B84ROU -OEChem-04022105243D 36 38 0 0 0 0 0 0 0999 V2000 7.7217 1.3037 -0.0101 Br 0 0 0 0 0 0 0 0 0 0 0 0 2.5680 -3.1168 0.5441 S 0 0 0 0 0 0 0 0 0 0 0 0 1.1885 1.7717 -0.2802 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.0655 -1.6698 -0.1206 O 0 0 0 0 0 0 0 0 0 0 0 0 -5.7152 0.3701 2.0626 O 0 0 0 0 0 0 0 0 0 0 0 0 -6.9979 0.0068 -0.3762 O 0 0 0 0 0 0 0 0 0 0 0 0 1.8585 -0.4588 0.0444 N 0 0 0 0 0 0 0 0 0 0 0 0 0.1729 -2.1406 0.1058 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.5063 0.1343 -0.1297 C 0 0 0 0 0 0 0 0 0 0 0 0 0.9126 0.5827 -0.1171 C 0 0 0 0 0 0 0 0 0 0 0 0 3.2404 -0.0434 0.0315 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4764 1.0563 -0.2211 C 0 0 0 0 0 0 0 0 0 0 0 0 1.5279 -1.8314 0.1973 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.9017 -1.2864 -0.0564 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.9204 0.7807 -0.2573 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7048 0.8638 0.9839 C 0 0 0 0 0 0 0 0 0 0 0 0 4.1117 -0.5490 -0.9332 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.6467 0.7034 0.9310 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.5643 0.5987 -1.4813 C 0 0 0 0 0 0 0 0 0 0 0 0 5.0406 1.2654 0.9714 C 0 0 0 0 0 0 0 0 0 0 0 0 5.4473 -0.1474 -0.9457 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.0168 0.4442 0.8955 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.9345 0.3396 -1.5168 C 0 0 0 0 0 0 0 0 0 0 0 0 5.9118 0.7598 0.0066 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.6607 0.2623 -0.3284 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.2408 2.1165 -0.2800 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0594 -3.1263 0.1948 H 0 0 0 0 0 0 0 0 0 0 0 0 3.0424 1.2583 1.7502 H 0 0 0 0 0 0 0 0 0 0 0 0 3.7636 -1.2341 -1.7020 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.1455 0.8456 1.8861 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.0116 0.6564 -2.4158 H 0 0 0 0 0 0 0 0 0 0 0 0 5.3871 1.9710 1.7222 H 0 0 0 0 0 0 0 0 0 0 0 0 6.1117 -0.5459 -1.7081 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.4234 0.1996 -2.4772 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.1071 0.5210 2.8065 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.2688 -0.0905 -1.3053 H 0 0 0 0 0 0 0 0 0 0 0 0 1 24 1 0 0 0 0 2 13 2 0 0 0 0 3 10 2 0 0 0 0 4 14 2 0 0 0 0 5 22 1 0 0 0 0 5 35 1 0 0 0 0 6 25 1 0 0 0 0 6 36 1 0 0 0 0 7 10 1 0 0 0 0 7 11 1 0 0 0 0 7 13 1 0 0 0 0 8 13 1 0 0 0 0 8 14 1 0 0 0 0 8 27 1 0 0 0 0 9 10 1 0 0 0 0 9 12 2 3 0 0 0 9 14 1 0 0 0 0 11 16 2 0 0 0 0 11 17 1 0 0 0 0 12 15 1 0 0 0 0 12 26 1 0 0 0 0 15 18 2 0 0 0 0 15 19 1 0 0 0 0 16 20 1 0 0 0 0 16 28 1 0 0 0 0 17 21 2 0 0 0 0 17 29 1 0 0 0 0 18 22 1 0 0 0 0 18 30 1 0 0 0 0 19 23 2 0 0 0 0 19 31 1 0 0 0 0 20 24 2 0 0 0 0 20 32 1 0 0 0 0 21 24 1 0 0 0 0 21 33 1 0 0 0 0 22 25 2 0 0 0 0 23 25 1 0 0 0 0 23 34 1 0 0 0 0 M END $$$$