RDKit 3D 30 31 0 0 0 0 0 0 0 0999 V2000 3.3511 0.3272 0.8516 C 0 0 0 0 0 0 0 0 0 0 0 0 1.8834 0.4584 0.4157 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3264 1.7252 0.9957 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1006 2.0075 0.6757 C 0 0 2 0 0 0 0 0 0 0 0 0 -1.0344 0.9199 1.1749 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.2288 -0.1251 0.1425 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.6623 -1.3743 0.5500 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.8573 -2.3869 -0.3568 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.2933 -3.6414 0.0574 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.6286 -2.1884 -1.6865 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.8904 -3.5746 -2.9687 Br 0 0 0 0 0 0 0 0 0 0 0 0 -1.1841 -0.9222 -2.1411 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.9646 -0.7541 -3.4703 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.9993 0.0646 -1.2157 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.5502 1.3901 -1.6040 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.3141 1.6587 -2.8204 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.3807 2.3614 -0.6378 O 0 0 0 0 0 0 0 0 0 0 0 0 3.9479 1.1720 0.4625 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3738 0.4185 1.9684 H 0 0 0 0 0 0 0 0 0 0 0 0 3.7573 -0.6619 0.5802 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8077 0.3941 -0.6692 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3489 -0.3943 0.8807 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4431 1.7681 2.0978 H 0 0 0 0 0 0 0 0 0 0 0 0 1.9442 2.5765 0.6062 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3703 2.8992 1.3340 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7009 0.5012 2.1416 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.0422 1.3761 1.3691 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.8611 -1.5859 1.6117 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.4500 -4.4073 -0.5565 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6704 -0.0018 -3.9771 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 5 6 1 0 6 7 2 0 7 8 1 0 8 9 1 0 8 10 2 0 10 11 1 0 10 12 1 0 12 13 1 0 12 14 2 0 14 15 1 0 15 16 2 0 15 17 1 0 17 4 1 0 14 6 1 0 1 18 1 0 1 19 1 0 1 20 1 0 2 21 1 0 2 22 1 0 3 23 1 0 3 24 1 0 4 25 1 1 5 26 1 0 5 27 1 0 7 28 1 0 9 29 1 0 13 30 1 0 M END