BDXS86 -OEChem-04042103003D 40 42 0 0 0 0 0 0 0999 V2000 5.1248 2.2996 -1.2667 O 0 0 0 0 0 0 0 0 0 0 0 0 3.9699 0.5040 -2.0468 O 0 0 0 0 0 0 0 0 0 0 0 0 -4.2724 3.0780 -0.9653 O 0 0 0 0 0 0 0 0 0 0 0 0 -6.0374 2.1542 0.1292 O 0 0 0 0 0 0 0 0 0 0 0 0 2.6989 -0.7567 0.0791 N 0 0 0 0 0 0 0 0 0 0 0 0 -1.6611 -2.5807 -0.0318 N 0 0 0 0 0 0 0 0 0 0 0 0 0.4944 -1.6551 0.0218 N 0 0 0 0 0 0 0 0 0 0 0 0 0.1706 -4.0420 0.0924 N 0 0 0 0 0 0 0 0 0 0 0 0 2.5581 0.5599 0.5469 C 0 0 0 0 0 0 0 0 0 0 0 0 3.2336 1.6222 -0.0641 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.4672 -1.4259 -0.1053 C 0 0 0 0 0 0 0 0 0 0 0 0 1.8248 -1.8713 0.0827 C 0 0 0 0 0 0 0 0 0 0 0 0 1.7272 0.8143 1.6434 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.2665 -2.7681 0.0303 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.7477 -1.4329 0.4482 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.9842 -0.2766 -0.7311 C 0 0 0 0 0 0 0 0 0 0 0 0 3.0797 2.9229 0.4158 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.0622 0.8584 -0.2503 C 0 0 0 0 0 0 0 0 0 0 0 0 1.5733 2.1151 2.1231 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3955 -3.1259 0.1499 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.5452 -0.2908 0.3755 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.7817 0.8655 -0.8036 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2495 3.1693 1.5093 C 0 0 0 0 0 0 0 0 0 0 0 0 1.5109 -4.1849 0.1512 C 0 0 0 0 0 0 0 0 0 0 0 0 4.1081 1.3981 -1.2083 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.8934 2.0494 -0.3253 C 0 0 0 0 0 0 0 0 0 0 0 0 3.5385 -0.9212 -0.4686 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1979 0.0105 2.1487 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.1774 -3.4430 0.1145 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.1352 -2.3218 0.9394 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0123 -0.2399 -1.2119 H 0 0 0 0 0 0 0 0 0 0 0 0 3.5815 3.7682 -0.0479 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9284 2.3069 2.9757 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.5398 -0.3166 0.8131 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.3702 1.7356 -1.3076 H 0 0 0 0 0 0 0 0 0 0 0 0 3.4655 -3.2852 0.1995 H 0 0 0 0 0 0 0 0 0 0 0 0 2.1273 4.1823 1.8816 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8661 -5.2087 0.2016 H 0 0 0 0 0 0 0 0 0 0 0 0 5.7082 2.1426 -2.0397 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.8408 3.8762 -1.0100 H 0 0 0 0 0 0 0 0 0 0 0 0 1 25 1 0 0 0 0 1 39 1 0 0 0 0 2 25 2 0 0 0 0 3 26 1 0 0 0 0 3 40 1 0 0 0 0 4 26 2 0 0 0 0 5 9 1 0 0 0 0 5 12 1 0 0 0 0 5 27 1 0 0 0 0 6 11 1 0 0 0 0 6 14 1 0 0 0 0 6 29 1 0 0 0 0 7 12 2 0 0 0 0 7 14 1 0 0 0 0 8 14 2 0 0 0 0 8 24 1 0 0 0 0 9 10 1 0 0 0 0 9 13 2 0 0 0 0 10 17 2 0 0 0 0 10 25 1 0 0 0 0 11 15 2 0 0 0 0 11 16 1 0 0 0 0 12 20 1 0 0 0 0 13 19 1 0 0 0 0 13 28 1 0 0 0 0 15 21 1 0 0 0 0 15 30 1 0 0 0 0 16 22 2 0 0 0 0 16 31 1 0 0 0 0 17 23 1 0 0 0 0 17 32 1 0 0 0 0 18 21 2 0 0 0 0 18 22 1 0 0 0 0 18 26 1 0 0 0 0 19 23 2 0 0 0 0 19 33 1 0 0 0 0 20 24 2 0 0 0 0 20 36 1 0 0 0 0 21 34 1 0 0 0 0 22 35 1 0 0 0 0 23 37 1 0 0 0 0 24 38 1 0 0 0 0 M END $$$$