BG4R3Q -OEChem-04012115302D 35 36 0 0 0 0 0 0 0999 V2000 2.0000 -0.8450 0.0000 Br 0 0 0 0 0 0 0 0 0 0 0 0 5.4641 -0.8450 0.0000 Br 0 0 0 0 0 0 0 0 0 0 0 0 3.7320 -3.8450 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 5.4641 0.1550 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 2.7320 -3.8450 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 4.7320 -3.8450 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 6.3301 1.6550 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 3.7320 0.1550 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 3.7320 -4.8450 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 4.5981 1.6550 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 3.7320 -2.8450 0.0000 C 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 2.8660 -2.3450 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5981 -2.3450 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8660 -1.3450 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 4.5981 0.6550 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.4641 3.1550 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.4641 2.1550 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.3301 3.6550 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5981 3.6550 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.3301 4.6550 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5981 4.6550 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.4641 5.1550 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3291 -2.6550 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.1350 -2.6550 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.1951 0.4650 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.1951 -5.1550 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.2690 -5.1550 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.0611 1.9650 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.8671 3.3450 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.0611 3.3450 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.8671 4.9650 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.0611 4.9650 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.4641 5.7750 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 15 1 0 0 0 0 2 16 1 0 0 0 0 3 5 2 0 0 0 0 3 6 2 0 0 0 0 3 9 1 0 0 0 0 3 11 1 0 0 0 0 4 17 2 0 0 0 0 7 19 2 0 0 0 0 8 12 1 0 0 0 0 8 17 1 0 0 0 0 8 27 1 0 0 0 0 9 28 1 0 0 0 0 9 29 1 0 0 0 0 10 17 1 0 0 0 0 10 19 1 0 0 0 0 10 30 1 0 0 0 0 11 13 2 0 0 0 0 11 14 1 0 0 0 0 12 15 2 0 0 0 0 12 16 1 0 0 0 0 13 15 1 0 0 0 0 13 25 1 0 0 0 0 14 16 2 0 0 0 0 14 26 1 0 0 0 0 18 19 1 0 0 0 0 18 20 2 0 0 0 0 18 21 1 0 0 0 0 20 22 1 0 0 0 0 20 31 1 0 0 0 0 21 23 2 0 0 0 0 21 32 1 0 0 0 0 22 24 2 0 0 0 0 22 33 1 0 0 0 0 23 24 1 0 0 0 0 23 34 1 0 0 0 0 24 35 1 0 0 0 0 M END $$$$