0 0 0 0 5.2432 0.4616 0.1115 C 0 0 0 0 0 0 0 0 0 0 0 0 5.0725 -0.9034 -0.3231 O 0 0 0 0 0 0 0 0 0 0 0 0 1.0160 -2.7784 -1.2988 H 0 0 0 0 0 0 0 0 0 0 0 0 3.4969 -2.9913 -1.1357 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3010 1.3545 0.0076 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5913 0.6465 0.8820 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.2323 -0.6543 -1.4225 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.5714 -0.0108 -1.0382 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.2493 2.3147 2.3275 H 0 0 0 0 0 0 0 0 0 0 0 0 5.7416 0.4593 1.0877 H 0 0 0 0 0 0 0 0 0 0 0 0 5.8836 0.9823 -0.6098 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 6 7 1 0 7 8 2 0 7 9 1 0 9 10 1 0 10 11 2 0 11 12 1 0 12 13 2 0 13 14 1 0 14 15 2 0 13 16 1 0 4 17 1 0 17 18 1 0 18 19 1 0 6 1 1 0 19 3 1 0 15 10 1 0 1 20 1 0 2 21 1 0 5 22 1 0 9 23 1 0 11 24 1 0 12 25 1 0 14 26 1 0 18 27 1 0 18 28 1 0 M END