RDKit 3D 48 52 0 0 0 0 0 0 0 0999 V2000 -3.6149 4.9806 0.9991 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.2670 4.9012 0.6635 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.6778 3.6557 0.4216 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.4173 2.4595 0.5079 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.7793 2.5737 0.8503 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.3723 3.8173 1.0930 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.7922 1.1453 0.2516 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.5721 0.0526 0.3279 N 0 0 0 0 0 0 0 0 0 0 0 0 -1.9952 -1.1410 0.0906 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.6514 -1.2396 -0.2165 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0909 -0.0725 -0.2661 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.4801 1.1195 -0.0401 N 0 0 0 0 0 0 0 0 0 0 0 0 1.4647 -0.1500 -0.5870 N 0 0 0 0 0 0 0 0 0 0 0 0 2.0326 1.1433 -1.0004 C 0 0 0 0 0 0 0 0 0 0 0 0 3.4120 0.9083 -1.6217 C 0 0 0 0 0 0 0 0 0 0 0 0 4.2960 0.0705 -0.7324 C 0 0 0 0 0 0 0 0 0 0 0 0 5.6847 0.0746 -0.9230 C 0 0 0 0 0 0 0 0 0 0 0 0 6.5082 -0.7197 -0.1263 C 0 0 0 0 0 0 0 0 0 0 0 0 5.9518 -1.5288 0.8608 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5695 -1.5492 1.0494 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7260 -0.7616 0.2491 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2296 -0.7881 0.5013 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.8936 -2.3068 0.1732 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.4502 -3.5956 0.5124 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.3516 -4.6579 0.5723 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.6854 -4.4170 0.2942 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.1663 -3.1981 -0.0311 N 0 0 0 0 0 0 0 0 0 0 0 0 -4.2646 -2.1826 -0.0780 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.7596 -6.3892 1.0292 Br 0 0 0 0 0 0 0 0 0 0 0 0 -4.0744 5.9472 1.1873 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.6699 5.8063 0.5887 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6210 3.6233 0.1608 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.3969 1.6806 0.9329 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.4258 3.8723 1.3552 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1869 -2.1871 -0.4558 H 0 0 0 0 0 0 0 0 0 0 0 0 2.1177 1.8230 -0.1411 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4020 1.6283 -1.7568 H 0 0 0 0 0 0 0 0 0 0 0 0 3.8836 1.8781 -1.8185 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3007 0.3853 -2.5799 H 0 0 0 0 0 0 0 0 0 0 0 0 6.1308 0.6973 -1.6951 H 0 0 0 0 0 0 0 0 0 0 0 0 7.5844 -0.7083 -0.2775 H 0 0 0 0 0 0 0 0 0 0 0 0 6.5949 -2.1458 1.4830 H 0 0 0 0 0 0 0 0 0 0 0 0 4.1519 -2.1862 1.8261 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0396 -0.2752 1.4543 H 0 0 0 0 0 0 0 0 0 0 0 0 1.9256 -1.8374 0.6024 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.4053 -3.7778 0.7484 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.4279 -5.2090 0.3264 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.6979 -1.2193 -0.3432 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 4 7 1 0 7 8 2 0 8 9 1 0 9 10 2 0 10 11 1 0 11 12 2 0 11 13 1 0 13 14 1 0 14 15 1 0 15 16 1 0 16 17 2 0 17 18 1 0 18 19 2 0 19 20 1 0 20 21 2 0 21 22 1 0 9 23 1 0 23 24 2 0 24 25 1 0 25 26 2 0 26 27 1 0 27 28 2 0 25 29 1 0 6 1 1 0 12 7 1 0 22 13 1 0 21 16 1 0 28 23 1 0 1 30 1 0 2 31 1 0 3 32 1 0 5 33 1 0 6 34 1 0 10 35 1 0 14 36 1 0 14 37 1 0 15 38 1 0 15 39 1 0 17 40 1 0 18 41 1 0 19 42 1 0 20 43 1 0 22 44 1 0 22 45 1 0 24 46 1 0 26 47 1 0 28 48 1 0 M END