BTO3J2 -OEChem-04012115023D 38 40 0 1 0 0 0 0 0999 V2000 -3.0719 -3.3620 0.1698 Br 0 0 0 0 0 0 0 0 0 0 0 0 1.6428 -0.7487 -1.3160 S 0 0 0 0 0 0 0 0 0 0 0 0 4.1282 1.4543 -0.5481 O 0 0 0 0 0 0 0 0 0 0 0 0 1.8394 -2.0531 -1.9190 O 0 0 0 0 0 0 0 0 0 0 0 0 1.9658 0.4595 -2.0509 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.6794 2.9376 -0.1870 O 0 0 0 0 0 0 0 0 0 0 0 0 -5.2006 1.8037 0.5962 O 0 0 0 0 0 0 0 0 0 0 0 0 2.4080 -0.7059 0.2011 N 0 0 1 0 0 0 0 0 0 0 0 0 -4.0092 -0.2253 0.3227 N 0 0 0 0 0 0 0 0 0 0 0 0 2.4516 0.6018 0.9315 C 0 0 1 0 0 0 0 0 0 0 0 0 2.0689 0.2578 2.3733 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0743 -1.7834 1.1722 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4663 -1.1995 2.5192 C 0 0 0 0 0 0 0 0 0 0 0 0 3.8569 1.1770 0.8161 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0504 -0.6390 -0.8219 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.6501 0.6161 -0.6938 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.7769 -1.8204 -0.5638 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.9721 0.6350 -0.3069 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.6969 -0.5249 -0.0504 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.1194 -1.7714 -0.1723 C 0 0 0 0 0 0 0 0 0 0 0 0 5.4313 1.9962 -0.7242 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.8856 1.7531 -0.0814 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.2211 1.1414 0.3334 C 0 0 0 0 0 0 0 0 0 0 0 0 1.7400 1.3225 0.5216 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9826 0.3522 2.4969 H 0 0 0 0 0 0 0 0 0 0 0 0 2.5473 0.9023 3.1166 H 0 0 0 0 0 0 0 0 0 0 0 0 2.6446 -2.6895 0.9505 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0137 -2.0243 1.2006 H 0 0 0 0 0 0 0 0 0 0 0 0 3.5482 -1.2856 2.6738 H 0 0 0 0 0 0 0 0 0 0 0 0 1.9610 -1.6945 3.3533 H 0 0 0 0 0 0 0 0 0 0 0 0 4.6024 0.4679 1.1964 H 0 0 0 0 0 0 0 0 0 0 0 0 3.9282 2.1036 1.3979 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1194 1.5393 -0.8921 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2931 -2.7887 -0.6743 H 0 0 0 0 0 0 0 0 0 0 0 0 5.5812 2.1908 -1.7895 H 0 0 0 0 0 0 0 0 0 0 0 0 6.1911 1.2837 -0.3889 H 0 0 0 0 0 0 0 0 0 0 0 0 5.5311 2.9397 -0.1790 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.7008 -0.9292 0.5522 H 0 0 0 0 0 0 0 0 0 0 0 0 1 20 1 0 0 0 0 2 4 2 0 0 0 0 2 5 2 0 0 0 0 2 8 1 0 0 0 0 2 15 1 0 0 0 0 3 14 1 0 0 0 0 3 21 1 0 0 0 0 6 22 2 0 0 0 0 7 23 2 0 0 0 0 8 10 1 0 0 0 0 8 12 1 0 0 0 0 9 19 1 0 0 0 0 9 23 1 0 0 0 0 9 38 1 0 0 0 0 10 11 1 0 0 0 0 10 14 1 0 0 0 0 10 24 1 0 0 0 0 11 13 1 0 0 0 0 11 25 1 0 0 0 0 11 26 1 0 0 0 0 12 13 1 0 0 0 0 12 27 1 0 0 0 0 12 28 1 0 0 0 0 13 29 1 0 0 0 0 13 30 1 0 0 0 0 14 31 1 0 0 0 0 14 32 1 0 0 0 0 15 16 2 0 0 0 0 15 17 1 0 0 0 0 16 18 1 0 0 0 0 16 33 1 0 0 0 0 17 20 2 0 0 0 0 17 34 1 0 0 0 0 18 19 2 0 0 0 0 18 22 1 0 0 0 0 19 20 1 0 0 0 0 21 35 1 0 0 0 0 21 36 1 0 0 0 0 21 37 1 0 0 0 0 22 23 1 0 0 0 0 M END $$$$