RDKit 3D 42 43 0 0 0 0 0 0 0 0999 V2000 1.5721 1.1695 0.2220 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7166 0.3925 -0.4713 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1820 -0.3690 -1.7203 C 0 0 1 0 0 0 0 0 0 0 0 0 2.5863 -0.0394 -2.2491 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0962 -1.8746 -1.4367 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.2959 -2.3024 -0.9765 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.8166 -1.4956 0.2371 C 0 0 1 0 0 0 0 0 0 0 0 0 -2.2097 -2.0428 0.6002 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0224 -1.7926 1.3691 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.7570 0.0772 -0.0235 C 0 0 1 0 0 0 0 0 0 0 0 0 -1.1971 0.8527 1.2671 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.3885 2.3705 1.0875 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.3275 2.7425 -0.0775 C 0 0 1 0 0 0 0 0 0 0 0 0 -3.7859 2.4502 0.3197 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.1944 4.5350 -0.3126 Cl 0 0 0 0 0 0 0 0 0 0 0 0 -1.8459 2.0088 -1.3468 C 0 0 2 0 0 0 0 0 0 0 0 0 -3.0053 2.3402 -2.9054 Br 0 0 0 0 0 0 0 0 0 0 0 0 -1.7593 0.4905 -1.1480 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3217 1.6432 1.1628 H 0 0 0 0 0 0 0 0 0 0 0 0 2.5989 1.3327 -0.0881 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5048 -0.1231 -2.5454 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3684 -0.3170 -1.5339 H 0 0 0 0 0 0 0 0 0 0 0 0 2.7824 -0.5883 -3.1772 H 0 0 0 0 0 0 0 0 0 0 0 0 2.6820 1.0279 -2.4765 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3558 -2.4398 -2.3406 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8333 -2.1557 -0.6727 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2459 -3.3692 -0.7216 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9946 -2.2153 -1.8174 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.6009 -1.5971 1.5189 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.9388 -1.9053 -0.2024 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.1529 -3.1192 0.8065 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0965 -2.7585 1.4508 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4911 0.6761 2.0878 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.1537 0.4582 1.6250 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4175 2.8514 0.9336 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.7702 2.7850 2.0303 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.0414 2.9465 1.2639 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.9718 1.3819 0.4625 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.5000 2.8109 -0.4278 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8712 2.3954 -1.6676 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.7604 0.1158 -0.9076 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.5125 0.0077 -2.0989 H 0 0 0 0 0 0 0 0 0 0 0 0 12 13 1 0 5 6 1 0 3 2 1 0 10 2 1 6 10 7 1 0 7 6 1 0 13 16 1 0 2 1 2 3 16 18 1 0 3 4 1 0 5 3 1 0 7 9 1 1 13 14 1 0 10 11 1 0 16 17 1 0 10 18 1 0 7 8 1 0 11 12 1 0 13 15 1 6 11 33 1 0 11 34 1 0 12 35 1 0 12 36 1 0 16 40 1 6 18 41 1 0 18 42 1 0 5 25 1 0 5 26 1 0 3 21 1 6 6 27 1 0 6 28 1 0 1 19 1 0 1 20 1 0 4 22 1 0 4 23 1 0 4 24 1 0 9 32 1 0 14 37 1 0 14 38 1 0 14 39 1 0 8 29 1 0 8 30 1 0 8 31 1 0 M END