B5O3DA -OEChem-04022107443D 40 42 0 0 0 0 0 0 0999 V2000 4.0492 0.4266 -1.6541 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.3949 0.9702 -0.1027 N 0 0 0 0 0 0 0 0 0 0 0 0 -1.1332 1.4139 0.0497 N 0 0 0 0 0 0 0 0 0 0 0 0 -3.6257 -1.1127 -0.1979 N 0 0 0 0 0 0 0 0 0 0 0 0 -2.1551 -3.0419 0.0593 N 0 0 0 0 0 0 0 0 0 0 0 0 0.2029 -2.8346 0.3654 N 0 0 0 0 0 0 0 0 0 0 0 0 5.1651 0.5758 0.9245 N 0 0 0 0 0 0 0 0 0 0 0 0 -3.4678 1.9207 -0.2753 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.5022 -0.3885 -0.0729 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.2178 -0.8691 0.1126 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.4213 0.2891 0.1802 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0060 0.3624 0.3663 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.2872 2.7480 -1.5505 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.6172 2.8293 0.9474 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.0626 -2.2498 0.1780 C 0 0 0 0 0 0 0 0 0 0 0 0 1.8550 0.3589 -0.7404 C 0 0 0 0 0 0 0 0 0 0 0 0 1.5382 0.4367 1.6535 C 0 0 0 0 0 0 0 0 0 0 0 0 3.2365 0.4297 -0.5599 C 0 0 0 0 0 0 0 0 0 0 0 0 2.9197 0.5073 1.8339 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7688 0.5039 0.7272 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.3518 -2.4328 -0.1188 C 0 0 0 0 0 0 0 0 0 0 0 0 4.4953 -0.8429 -2.1256 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.3976 1.3486 -0.3795 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.3920 3.3778 -1.5018 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.1503 3.4025 -1.7119 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.1887 2.0972 -2.4265 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.7347 3.4623 1.0924 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.7546 2.2367 1.8587 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.4869 3.4855 0.8373 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4483 0.3018 -1.7479 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8900 0.4398 2.5266 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3215 0.5643 2.8424 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.2051 -3.0961 -0.2100 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0348 -2.2704 0.4564 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2712 -3.8427 0.4072 H 0 0 0 0 0 0 0 0 0 0 0 0 5.5425 0.6327 1.8609 H 0 0 0 0 0 0 0 0 0 0 0 0 5.7868 0.5903 0.1271 H 0 0 0 0 0 0 0 0 0 0 0 0 5.1592 -0.6775 -2.9786 H 0 0 0 0 0 0 0 0 0 0 0 0 3.6447 -1.4472 -2.4568 H 0 0 0 0 0 0 0 0 0 0 0 0 5.0519 -1.3746 -1.3475 H 0 0 0 0 0 0 0 0 0 0 0 0 1 18 1 0 0 0 0 1 22 1 0 0 0 0 2 3 1 0 0 0 0 2 8 1 0 0 0 0 2 9 1 0 0 0 0 3 11 2 0 0 0 0 4 9 2 0 0 0 0 4 21 1 0 0 0 0 5 15 1 0 0 0 0 5 21 2 0 0 0 0 6 15 1 0 0 0 0 6 34 1 0 0 0 0 6 35 1 0 0 0 0 7 20 1 0 0 0 0 7 36 1 0 0 0 0 7 37 1 0 0 0 0 8 13 1 0 0 0 0 8 14 1 0 0 0 0 8 23 1 0 0 0 0 9 10 1 0 0 0 0 10 11 1 0 0 0 0 10 15 2 0 0 0 0 11 12 1 0 0 0 0 12 16 2 0 0 0 0 12 17 1 0 0 0 0 13 24 1 0 0 0 0 13 25 1 0 0 0 0 13 26 1 0 0 0 0 14 27 1 0 0 0 0 14 28 1 0 0 0 0 14 29 1 0 0 0 0 16 18 1 0 0 0 0 16 30 1 0 0 0 0 17 19 2 0 0 0 0 17 31 1 0 0 0 0 18 20 2 0 0 0 0 19 20 1 0 0 0 0 19 32 1 0 0 0 0 21 33 1 0 0 0 0 22 38 1 0 0 0 0 22 39 1 0 0 0 0 22 40 1 0 0 0 0 M END $$$$