D08RDI -OEChem-04152110492D 44 46 0 0 0 0 0 0 0999 V2000 3.0000 4.0000 0.0000 Br 0 0 0 0 0 0 0 0 0 0 0 0 3.0000 -0.0000 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 3.0000 -3.0000 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 8.1279 -2.0000 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 2.0000 -0.0000 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 4.0000 0.0000 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 6.5443 -1.1953 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 6.5443 -2.8047 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 3.0000 -1.0000 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 5.5981 -1.5000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.5981 -2.5000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.8660 -1.5000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.7320 -1.0000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.1279 -2.0000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.7320 -3.0000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.8660 -2.5000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.8550 -0.2447 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.8550 -3.7552 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.0000 1.0000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.8660 1.5000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.1340 1.5000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.8660 2.5000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.7320 1.0000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.1340 2.5000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.0000 3.0000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.0000 -4.0000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.7320 -0.3800 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.7320 -3.6200 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.4631 -1.3100 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.4443 -0.4374 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.0476 0.3446 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.2656 -0.0521 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.2656 -3.9479 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.0476 -4.3446 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.4443 -3.5626 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.5970 1.1900 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.4030 2.8100 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.4220 0.4631 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.2690 0.6900 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.0420 1.5369 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.5970 2.8100 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3800 -4.0000 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.0000 -4.6200 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.6200 -4.0000 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 25 1 0 0 0 0 2 5 2 0 0 0 0 2 6 2 0 0 0 0 2 9 1 0 0 0 0 2 19 1 0 0 0 0 3 16 1 0 0 0 0 3 26 1 0 0 0 0 4 14 2 0 0 0 0 7 10 1 0 0 0 0 7 14 1 0 0 0 0 7 17 1 0 0 0 0 8 11 1 0 0 0 0 8 14 1 0 0 0 0 8 18 1 0 0 0 0 9 12 1 0 0 0 0 9 29 1 0 0 0 0 10 11 2 0 0 0 0 10 13 1 0 0 0 0 11 15 1 0 0 0 0 12 13 2 0 0 0 0 12 16 1 0 0 0 0 13 27 1 0 0 0 0 15 16 2 0 0 0 0 15 28 1 0 0 0 0 17 30 1 0 0 0 0 17 31 1 0 0 0 0 17 32 1 0 0 0 0 18 33 1 0 0 0 0 18 34 1 0 0 0 0 18 35 1 0 0 0 0 19 20 2 0 0 0 0 19 21 1 0 0 0 0 20 22 1 0 0 0 0 20 23 1 0 0 0 0 21 24 2 0 0 0 0 21 36 1 0 0 0 0 22 25 2 0 0 0 0 22 37 1 0 0 0 0 23 38 1 0 0 0 0 23 39 1 0 0 0 0 23 40 1 0 0 0 0 24 25 1 0 0 0 0 24 41 1 0 0 0 0 26 42 1 0 0 0 0 26 43 1 0 0 0 0 26 44 1 0 0 0 0 M END $$$$