BBX01M -OEChem-04022101392D 39 42 0 0 0 0 0 0 0999 V2000 7.2098 -0.9130 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 7.8007 1.0902 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 4.6783 2.3950 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 6.4666 -1.5821 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 7.9529 -0.2438 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 6.5406 -0.1698 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 4.6783 0.7855 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 6.2619 1.5902 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.8497 0.7812 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.8497 2.3993 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.2619 1.5902 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.8789 -1.6561 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.8007 2.0902 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7320 2.0902 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7320 1.0902 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.5406 3.3503 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.5699 -2.6072 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.8571 -1.4482 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8660 2.5902 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8660 0.5902 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0000 2.0902 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0000 1.0902 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.2390 -3.3503 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.5262 -2.1914 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.2172 -3.1424 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.9342 -0.2987 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.3023 2.4547 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.1303 3.5419 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.3491 3.9400 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.9510 3.1587 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.9634 -2.7361 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.0486 -0.8586 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.8660 3.2102 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.8660 -0.0298 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4631 2.4003 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4631 0.7802 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.0474 -3.9400 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.1326 -2.0624 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.6320 -3.6032 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 4 2 0 0 0 0 1 5 2 0 0 0 0 1 6 1 0 0 0 0 1 12 1 0 0 0 0 2 9 1 0 0 0 0 2 13 1 0 0 0 0 3 11 1 0 0 0 0 3 14 1 0 0 0 0 6 9 1 0 0 0 0 6 26 1 0 0 0 0 7 11 2 0 0 0 0 7 15 1 0 0 0 0 8 9 2 0 0 0 0 8 10 1 0 0 0 0 8 11 1 0 0 0 0 10 13 2 0 0 0 0 10 16 1 0 0 0 0 12 17 2 0 0 0 0 12 18 1 0 0 0 0 13 27 1 0 0 0 0 14 15 1 0 0 0 0 14 19 2 0 0 0 0 15 20 2 0 0 0 0 16 28 1 0 0 0 0 16 29 1 0 0 0 0 16 30 1 0 0 0 0 17 23 1 0 0 0 0 17 31 1 0 0 0 0 18 24 2 0 0 0 0 18 32 1 0 0 0 0 19 21 1 0 0 0 0 19 33 1 0 0 0 0 20 22 1 0 0 0 0 20 34 1 0 0 0 0 21 22 2 0 0 0 0 21 35 1 0 0 0 0 22 36 1 0 0 0 0 23 25 2 0 0 0 0 23 37 1 0 0 0 0 24 25 1 0 0 0 0 24 38 1 0 0 0 0 25 39 1 0 0 0 0 M END $$$$