BNL8G3 -OEChem-04022115413D 37 40 0 0 0 0 0 0 0999 V2000 5.9205 1.2406 1.3021 Br 0 0 0 0 0 0 0 0 0 0 0 0 1.7809 2.5418 0.5488 S 0 0 0 0 0 0 0 0 0 0 0 0 -0.7707 1.9598 -0.4682 O 0 0 0 0 0 0 0 0 0 0 0 0 0.8984 0.3145 -0.6128 N 0 0 0 0 0 0 0 0 0 0 0 0 -5.2059 -0.6038 1.5161 N 0 0 0 0 0 0 0 0 0 0 0 0 5.0184 -1.1734 -0.5659 N 0 0 0 0 0 0 0 0 0 0 0 0 2.9855 -1.9166 -0.2652 N 0 0 0 0 0 0 0 0 0 0 0 0 5.1173 -2.4742 -0.8795 N 0 0 0 0 0 0 0 0 0 0 0 0 -2.7392 0.0112 -1.1493 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.2896 -0.1660 -1.4782 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.2821 -0.4036 0.0787 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.6539 -0.2181 0.3501 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.3766 0.8445 -0.7937 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.5485 0.6093 -2.1109 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0178 0.9431 -0.0172 C 0 0 0 0 0 0 0 0 0 0 0 0 3.3044 0.5024 0.2022 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.4903 -1.0083 1.0644 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.4399 0.3825 -0.6294 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.9005 0.7949 -1.8503 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7483 -0.8500 -0.2022 C 0 0 0 0 0 0 0 0 0 0 0 0 4.1062 1.4901 0.8437 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.0564 -1.4067 2.2668 C 0 0 0 0 0 0 0 0 0 0 0 0 3.4020 2.6482 1.0900 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.4071 -1.1835 2.4411 C 0 0 0 0 0 0 0 0 0 0 0 0 3.8609 -2.8786 -0.6811 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.9806 -1.1949 -1.2570 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1233 -0.0496 -2.5578 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.1434 0.9381 -3.0640 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0779 -0.6311 -0.9418 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.4272 -1.1845 0.9320 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.5019 0.5395 -0.4497 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.5394 1.2613 -2.5946 H 0 0 0 0 0 0 0 0 0 0 0 0 3.7546 3.5554 1.5611 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.4593 -1.8753 3.0403 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.9044 -1.4739 3.3608 H 0 0 0 0 0 0 0 0 0 0 0 0 5.8424 -0.5867 -0.6256 H 0 0 0 0 0 0 0 0 0 0 0 0 3.5740 -3.9065 -0.8449 H 0 0 0 0 0 0 0 0 0 0 0 0 1 21 1 0 0 0 0 2 15 1 0 0 0 0 2 23 1 0 0 0 0 3 13 2 0 0 0 0 4 13 1 0 0 0 0 4 15 1 0 0 0 0 4 29 1 0 0 0 0 5 12 1 0 0 0 0 5 24 2 0 0 0 0 6 8 1 0 0 0 0 6 20 1 0 0 0 0 6 36 1 0 0 0 0 7 20 2 0 0 0 0 7 25 1 0 0 0 0 8 25 2 0 0 0 0 9 10 1 0 0 0 0 9 11 2 0 0 0 0 9 14 1 0 0 0 0 10 13 1 0 0 0 0 10 26 1 0 0 0 0 10 27 1 0 0 0 0 11 12 1 0 0 0 0 11 17 1 0 0 0 0 12 18 2 0 0 0 0 14 19 2 0 0 0 0 14 28 1 0 0 0 0 15 16 2 0 0 0 0 16 20 1 0 0 0 0 16 21 1 0 0 0 0 17 22 2 0 0 0 0 17 30 1 0 0 0 0 18 19 1 0 0 0 0 18 31 1 0 0 0 0 19 32 1 0 0 0 0 21 23 2 0 0 0 0 22 24 1 0 0 0 0 22 34 1 0 0 0 0 23 33 1 0 0 0 0 24 35 1 0 0 0 0 25 37 1 0 0 0 0 M END $$$$