BP3S8R -OEChem-04022100272D 35 37 0 0 0 0 0 0 0999 V2000 5.5361 2.0081 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 2.8660 -1.0442 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 2.0570 -0.4565 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 4.6261 -0.7655 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 4.9483 1.1991 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 3.3660 0.4946 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.6750 -0.4565 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8660 -2.0442 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.9538 1.3036 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3660 0.4946 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.5471 2.2172 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0000 -2.5442 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7320 -2.5442 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.1349 3.0262 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5526 2.3217 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0000 -3.5442 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7320 -3.5442 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8660 -4.0442 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7281 3.9397 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.1458 3.2352 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.7336 4.0442 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0016 0.9962 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4631 -2.2342 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.2690 -2.2342 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.0868 -0.3506 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.7550 -1.3719 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.7515 2.9614 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.1881 1.8201 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4631 -3.8542 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.2690 -3.8542 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.8660 -4.6642 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.0926 4.4413 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.5292 3.3000 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.4814 4.6106 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.1527 1.9433 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 5 1 0 0 0 0 1 35 1 0 0 0 0 2 3 1 0 0 0 0 2 7 1 0 0 0 0 2 8 1 0 0 0 0 3 10 2 0 0 0 0 4 7 1 0 0 0 0 4 25 1 0 0 0 0 4 26 1 0 0 0 0 5 9 2 0 0 0 0 6 7 2 0 0 0 0 6 9 1 0 0 0 0 6 10 1 0 0 0 0 8 12 2 0 0 0 0 8 13 1 0 0 0 0 9 11 1 0 0 0 0 10 22 1 0 0 0 0 11 14 2 0 0 0 0 11 15 1 0 0 0 0 12 16 1 0 0 0 0 12 23 1 0 0 0 0 13 17 2 0 0 0 0 13 24 1 0 0 0 0 14 19 1 0 0 0 0 14 27 1 0 0 0 0 15 20 2 0 0 0 0 15 28 1 0 0 0 0 16 18 2 0 0 0 0 16 29 1 0 0 0 0 17 18 1 0 0 0 0 17 30 1 0 0 0 0 18 31 1 0 0 0 0 19 21 2 0 0 0 0 19 32 1 0 0 0 0 20 21 1 0 0 0 0 20 33 1 0 0 0 0 21 34 1 0 0 0 0 M END $$$$