BKXI13 -OEChem-04022100392D 37 38 0 1 0 0 0 0 0999 V2000 2.8660 -4.3783 0.0000 Br 0 0 0 0 0 0 0 0 0 0 0 0 4.6456 -0.2851 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 6.3092 0.3536 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 6.6227 3.2557 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 3.0934 1.7853 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 6.8038 1.5332 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 4.8147 1.3241 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 5.2215 2.2376 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 3.8366 1.1162 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.6337 3.0467 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7320 0.1217 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.3147 0.4581 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.2160 2.3422 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8660 -0.3783 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8660 -1.3783 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7320 -1.8783 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0000 -1.8783 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.6172 3.3602 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7320 -2.8783 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0000 -2.8783 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8660 -3.3783 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.0240 4.2738 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.0185 4.3783 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.6049 2.1728 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.1353 3.4111 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.2693 3.5483 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.1321 2.6822 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3291 -0.0683 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.2690 -1.5683 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4631 -1.5683 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.5740 2.7418 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.2188 3.2103 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.2690 -3.1883 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4631 -3.1883 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.6596 4.7754 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.3829 3.8767 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.2707 4.9447 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 21 1 0 0 0 0 2 11 1 0 0 0 0 2 12 1 0 0 0 0 3 12 2 0 0 0 0 4 13 1 0 0 0 0 4 18 1 0 0 0 0 5 9 2 0 0 0 0 6 13 2 0 0 0 0 7 8 1 0 0 0 0 7 9 1 0 0 0 0 7 12 1 0 0 0 0 8 10 1 1 0 0 0 8 13 1 0 0 0 0 8 24 1 0 0 0 0 9 11 1 0 0 0 0 10 25 1 0 0 0 0 10 26 1 0 0 0 0 10 27 1 0 0 0 0 11 14 2 0 0 0 0 14 15 1 0 0 0 0 14 28 1 0 0 0 0 15 16 2 0 0 0 0 15 17 1 0 0 0 0 16 19 1 0 0 0 0 16 29 1 0 0 0 0 17 20 2 0 0 0 0 17 30 1 0 0 0 0 18 22 1 0 0 0 0 18 31 1 0 0 0 0 18 32 1 0 0 0 0 19 21 2 0 0 0 0 19 33 1 0 0 0 0 20 21 1 0 0 0 0 20 34 1 0 0 0 0 22 23 2 0 0 0 0 22 35 1 0 0 0 0 23 36 1 0 0 0 0 23 37 1 0 0 0 0 M END $$$$