B32TKP -OEChem-04022106133D 21 21 0 0 0 0 0 0 0999 V2000 5.1744 -0.3720 0.0148 Br 0 0 0 0 0 0 0 0 0 0 0 0 -4.5443 -0.4632 0.6195 S 0 0 0 0 0 0 0 0 0 0 0 0 -3.4498 1.7608 -0.3210 N 0 0 0 0 0 0 0 0 0 0 0 0 -1.4001 -2.5341 -0.5353 N 0 0 0 0 0 0 0 0 0 0 0 0 0.5906 0.5678 0.0945 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2399 0.1645 1.2611 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3072 0.6906 -1.0960 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.8337 0.8621 0.1195 C 0 0 0 0 0 0 0 0 0 0 0 0 2.6061 -0.1160 1.2374 C 0 0 0 0 0 0 0 0 0 0 0 0 2.6734 0.4100 -1.1197 C 0 0 0 0 0 0 0 0 0 0 0 0 3.3229 0.0067 0.0471 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.8404 -0.0266 -0.0703 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.2501 0.4589 0.0749 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.5962 -1.4094 -0.3265 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6954 0.0650 2.1971 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8152 1.0047 -2.0134 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0349 1.8998 0.3753 H 0 0 0 0 0 0 0 0 0 0 0 0 3.0971 -0.4289 2.1553 H 0 0 0 0 0 0 0 0 0 0 0 0 3.2174 0.5109 -2.0554 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.7311 2.3516 -0.7252 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.3746 2.1751 -0.2624 H 0 0 0 0 0 0 0 0 0 0 0 0 1 11 1 0 0 0 0 2 13 2 0 0 0 0 3 13 1 0 0 0 0 3 20 1 0 0 0 0 3 21 1 0 0 0 0 4 14 3 0 0 0 0 5 6 2 0 0 0 0 5 7 1 0 0 0 0 5 8 1 0 0 0 0 6 9 1 0 0 0 0 6 15 1 0 0 0 0 7 10 2 0 0 0 0 7 16 1 0 0 0 0 8 12 2 0 0 0 0 8 17 1 0 0 0 0 9 11 2 0 0 0 0 9 18 1 0 0 0 0 10 11 1 0 0 0 0 10 19 1 0 0 0 0 12 13 1 0 0 0 0 12 14 1 0 0 0 0 M END $$$$