BGK57I -OEChem-04022102303D 29 30 0 0 0 0 0 0 0999 V2000 -2.6418 -2.9303 -1.3781 Br 0 0 0 0 0 0 0 0 0 0 0 0 1.0574 1.6636 -2.3582 S 0 0 0 0 0 0 0 0 0 0 0 0 3.4493 -1.6306 0.9824 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.0816 2.6588 0.6336 O 0 0 0 0 0 0 0 0 0 0 0 0 1.9309 0.4489 -0.1149 N 0 0 0 0 0 0 0 0 0 0 0 0 3.1885 0.0590 -0.7374 C 0 0 0 0 0 0 0 0 0 0 0 0 1.7855 0.1051 1.2928 C 0 0 0 0 0 0 0 0 0 0 0 0 3.4918 -1.4012 -0.4304 C 0 0 0 0 0 0 0 0 0 0 0 0 2.1473 -1.3573 1.5120 C 0 0 0 0 0 0 0 0 0 0 0 0 0.9981 1.1756 -0.7761 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1789 1.5936 0.0384 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.3873 0.7388 0.1332 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4368 -0.4784 -0.5463 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.4750 1.1531 0.9021 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.5738 -1.2815 -0.4567 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.6122 0.3502 0.9914 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.6615 -0.8672 0.3122 C 0 0 0 0 0 0 0 0 0 0 0 0 3.9611 0.6977 -0.2918 H 0 0 0 0 0 0 0 0 0 0 0 0 3.2184 0.2094 -1.8176 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7954 0.2928 1.7079 H 0 0 0 0 0 0 0 0 0 0 0 0 2.4934 0.7440 1.8351 H 0 0 0 0 0 0 0 0 0 0 0 0 2.7781 -2.0705 -0.9254 H 0 0 0 0 0 0 0 0 0 0 0 0 4.4951 -1.6602 -0.7824 H 0 0 0 0 0 0 0 0 0 0 0 0 2.1664 -1.5847 2.5824 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4178 -2.0253 1.0389 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5990 -0.8268 -1.1432 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.4574 2.0976 1.4393 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.4591 0.6727 1.5899 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.5550 -1.4809 0.3924 H 0 0 0 0 0 0 0 0 0 0 0 0 1 15 1 0 0 0 0 2 10 2 0 0 0 0 3 8 1 0 0 0 0 3 9 1 0 0 0 0 4 11 2 0 0 0 0 5 6 1 0 0 0 0 5 7 1 0 0 0 0 5 10 1 0 0 0 0 6 8 1 0 0 0 0 6 18 1 0 0 0 0 6 19 1 0 0 0 0 7 9 1 0 0 0 0 7 20 1 0 0 0 0 7 21 1 0 0 0 0 8 22 1 0 0 0 0 8 23 1 0 0 0 0 9 24 1 0 0 0 0 9 25 1 0 0 0 0 10 11 1 0 0 0 0 11 12 1 0 0 0 0 12 13 2 0 0 0 0 12 14 1 0 0 0 0 13 15 1 0 0 0 0 13 26 1 0 0 0 0 14 16 2 0 0 0 0 14 27 1 0 0 0 0 15 17 2 0 0 0 0 16 17 1 0 0 0 0 16 28 1 0 0 0 0 17 29 1 0 0 0 0 M END $$$$