B1S9OL -OEChem-04022103393D 40 42 0 1 0 0 0 0 0999 V2000 4.4093 4.7619 -0.1286 Br 0 0 0 0 0 0 0 0 0 0 0 0 -2.2482 -1.7604 -0.3212 S 0 0 0 0 0 0 0 0 0 0 0 0 -4.6113 0.0111 -0.9052 O 0 0 0 0 0 0 0 0 0 0 0 0 1.9917 -4.1858 0.1921 O 0 0 0 0 0 0 0 0 0 0 0 0 0.0688 -2.9420 -0.0478 N 0 0 0 0 0 0 0 0 0 0 0 0 0.1263 -0.5842 -0.1823 N 0 0 0 0 0 0 0 0 0 0 0 0 4.7727 -1.8987 0.2918 N 0 0 0 0 0 0 0 0 0 0 0 0 -4.1596 0.0479 0.4529 C 0 0 2 0 0 0 0 0 0 0 0 0 -4.5191 1.3911 1.0923 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.0189 1.6513 0.9898 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.4960 1.4735 -0.4473 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.0295 0.1371 -1.0086 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.6530 -0.1712 0.4486 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.5146 -1.7059 -0.1721 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4985 -0.6631 -0.0568 C 0 0 0 0 0 0 0 0 0 0 0 0 2.1963 0.6390 -0.0740 C 0 0 0 0 0 0 0 0 0 0 0 0 2.1979 -1.8128 0.0706 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4334 -3.0981 0.0800 C 0 0 0 0 0 0 0 0 0 0 0 0 2.6281 1.1831 -1.2837 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4237 1.3242 1.1195 C 0 0 0 0 0 0 0 0 0 0 0 0 3.2876 2.4120 -1.2999 C 0 0 0 0 0 0 0 0 0 0 0 0 3.0832 2.5532 1.1034 C 0 0 0 0 0 0 0 0 0 0 0 0 3.5151 3.0971 -0.1062 C 0 0 0 0 0 0 0 0 0 0 0 0 3.6176 -1.8604 0.1926 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.6471 -0.7637 1.0108 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.9924 2.2009 0.5711 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.2051 1.4159 2.1417 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.2509 2.6625 1.3416 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.5558 0.9514 1.6418 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.5871 1.5490 -0.4988 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.0779 2.2840 -1.0570 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.5087 -0.7023 -0.4911 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.2938 0.0658 -2.0683 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.2595 -0.1488 1.4703 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.1727 0.6248 -0.1313 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5217 -3.7681 -0.0505 H 0 0 0 0 0 0 0 0 0 0 0 0 2.4575 0.6611 -2.2222 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0923 0.9133 2.0702 H 0 0 0 0 0 0 0 0 0 0 0 0 3.6177 2.8220 -2.2509 H 0 0 0 0 0 0 0 0 0 0 0 0 3.2526 3.0742 2.0422 H 0 0 0 0 0 0 0 0 0 0 0 0 1 23 1 0 0 0 0 2 13 1 0 0 0 0 2 14 1 0 0 0 0 3 8 1 0 0 0 0 3 12 1 0 0 0 0 4 18 2 0 0 0 0 5 14 1 0 0 0 0 5 18 1 0 0 0 0 5 36 1 0 0 0 0 6 14 2 0 0 0 0 6 15 1 0 0 0 0 7 24 3 0 0 0 0 8 9 1 0 0 0 0 8 13 1 0 0 0 0 8 25 1 0 0 0 0 9 10 1 0 0 0 0 9 26 1 0 0 0 0 9 27 1 0 0 0 0 10 11 1 0 0 0 0 10 28 1 0 0 0 0 10 29 1 0 0 0 0 11 12 1 0 0 0 0 11 30 1 0 0 0 0 11 31 1 0 0 0 0 12 32 1 0 0 0 0 12 33 1 0 0 0 0 13 34 1 0 0 0 0 13 35 1 0 0 0 0 15 16 1 0 0 0 0 15 17 2 0 0 0 0 16 19 2 0 0 0 0 16 20 1 0 0 0 0 17 18 1 0 0 0 0 17 24 1 0 0 0 0 19 21 1 0 0 0 0 19 37 1 0 0 0 0 20 22 2 0 0 0 0 20 38 1 0 0 0 0 21 23 2 0 0 0 0 21 39 1 0 0 0 0 22 23 1 0 0 0 0 22 40 1 0 0 0 0 M END $$$$