BEM98Q -OEChem-04042105323D 33 34 0 1 0 0 0 0 0999 V2000 2.6740 1.6483 -0.1085 O 0 0 0 0 0 0 0 0 0 0 0 0 -4.7076 -0.6489 -0.2606 O 0 0 0 0 0 0 0 0 0 0 0 0 4.6865 0.6761 1.0999 O 0 0 0 0 0 0 0 0 0 0 0 0 1.2633 1.7407 -0.1026 N 0 0 0 0 0 0 0 0 0 0 0 0 4.7437 -1.2663 -0.1813 N 0 0 0 0 0 0 0 0 0 0 0 0 5.8746 -1.7522 0.4422 N 0 0 0 0 0 0 0 0 0 0 0 0 1.8337 -0.5268 -0.3063 C 0 0 0 0 0 0 0 0 0 0 0 0 3.0301 0.3474 -0.5756 C 0 0 2 0 0 0 0 0 0 0 0 0 0.7956 0.5383 -0.2119 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.6503 0.2265 -0.2236 C 0 0 0 0 0 0 0 0 0 0 0 0 4.2294 -0.0476 0.2180 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.0773 -1.0976 -0.3254 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.5867 1.2563 -0.1341 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.3771 -0.3617 -0.2484 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.4407 -1.3917 -0.3378 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.9502 0.9623 -0.1465 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.5690 0.2360 0.4541 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.7719 -0.5390 0.9484 C 0 0 0 0 0 0 0 0 0 0 0 0 1.8929 -1.0682 0.6432 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6583 -1.2252 -1.1278 H 0 0 0 0 0 0 0 0 0 0 0 0 3.2763 0.4106 -1.6413 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3785 -1.9258 -0.3899 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2799 2.2962 -0.0605 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.7680 -2.4250 -0.4156 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.6459 1.7950 -0.1030 H 0 0 0 0 0 0 0 0 0 0 0 0 4.3297 -1.8199 -0.9248 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.0730 0.6680 1.3324 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.8954 1.0393 -0.2155 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.3074 -0.9958 0.1096 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.4603 -1.3551 1.6088 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.4608 0.1126 1.4933 H 0 0 0 0 0 0 0 0 0 0 0 0 6.5655 -1.9208 -0.2878 H 0 0 0 0 0 0 0 0 0 0 0 0 5.6340 -2.6682 0.8187 H 0 0 0 0 0 0 0 0 0 0 0 0 1 4 1 0 0 0 0 1 8 1 0 0 0 0 2 14 1 0 0 0 0 2 17 1 0 0 0 0 3 11 2 0 0 0 0 4 9 2 0 0 0 0 5 6 1 0 0 0 0 5 11 1 0 0 0 0 5 26 1 0 0 0 0 6 32 1 0 0 0 0 6 33 1 0 0 0 0 7 8 1 0 0 0 0 7 9 1 0 0 0 0 7 19 1 0 0 0 0 7 20 1 0 0 0 0 8 11 1 0 0 0 0 8 21 1 0 0 0 0 9 10 1 0 0 0 0 10 12 2 0 0 0 0 10 13 1 0 0 0 0 12 15 1 0 0 0 0 12 22 1 0 0 0 0 13 16 2 0 0 0 0 13 23 1 0 0 0 0 14 15 2 0 0 0 0 14 16 1 0 0 0 0 15 24 1 0 0 0 0 16 25 1 0 0 0 0 17 18 1 0 0 0 0 17 27 1 0 0 0 0 17 28 1 0 0 0 0 18 29 1 0 0 0 0 18 30 1 0 0 0 0 18 31 1 0 0 0 0 M END $$$$