DR1712 -OEChem-05042004202D 45 46 0 0 0 0 0 0 0999 V2000 3.1048 0.0000 0.0000 Br 0 0 0 0 0 0 0 0 0 0 0 0 4.0010 5.1200 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 5.7331 6.1200 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 5.7331 8.1200 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 4.8671 6.6200 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.5991 6.6200 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.8671 7.6200 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.5991 7.6200 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.7331 5.1200 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.8671 4.6200 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.5991 4.6200 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.8671 3.6200 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.5991 3.6200 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.7331 3.1200 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.1350 4.6200 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2690 5.1200 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.1350 3.6200 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4030 4.6200 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4030 3.6200 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2690 3.1200 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2690 6.1200 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.5369 3.1200 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.2565 6.7277 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.6550 6.0374 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.8112 6.0374 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.2097 6.7277 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.6550 8.2026 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.2565 7.5123 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.2097 7.5123 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.8112 8.2026 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.7331 8.7400 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.1360 4.9300 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.3301 3.3100 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.1360 3.3100 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.7331 2.5000 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.6720 3.3100 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8660 4.9300 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2690 2.5000 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.8890 6.1200 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2690 6.7400 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6490 6.1200 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2269 3.6569 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0000 2.8100 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8469 2.5831 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.1048 0.0000 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 45 1 0 0 0 0 2 10 1 0 0 0 0 2 15 1 0 0 0 0 3 5 1 0 0 0 0 3 6 1 0 0 0 0 3 9 1 0 0 0 0 4 7 1 0 0 0 0 4 8 1 0 0 0 0 4 31 1 0 0 0 0 5 7 1 0 0 0 0 5 23 1 0 0 0 0 5 24 1 0 0 0 0 6 8 1 0 0 0 0 6 25 1 0 0 0 0 6 26 1 0 0 0 0 7 27 1 0 0 0 0 7 28 1 0 0 0 0 8 29 1 0 0 0 0 8 30 1 0 0 0 0 9 10 1 0 0 0 0 9 11 2 0 0 0 0 10 12 2 0 0 0 0 11 13 1 0 0 0 0 11 32 1 0 0 0 0 12 14 1 0 0 0 0 12 33 1 0 0 0 0 13 14 2 0 0 0 0 13 34 1 0 0 0 0 14 35 1 0 0 0 0 15 16 2 0 0 0 0 15 17 1 0 0 0 0 16 18 1 0 0 0 0 16 21 1 0 0 0 0 17 20 2 0 0 0 0 17 36 1 0 0 0 0 18 19 2 0 0 0 0 18 37 1 0 0 0 0 19 20 1 0 0 0 0 19 22 1 0 0 0 0 20 38 1 0 0 0 0 21 39 1 0 0 0 0 21 40 1 0 0 0 0 21 41 1 0 0 0 0 22 42 1 0 0 0 0 22 43 1 0 0 0 0 22 44 1 0 0 0 0 M END $$$$