L2IUB5 -OEChem-05022322342D 43 45 0 1 0 0 0 0 0999 V2000 8.7788 2.4572 0.0000 Br 0 0 0 0 0 0 0 0 0 0 0 0 4.4487 3.9572 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 5.1724 1.1026 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 3.4782 1.4627 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 5.3147 2.4572 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 7.0468 2.4572 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 4.8759 -4.4572 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 3.5827 2.4572 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 2.6691 2.8640 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0000 2.1208 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5000 1.2548 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.4487 2.9572 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.2213 0.7936 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.0134 -0.1845 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.7565 -0.8537 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.1808 2.9572 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5486 -1.8318 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.7076 -0.5447 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.2918 -2.5010 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.1808 3.9572 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.4507 -1.2138 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.2428 -2.1919 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.0468 4.4572 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.9128 2.9572 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.9128 3.9572 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.0838 -3.4791 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.1026 2.1196 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.9791 3.4009 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.1675 3.2284 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.5851 2.5816 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4984 1.7564 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.9336 1.0026 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.6916 0.6652 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.4385 0.0477 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.6848 -0.7103 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.3147 1.8372 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.9590 -2.0234 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.8365 0.0618 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.6438 4.2672 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.0404 -1.0222 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.7036 -2.6068 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.0468 5.0772 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.4497 4.2672 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 24 1 0 0 0 0 2 12 2 0 0 0 0 3 13 2 0 0 0 0 4 8 1 0 0 0 0 4 11 1 0 0 0 0 4 13 1 0 0 0 0 5 12 1 0 0 0 0 5 16 1 0 0 0 0 5 36 1 0 0 0 0 6 16 2 0 0 0 0 6 24 1 0 0 0 0 7 26 3 0 0 0 0 8 9 1 0 0 0 0 8 12 1 1 0 0 0 8 27 1 0 0 0 0 9 10 1 0 0 0 0 9 28 1 0 0 0 0 9 29 1 0 0 0 0 10 11 1 0 0 0 0 10 30 1 0 0 0 0 10 31 1 0 0 0 0 11 32 1 0 0 0 0 11 33 1 0 0 0 0 13 14 1 0 0 0 0 14 15 1 0 0 0 0 14 34 1 0 0 0 0 14 35 1 0 0 0 0 15 17 2 0 0 0 0 15 18 1 0 0 0 0 16 20 1 0 0 0 0 17 19 1 0 0 0 0 17 37 1 0 0 0 0 18 21 2 0 0 0 0 18 38 1 0 0 0 0 19 22 2 0 0 0 0 19 26 1 0 0 0 0 20 23 2 0 0 0 0 20 39 1 0 0 0 0 21 22 1 0 0 0 0 21 40 1 0 0 0 0 22 41 1 0 0 0 0 23 25 1 0 0 0 0 23 42 1 0 0 0 0 24 25 2 0 0 0 0 25 43 1 0 0 0 0 M END $$$$