B3QGR2 -OEChem-04022105182D 35 35 0 0 0 0 0 0 0999 V2000 2.0000 -2.1550 0.0000 Br 0 0 0 0 0 0 0 0 0 0 0 0 8.9282 0.8450 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 5.4641 -0.1550 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 3.7320 -3.1550 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 6.3301 1.3450 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 4.5981 2.3450 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 3.7320 2.8450 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 3.7320 0.8450 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7320 -0.1550 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5981 1.3450 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.1962 0.8450 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.4641 0.8450 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8660 -0.6550 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5981 -0.6550 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.0622 1.3450 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8660 -1.6550 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5981 -1.6550 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7320 -2.1550 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.7942 1.3450 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.5200 1.4276 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.1215 0.7373 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.7976 0.3701 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.5947 0.3701 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.3301 1.9650 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3291 -0.3450 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.1350 -0.3450 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.4607 1.8200 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.6636 1.8200 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.1350 -1.9650 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.1042 0.8081 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.3312 1.6550 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.4842 1.8819 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.2690 -3.4650 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.7320 3.4650 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.1951 2.5350 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 16 1 0 0 0 0 2 15 1 0 0 0 0 2 19 1 0 0 0 0 3 12 2 0 0 0 0 4 18 1 0 0 0 0 4 33 1 0 0 0 0 5 11 1 0 0 0 0 5 12 1 0 0 0 0 5 24 1 0 0 0 0 6 7 1 0 0 0 0 6 10 2 0 0 0 0 7 34 1 0 0 0 0 7 35 1 0 0 0 0 8 9 1 0 0 0 0 8 10 1 0 0 0 0 8 20 1 0 0 0 0 8 21 1 0 0 0 0 9 13 2 0 0 0 0 9 14 1 0 0 0 0 10 12 1 0 0 0 0 11 15 1 0 0 0 0 11 22 1 0 0 0 0 11 23 1 0 0 0 0 13 16 1 0 0 0 0 13 25 1 0 0 0 0 14 17 2 0 0 0 0 14 26 1 0 0 0 0 15 27 1 0 0 0 0 15 28 1 0 0 0 0 16 18 2 0 0 0 0 17 18 1 0 0 0 0 17 29 1 0 0 0 0 19 30 1 0 0 0 0 19 31 1 0 0 0 0 19 32 1 0 0 0 0 M END $$$$