BHVO96 -OEChem-04022115453D 40 42 0 0 0 0 0 0 0999 V2000 0.5435 -2.9500 0.6523 Br 0 0 0 0 0 0 0 0 0 0 0 0 3.8408 2.2455 -0.0046 F 0 0 0 0 0 0 0 0 0 0 0 0 8.0282 0.0462 0.1311 F 0 0 0 0 0 0 0 0 0 0 0 0 1.8095 -0.0567 0.6049 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.3897 -2.2701 0.3506 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.3318 0.0721 0.1501 N 0 0 0 0 0 0 0 0 0 0 0 0 -4.4876 0.7936 0.9507 N 0 0 0 0 0 0 0 0 0 0 0 0 -5.6983 -0.5298 -1.2055 N 0 0 0 0 0 0 0 0 0 0 0 0 -1.5333 1.2318 0.1382 C 0 0 0 0 0 0 0 0 0 0 0 0 0.4426 -0.1285 0.4594 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.2011 1.1398 0.2866 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.7507 -1.2166 0.2986 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.7677 0.1199 0.0318 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.2559 -1.2715 0.4531 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4561 -0.1353 -0.6519 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.1335 2.5818 -0.1582 C 0 0 0 0 0 0 0 0 0 0 0 0 3.9411 -0.0854 -0.4427 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.3625 -0.5302 -1.0273 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5624 1.1228 -0.1256 C 0 0 0 0 0 0 0 0 0 0 0 0 4.7006 -1.2489 -0.5658 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.4182 0.1438 -0.2865 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.8237 0.7938 0.7725 C 0 0 0 0 0 0 0 0 0 0 0 0 5.9431 1.1671 0.0682 C 0 0 0 0 0 0 0 0 0 0 0 0 6.0813 -1.2045 -0.3723 C 0 0 0 0 0 0 0 0 0 0 0 0 6.7026 0.0036 -0.0552 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.8977 0.1659 -0.4524 C 0 0 0 0 0 0 0 0 0 0 0 0 0.4278 2.0247 0.2499 H 0 0 0 0 0 0 0 0 0 0 0 0 2.1849 -1.0562 -1.1840 H 0 0 0 0 0 0 0 0 0 0 0 0 2.1629 0.7056 -1.2954 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.7266 2.5490 -1.0783 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.3698 3.3552 -0.2970 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.7762 2.9062 0.6662 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.7973 -1.0664 -1.7811 H 0 0 0 0 0 0 0 0 0 0 0 0 4.2298 -2.1975 -0.8099 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.3953 1.3378 1.5152 H 0 0 0 0 0 0 0 0 0 0 0 0 6.4267 2.1074 0.3152 H 0 0 0 0 0 0 0 0 0 0 0 0 6.6728 -2.1103 -0.4676 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.2529 1.1948 -0.5674 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.2021 -0.3978 -1.3404 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.3855 -0.2853 0.4174 H 0 0 0 0 0 0 0 0 0 0 0 0 1 14 1 0 0 0 0 2 19 1 0 0 0 0 3 25 1 0 0 0 0 4 10 1 0 0 0 0 4 15 1 0 0 0 0 5 12 2 0 0 0 0 6 9 1 0 0 0 0 6 12 1 0 0 0 0 6 13 1 0 0 0 0 7 13 2 0 0 0 0 7 22 1 0 0 0 0 8 18 2 0 0 0 0 8 21 1 0 0 0 0 9 11 2 0 0 0 0 9 16 1 0 0 0 0 10 11 1 0 0 0 0 10 14 2 0 0 0 0 11 27 1 0 0 0 0 12 14 1 0 0 0 0 13 18 1 0 0 0 0 15 17 1 0 0 0 0 15 28 1 0 0 0 0 15 29 1 0 0 0 0 16 30 1 0 0 0 0 16 31 1 0 0 0 0 16 32 1 0 0 0 0 17 19 2 0 0 0 0 17 20 1 0 0 0 0 18 33 1 0 0 0 0 19 23 1 0 0 0 0 20 24 2 0 0 0 0 20 34 1 0 0 0 0 21 22 2 0 0 0 0 21 26 1 0 0 0 0 22 35 1 0 0 0 0 23 25 2 0 0 0 0 23 36 1 0 0 0 0 24 25 1 0 0 0 0 24 37 1 0 0 0 0 26 38 1 0 0 0 0 26 39 1 0 0 0 0 26 40 1 0 0 0 0 M END $$$$