B6S0GW -OEChem-04022112263D 29 31 0 0 0 0 0 0 0999 V2000 -6.7053 -0.8755 0.7112 Br 0 0 0 0 0 0 0 0 0 0 0 0 4.2047 -1.4093 0.0491 S 0 0 0 0 0 0 0 0 0 0 0 0 1.2319 2.4564 0.1131 O 0 0 0 0 0 0 0 0 0 0 0 0 1.5130 -2.8895 -0.6170 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.0787 1.0878 -0.4826 N 0 0 0 0 0 0 0 0 0 0 0 0 3.7520 1.1245 0.3427 N 0 0 0 0 0 0 0 0 0 0 0 0 2.5486 0.5128 0.0504 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0981 0.3994 -0.3817 C 0 0 0 0 0 0 0 0 0 0 0 0 2.6149 -0.8476 -0.1370 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3051 1.2447 -0.0522 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1953 -0.9327 -0.5600 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4861 -1.6745 -0.4477 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.3730 0.6361 -0.2081 C 0 0 0 0 0 0 0 0 0 0 0 0 4.6972 0.2079 0.3681 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.4592 1.1659 -0.9048 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.5783 -0.3446 0.7623 C 0 0 0 0 0 0 0 0 0 0 0 0 6.1231 0.4829 0.6485 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.7504 0.7155 -0.6308 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.8696 -0.7951 1.0364 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.9556 -0.2651 0.3399 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.6609 -1.5448 -0.8263 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0000 2.0640 -0.7485 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.3117 1.9300 -1.6638 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.7614 -0.7558 1.3490 H 0 0 0 0 0 0 0 0 0 0 0 0 6.4604 -0.0592 1.5377 H 0 0 0 0 0 0 0 0 0 0 0 0 6.7531 0.1935 -0.1987 H 0 0 0 0 0 0 0 0 0 0 0 0 6.2795 1.5512 0.8303 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.5858 1.1385 -1.1827 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.0134 -1.5544 1.8009 H 0 0 0 0 0 0 0 0 0 0 0 0 1 20 1 0 0 0 0 2 9 1 0 0 0 0 2 14 1 0 0 0 0 3 10 2 0 0 0 0 4 12 2 0 0 0 0 5 8 1 0 0 0 0 5 13 1 0 0 0 0 5 22 1 0 0 0 0 6 7 1 0 0 0 0 6 14 2 0 0 0 0 7 9 2 0 0 0 0 7 10 1 0 0 0 0 8 10 1 0 0 0 0 8 11 2 0 0 0 0 9 12 1 0 0 0 0 11 12 1 0 0 0 0 11 21 1 0 0 0 0 13 15 2 0 0 0 0 13 16 1 0 0 0 0 14 17 1 0 0 0 0 15 18 1 0 0 0 0 15 23 1 0 0 0 0 16 19 2 0 0 0 0 16 24 1 0 0 0 0 17 25 1 0 0 0 0 17 26 1 0 0 0 0 17 27 1 0 0 0 0 18 20 2 0 0 0 0 18 28 1 0 0 0 0 19 20 1 0 0 0 0 19 29 1 0 0 0 0 M END $$$$