BJO13M -OEChem-04012112542D 65 68 0 1 0 0 0 0 0999 V2000 4.5981 -0.4426 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 4.7404 0.9120 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 2.8660 -3.4426 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 6.3301 -0.4426 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 5.8994 2.1992 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 5.4641 -1.9426 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 6.4347 0.5519 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 7.4128 0.7598 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.9128 -0.1062 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.2437 -0.8494 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.6915 1.2210 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.4641 -0.9426 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.1563 2.8683 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.8505 2.5082 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.2052 2.5593 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.0584 3.4863 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5981 -2.4426 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5981 -3.4426 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.9973 1.5811 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.0094 3.7954 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.4621 3.2284 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.3152 4.1555 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7320 -3.9426 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.0462 1.2721 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.2174 4.7735 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5110 2.9194 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.5232 5.1336 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.4641 -3.9426 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3031 1.9412 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.4742 5.4426 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7320 -4.9426 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.4641 -4.9426 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5981 -5.4426 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0000 -3.9426 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.8558 0.3297 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.9792 1.0120 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.2212 1.3495 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.3277 -0.5670 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.4144 0.2582 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.9337 -1.3863 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.7453 -1.2138 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.6448 3.2500 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.8652 3.4157 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.9368 1.8942 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.4701 2.4865 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.0010 -2.2526 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.3860 -1.8600 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.9875 -2.5503 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.4581 1.1663 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.4702 3.3805 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.5910 3.8349 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.7256 3.9639 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.9174 0.6657 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.8070 4.9651 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0503 3.3343 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.0624 5.5485 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.0010 -3.6326 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7134 1.7497 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.6031 6.0491 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.1951 -5.2526 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.0010 -5.2526 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.5981 -6.0626 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6900 -3.4057 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4631 -4.2526 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3100 -4.4796 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 12 2 0 0 0 0 2 11 2 0 0 0 0 3 23 1 0 0 0 0 3 34 1 0 0 0 0 4 7 1 0 0 0 0 4 10 1 0 0 0 0 4 12 1 0 0 0 0 5 11 1 0 0 0 0 5 13 1 0 0 0 0 5 14 1 0 0 0 0 6 12 1 0 0 0 0 6 17 1 0 0 0 0 6 46 1 0 0 0 0 7 8 1 0 0 0 0 7 11 1 6 0 0 0 7 35 1 0 0 0 0 8 9 1 0 0 0 0 8 36 1 0 0 0 0 8 37 1 0 0 0 0 9 10 1 0 0 0 0 9 38 1 0 0 0 0 9 39 1 0 0 0 0 10 40 1 0 0 0 0 10 41 1 0 0 0 0 13 15 1 0 0 0 0 13 42 1 0 0 0 0 13 43 1 0 0 0 0 14 16 1 0 0 0 0 14 44 1 0 0 0 0 14 45 1 0 0 0 0 15 19 2 0 0 0 0 15 21 1 0 0 0 0 16 20 2 0 0 0 0 16 22 1 0 0 0 0 17 18 1 0 0 0 0 17 47 1 0 0 0 0 17 48 1 0 0 0 0 18 23 1 0 0 0 0 18 28 2 0 0 0 0 19 24 1 0 0 0 0 19 49 1 0 0 0 0 20 25 1 0 0 0 0 20 50 1 0 0 0 0 21 26 2 0 0 0 0 21 51 1 0 0 0 0 22 27 2 0 0 0 0 22 52 1 0 0 0 0 23 31 2 0 0 0 0 24 29 2 0 0 0 0 24 53 1 0 0 0 0 25 30 2 0 0 0 0 25 54 1 0 0 0 0 26 29 1 0 0 0 0 26 55 1 0 0 0 0 27 30 1 0 0 0 0 27 56 1 0 0 0 0 28 32 1 0 0 0 0 28 57 1 0 0 0 0 29 58 1 0 0 0 0 30 59 1 0 0 0 0 31 33 1 0 0 0 0 31 60 1 0 0 0 0 32 33 2 0 0 0 0 32 61 1 0 0 0 0 33 62 1 0 0 0 0 34 63 1 0 0 0 0 34 64 1 0 0 0 0 34 65 1 0 0 0 0 M END $$$$