BA12BO -OEChem-04022101343D 31 33 0 0 0 0 0 0 0999 V2000 -2.1204 -1.0773 0.0004 O 0 0 0 0 0 0 0 0 0 0 0 0 0.2130 -2.3860 -0.0021 O 0 0 0 0 0 0 0 0 0 0 0 0 0.4481 2.9514 -0.0018 O 0 0 0 0 0 0 0 0 0 0 0 0 2.7917 -2.5690 0.0007 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.3928 -0.3954 0.0003 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.9502 -0.3466 0.0001 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.9016 0.9957 0.0003 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.3059 1.1112 0.0011 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.1389 -0.8641 -1.2534 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.1397 -0.8661 1.2528 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.1321 1.7493 0.0010 C 0 0 0 0 0 0 0 0 0 0 0 0 1.5869 -0.4621 -0.0002 C 0 0 0 0 0 0 0 0 0 0 0 0 1.6380 0.9305 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2915 -1.1623 -0.0006 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3968 1.7264 -0.0002 C 0 0 0 0 0 0 0 0 0 0 0 0 2.7737 -1.2056 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8774 1.5829 0.0005 C 0 0 0 0 0 0 0 0 0 0 0 0 4.0063 -0.5525 0.0005 C 0 0 0 0 0 0 0 0 0 0 0 0 4.0581 0.8396 0.0007 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.2269 1.6878 0.0015 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.2165 -1.9575 -1.2757 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.1499 -0.4458 -1.3101 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.5960 -0.5760 -2.1617 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.1507 -0.4480 1.3094 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.2172 -1.9595 1.2734 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.5974 -0.5792 2.1619 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.1033 2.8330 0.0014 H 0 0 0 0 0 0 0 0 0 0 0 0 2.9451 2.6675 0.0007 H 0 0 0 0 0 0 0 0 0 0 0 0 4.9315 -1.1228 0.0008 H 0 0 0 0 0 0 0 0 0 0 0 0 5.0184 1.3471 0.0012 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8906 -2.9249 0.0022 H 0 0 0 0 0 0 0 0 0 0 0 0 1 5 1 0 0 0 0 1 6 1 0 0 0 0 2 14 2 0 0 0 0 3 15 2 0 0 0 0 4 16 1 0 0 0 0 4 31 1 0 0 0 0 5 8 1 0 0 0 0 5 9 1 0 0 0 0 5 10 1 0 0 0 0 6 7 2 0 0 0 0 6 14 1 0 0 0 0 7 11 1 0 0 0 0 7 15 1 0 0 0 0 8 11 2 0 0 0 0 8 20 1 0 0 0 0 9 21 1 0 0 0 0 9 22 1 0 0 0 0 9 23 1 0 0 0 0 10 24 1 0 0 0 0 10 25 1 0 0 0 0 10 26 1 0 0 0 0 11 27 1 0 0 0 0 12 13 2 0 0 0 0 12 14 1 0 0 0 0 12 16 1 0 0 0 0 13 15 1 0 0 0 0 13 17 1 0 0 0 0 16 18 2 0 0 0 0 17 19 2 0 0 0 0 17 28 1 0 0 0 0 18 19 1 0 0 0 0 18 29 1 0 0 0 0 19 30 1 0 0 0 0 M END $$$$