BAU7L3 -OEChem-04022105083D 47 49 0 0 0 0 0 0 0999 V2000 -3.1708 0.1963 -1.5828 O 0 0 0 0 0 0 0 0 0 0 0 0 -4.0670 1.7124 0.5673 O 0 0 0 0 0 0 0 0 0 0 0 0 -5.2667 -1.9235 0.2013 O 0 0 0 0 0 0 0 0 0 0 0 0 6.3345 0.7134 0.0992 O 0 5 0 0 0 0 0 0 0 0 0 0 5.9122 -0.4503 -1.7138 O 0 0 0 0 0 0 0 0 0 0 0 0 1.2701 -1.2370 1.2012 N 0 0 0 0 0 0 0 0 0 0 0 0 5.5323 0.1969 -0.7115 N 0 3 0 0 0 0 0 0 0 0 0 0 1.4125 0.7415 -0.1011 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0085 0.9921 0.0689 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0092 -0.3759 0.4765 C 0 0 0 0 0 0 0 0 0 0 0 0 3.3924 -0.5672 0.2769 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.9230 0.4709 -0.8463 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.2874 0.7102 -0.6821 C 0 0 0 0 0 0 0 0 0 0 0 0 2.1487 1.6554 -0.8590 C 0 0 0 0 0 0 0 0 0 0 0 0 4.1332 0.3519 -0.4853 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.4582 1.7525 1.1482 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.1974 -1.2224 -1.7275 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.7371 1.4707 0.3972 C 0 0 0 0 0 0 0 0 0 0 0 0 3.5108 1.4607 -1.0516 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.5999 -1.6771 -2.0995 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.8225 1.9919 1.3124 C 0 0 0 0 0 0 0 0 0 0 0 0 3.9936 -1.6917 0.8583 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.6187 -1.3107 -1.0316 C 0 0 0 0 0 0 0 0 0 0 0 0 3.2347 -2.5809 1.6055 C 0 0 0 0 0 0 0 0 0 0 0 0 1.8886 -2.3101 1.7453 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.4435 2.4987 1.6963 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.1721 -1.5689 1.2377 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.5733 -0.1160 -1.6930 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6724 2.5251 -1.3060 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2425 2.1650 1.8706 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.5030 -1.5009 -2.5285 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.8691 -1.7214 -0.8065 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.5891 -2.7637 -2.2421 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.9011 -1.2117 -3.0449 H 0 0 0 0 0 0 0 0 0 0 0 0 4.0722 2.1793 -1.6434 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.0992 2.5905 2.1733 H 0 0 0 0 0 0 0 0 0 0 0 0 5.0542 -1.9011 0.7456 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.6079 -1.6678 -1.3414 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.6733 -0.2231 -0.9074 H 0 0 0 0 0 0 0 0 0 0 0 0 3.6829 -3.4555 2.0621 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2452 -2.9697 2.3182 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.5346 2.5893 1.6757 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.1839 2.0027 2.6377 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.0387 3.5146 1.6339 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.1866 -1.8953 0.9896 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.1545 -0.4883 1.4093 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.8580 -2.0722 2.1560 H 0 0 0 0 0 0 0 0 0 0 0 0 1 13 1 0 0 0 0 1 17 1 0 0 0 0 2 18 1 0 0 0 0 2 26 1 0 0 0 0 3 23 1 0 0 0 0 3 27 1 0 0 0 0 4 7 1 0 0 0 0 5 7 2 0 0 0 0 6 10 1 0 0 0 0 6 25 2 0 0 0 0 7 15 1 0 0 0 0 8 9 1 0 0 0 0 8 10 2 0 0 0 0 8 14 1 0 0 0 0 9 12 2 0 0 0 0 9 16 1 0 0 0 0 10 11 1 0 0 0 0 11 15 2 0 0 0 0 11 22 1 0 0 0 0 12 13 1 0 0 0 0 12 28 1 0 0 0 0 13 18 2 0 0 0 0 14 19 2 0 0 0 0 14 29 1 0 0 0 0 15 19 1 0 0 0 0 16 21 2 0 0 0 0 16 30 1 0 0 0 0 17 20 1 0 0 0 0 17 31 1 0 0 0 0 17 32 1 0 0 0 0 18 21 1 0 0 0 0 19 35 1 0 0 0 0 20 23 1 0 0 0 0 20 33 1 0 0 0 0 20 34 1 0 0 0 0 21 36 1 0 0 0 0 22 24 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 24 25 1 0 0 0 0 24 40 1 0 0 0 0 25 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 27 45 1 0 0 0 0 27 46 1 0 0 0 0 27 47 1 0 0 0 0 M CHG 2 4 -1 7 1 M END $$$$