D04AAT -OEChem-10191522002D 43 46 0 1 0 0 0 0 0999 V2000 2.0000 1.0219 0.0000 Br 0 0 0 0 0 0 0 0 0 0 0 0 3.7601 0.7432 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 8.3479 0.9342 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 7.8479 -0.9319 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 10.0799 -0.0659 0.0000 N 0 0 3 0 0 0 0 0 0 0 0 0 10.0799 0.9342 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 10.9739 1.4688 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.2139 -0.5658 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.9739 -0.6005 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.8799 0.9550 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.2139 1.4342 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.3479 -0.0659 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 11.8799 -0.0867 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.3479 -0.0659 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.8479 0.8002 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.8479 -0.9319 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.8479 0.8002 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.8479 -0.9319 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.3479 -0.0659 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.3479 -0.0659 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7601 -0.8749 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8090 -0.5658 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8090 0.4342 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.0751 1.5541 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.3675 1.9478 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.5693 1.9386 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.8154 -1.0408 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.6124 -1.0408 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.5693 -1.0703 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.3675 -1.0795 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 12.4908 0.8489 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 12.0890 1.5387 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.6124 1.9091 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.8154 1.9091 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 12.0890 -0.6704 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 12.4908 0.0194 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.1579 -1.4688 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.1579 1.3371 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.1579 -1.4688 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.5379 1.3371 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.5379 -1.4688 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.9517 -1.4645 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3074 -0.9303 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 23 1 0 0 0 0 2 20 1 0 0 0 0 2 23 1 0 0 0 0 3 11 1 0 0 0 0 3 12 1 0 0 0 0 4 12 1 0 0 0 0 4 37 1 0 0 0 0 5 6 1 0 0 0 0 5 8 1 0 0 0 0 5 9 1 0 0 0 0 6 7 1 0 0 0 0 6 11 1 0 0 0 0 6 24 1 0 0 0 0 7 10 1 0 0 0 0 7 25 1 0 0 0 0 7 26 1 0 0 0 0 8 12 1 0 0 0 0 8 27 1 0 0 0 0 8 28 1 0 0 0 0 9 13 1 0 0 0 0 9 29 1 0 0 0 0 9 30 1 0 0 0 0 10 13 1 0 0 0 0 10 31 1 0 0 0 0 10 32 1 0 0 0 0 11 33 1 0 0 0 0 11 34 1 0 0 0 0 12 14 1 0 0 0 0 13 35 1 0 0 0 0 13 36 1 0 0 0 0 14 15 2 0 0 0 0 14 16 1 0 0 0 0 15 17 1 0 0 0 0 15 38 1 0 0 0 0 16 18 2 0 0 0 0 16 39 1 0 0 0 0 17 19 2 0 0 0 0 17 40 1 0 0 0 0 18 19 1 0 0 0 0 18 41 1 0 0 0 0 19 20 1 0 0 0 0 20 21 2 0 0 0 0 21 22 1 0 0 0 0 21 42 1 0 0 0 0 22 23 2 0 0 0 0 22 43 1 0 0 0 0 M END $$$$