BF1KC2 -OEChem-04012118082D 42 44 0 1 0 0 0 0 0999 V2000 5.1294 2.1693 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 2.3660 -0.2577 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 3.7281 3.1874 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 2.5526 1.5694 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 3.6750 -1.2088 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 2.0570 -1.2088 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 4.2281 4.0534 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.7500 3.3953 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.5590 4.7966 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.6454 4.3898 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.5471 1.4648 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 4.1349 2.2738 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.9538 0.5513 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 4.9483 0.4468 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.3660 -0.2577 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8660 -1.7966 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8660 -2.7966 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0000 -3.2966 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7320 -3.2966 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0000 -4.2966 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7320 -4.2966 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8660 -4.7966 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.7297 3.6890 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.6430 4.5142 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.1300 3.3953 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.6852 2.7787 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.0606 5.1610 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.2490 5.3335 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.4539 4.9795 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0390 4.2609 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.1827 0.9632 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.2060 -0.0151 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.8835 -0.1698 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.5649 0.3820 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.0131 1.0634 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3004 2.1358 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.1881 1.0678 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4631 -2.9866 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.2690 -2.9866 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4631 -4.6066 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.2690 -4.6066 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.8660 -5.4166 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 12 2 0 0 0 0 2 6 1 0 0 0 0 2 15 1 0 0 0 0 3 7 1 0 0 0 0 3 8 1 0 0 0 0 3 12 1 0 0 0 0 11 4 1 6 0 0 0 4 36 1 0 0 0 0 4 37 1 0 0 0 0 5 15 2 0 0 0 0 5 16 1 0 0 0 0 6 16 2 0 0 0 0 7 9 1 0 0 0 0 7 23 1 0 0 0 0 7 24 1 0 0 0 0 8 10 1 0 0 0 0 8 25 1 0 0 0 0 8 26 1 0 0 0 0 9 10 1 0 0 0 0 9 27 1 0 0 0 0 9 28 1 0 0 0 0 10 29 1 0 0 0 0 10 30 1 0 0 0 0 11 12 1 0 0 0 0 11 13 1 0 0 0 0 11 31 1 0 0 0 0 13 14 1 6 0 0 0 13 15 1 0 0 0 0 13 32 1 0 0 0 0 14 33 1 0 0 0 0 14 34 1 0 0 0 0 14 35 1 0 0 0 0 16 17 1 0 0 0 0 17 18 2 0 0 0 0 17 19 1 0 0 0 0 18 20 1 0 0 0 0 18 38 1 0 0 0 0 19 21 2 0 0 0 0 19 39 1 0 0 0 0 20 22 2 0 0 0 0 20 40 1 0 0 0 0 21 22 1 0 0 0 0 21 41 1 0 0 0 0 22 42 1 0 0 0 0 M END $$$$