BM95QP -OEChem-04042107163D 39 41 0 0 0 0 0 0 0999 V2000 -1.9595 -0.5196 -2.4651 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.1478 1.3191 0.9225 O 0 0 0 0 0 0 0 0 0 0 0 0 5.9675 0.8257 -0.2764 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.7164 -2.5567 0.3542 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.6267 -3.2393 0.7451 N 0 0 0 0 0 0 0 0 0 0 0 0 -1.5162 -1.2125 0.2577 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.5628 -0.3028 -0.1481 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.2075 -0.9980 0.6089 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.3894 0.2596 0.8247 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.7527 0.0150 -1.4930 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.4056 1.1398 0.4527 C 0 0 0 0 0 0 0 0 0 0 0 0 0.4699 0.2631 0.6600 C 0 0 0 0 0 0 0 0 0 0 0 0 1.9469 0.4145 0.4079 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2918 -2.2817 0.8993 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.7691 0.8952 -1.8649 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.5954 1.4575 -0.8920 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.2896 1.7410 1.4924 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5500 -0.4691 -0.4473 C 0 0 0 0 0 0 0 0 0 0 0 0 2.6105 1.4281 1.0473 C 0 0 0 0 0 0 0 0 0 0 0 0 3.9182 -0.3291 -0.6804 C 0 0 0 0 0 0 0 0 0 0 0 0 3.9786 1.5683 0.8142 C 0 0 0 0 0 0 0 0 0 0 0 0 4.6325 0.6897 -0.0498 C 0 0 0 0 0 0 0 0 0 0 0 0 6.5729 -0.1078 -1.1698 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.2467 0.0138 1.8753 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.5652 -3.0773 0.1698 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2805 -2.5699 1.2276 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.9291 1.1519 -2.9087 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.3848 2.1404 -1.1949 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0128 -1.2475 -0.9778 H 0 0 0 0 0 0 0 0 0 0 0 0 2.1164 2.1141 1.7277 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.7412 1.9090 2.4256 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.6779 2.7132 1.1699 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.1356 1.0769 1.6959 H 0 0 0 0 0 0 0 0 0 0 0 0 4.3616 -1.0407 -1.3686 H 0 0 0 0 0 0 0 0 0 0 0 0 4.5302 2.3626 1.3098 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.2439 -0.1805 -3.3311 H 0 0 0 0 0 0 0 0 0 0 0 0 7.6361 0.1467 -1.2314 H 0 0 0 0 0 0 0 0 0 0 0 0 6.1639 -0.0191 -2.1820 H 0 0 0 0 0 0 0 0 0 0 0 0 6.5109 -1.1315 -0.7852 H 0 0 0 0 0 0 0 0 0 0 0 0 1 10 1 0 0 0 0 1 36 1 0 0 0 0 2 12 2 0 0 0 0 3 22 1 0 0 0 0 3 23 1 0 0 0 0 4 5 1 0 0 0 0 4 6 1 0 0 0 0 4 25 1 0 0 0 0 5 14 2 0 0 0 0 6 7 1 0 0 0 0 6 8 2 0 0 0 0 7 9 1 0 0 0 0 7 10 2 0 0 0 0 8 12 1 0 0 0 0 8 14 1 0 0 0 0 9 11 2 0 0 0 0 9 24 1 0 0 0 0 10 15 1 0 0 0 0 11 16 1 0 0 0 0 11 17 1 0 0 0 0 12 13 1 0 0 0 0 13 18 2 0 0 0 0 13 19 1 0 0 0 0 14 26 1 0 0 0 0 15 16 2 0 0 0 0 15 27 1 0 0 0 0 16 28 1 0 0 0 0 17 31 1 0 0 0 0 17 32 1 0 0 0 0 17 33 1 0 0 0 0 18 20 1 0 0 0 0 18 29 1 0 0 0 0 19 21 2 0 0 0 0 19 30 1 0 0 0 0 20 22 2 0 0 0 0 20 34 1 0 0 0 0 21 22 1 0 0 0 0 21 35 1 0 0 0 0 23 37 1 0 0 0 0 23 38 1 0 0 0 0 23 39 1 0 0 0 0 M END $$$$