B54INS -OEChem-04012114242D 39 41 0 0 0 0 0 0 0999 V2000 2.0000 -2.8450 0.0000 Br 0 0 0 0 0 0 0 0 0 0 0 0 9.7942 3.6550 0.0000 Cl 0 0 0 0 0 0 0 0 0 0 0 0 8.0622 -1.3450 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 6.3301 1.6550 0.0000 N 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 7.1962 0.1550 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 3.7320 1.1550 0.0000 N 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 4.5981 -1.3450 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.4641 0.1550 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.3301 0.6550 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.1962 2.1550 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 3.7320 -0.8450 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 7.1962 3.1550 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.0622 1.6550 0.0000 C 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 2.8660 -1.3450 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 8.0622 3.6550 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.9282 2.1550 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.9282 3.1550 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 -2.3450 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.9282 -2.8450 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.7942 -3.3450 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.7932 1.9650 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 3.7320 -0.2250 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.6592 3.4650 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.0622 1.0350 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 2.3291 -1.0350 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.0622 4.2750 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.4651 1.8450 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.4516 -2.2373 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.8501 -2.9276 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.3312 -3.6550 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 20 1 0 0 0 0 2 23 1 0 0 0 0 3 15 1 0 0 0 0 3 25 1 0 0 0 0 4 11 1 0 0 0 0 4 12 1 0 0 0 0 4 28 1 0 0 0 0 5 8 1 0 0 0 0 5 15 2 0 0 0 0 6 11 2 0 0 0 0 6 15 1 0 0 0 0 7 24 3 0 0 0 0 8 9 1 0 0 0 0 8 10 2 0 0 0 0 9 13 2 0 0 0 0 9 14 1 0 0 0 0 10 11 1 0 0 0 0 10 24 1 0 0 0 0 12 16 2 0 0 0 0 12 17 1 0 0 0 0 13 18 1 0 0 0 0 13 29 1 0 0 0 0 14 19 2 0 0 0 0 14 30 1 0 0 0 0 16 21 1 0 0 0 0 16 31 1 0 0 0 0 17 22 2 0 0 0 0 17 32 1 0 0 0 0 18 20 2 0 0 0 0 18 33 1 0 0 0 0 19 20 1 0 0 0 0 19 34 1 0 0 0 0 21 23 2 0 0 0 0 21 35 1 0 0 0 0 22 23 1 0 0 0 0 22 36 1 0 0 0 0 25 26 1 0 0 0 0 25 37 1 0 0 0 0 25 38 1 0 0 0 0 26 27 3 0 0 0 0 27 39 1 0 0 0 0 M END $$$$