BB2NL5 -OEChem-04022102012D 41 45 0 1 0 0 0 0 0999 V2000 6.2243 -1.4396 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 3.8622 -3.7305 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 6.4724 0.8387 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 3.8743 -0.6613 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 4.7564 -2.2028 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 4.7403 -1.1613 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.9643 -1.1681 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.8583 -2.7305 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 2.9562 -2.2097 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.8743 0.3387 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.7444 -2.3099 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.6063 -0.6613 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.0083 -0.1613 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.7403 0.8387 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.6063 0.3387 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.9643 0.8456 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.7564 1.8802 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.9562 1.8872 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.8583 2.4080 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0084 2.4151 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.8751 3.4929 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0000 3.5001 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.9396 4.0426 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.9349 -3.0338 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.7597 -0.5828 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3526 -1.2695 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.3970 -3.0374 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3462 -2.0989 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.7427 -2.7918 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.5970 -2.9122 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.3220 -2.5352 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3183 0.3757 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.4713 0.1487 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.6983 -0.6982 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.4310 0.5294 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3264 -4.0426 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.2968 2.1840 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4750 2.0989 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.4155 3.7966 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4619 3.8080 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.9420 4.6626 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 11 1 0 0 0 0 1 12 1 0 0 0 0 8 2 1 1 0 0 0 2 36 1 0 0 0 0 3 15 2 0 0 0 0 4 6 1 0 0 0 0 4 7 1 0 0 0 0 4 10 1 0 0 0 0 4 13 1 6 0 0 0 5 6 1 0 0 0 0 5 8 1 0 0 0 0 5 11 1 0 0 0 0 5 24 1 6 0 0 0 6 12 2 0 0 0 0 7 9 1 0 0 0 0 7 25 1 0 0 0 0 7 26 1 0 0 0 0 8 9 1 0 0 0 0 8 27 1 0 0 0 0 9 28 1 0 0 0 0 9 29 1 0 0 0 0 10 14 1 0 0 0 0 10 16 2 0 0 0 0 11 30 1 0 0 0 0 11 31 1 0 0 0 0 12 15 1 0 0 0 0 13 32 1 0 0 0 0 13 33 1 0 0 0 0 13 34 1 0 0 0 0 14 15 1 0 0 0 0 14 17 2 0 0 0 0 16 18 1 0 0 0 0 16 35 1 0 0 0 0 17 19 1 0 0 0 0 17 37 1 0 0 0 0 18 19 1 0 0 0 0 18 20 2 0 0 0 0 19 21 2 0 0 0 0 20 22 1 0 0 0 0 20 38 1 0 0 0 0 21 23 1 0 0 0 0 21 39 1 0 0 0 0 22 23 2 0 0 0 0 22 40 1 0 0 0 0 23 41 1 0 0 0 0 M END $$$$