B4OWA7 -OEChem-04022103083D 25 26 0 0 0 0 0 0 0999 V2000 3.5370 0.8901 -0.0587 S 0 0 0 0 0 0 0 0 0 0 0 0 -2.9841 1.7652 -0.0217 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.1147 -2.1663 -0.4082 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.7597 3.4368 -0.1919 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.5862 -0.7449 0.6752 O 0 0 0 0 0 0 0 0 0 0 0 0 0.6762 1.6316 -0.0787 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.1413 -0.5757 0.0899 N 0 0 0 0 0 0 0 0 0 0 0 0 0.8521 0.2581 0.0212 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2521 -0.2381 0.0336 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4046 -0.0394 0.0747 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.7013 1.2678 -0.0103 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.5701 2.2279 -0.1019 C 0 0 0 0 0 0 0 0 0 0 0 0 2.7079 -1.5357 0.1118 C 0 0 0 0 0 0 0 0 0 0 0 0 4.1310 -1.6046 0.0961 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.5115 -1.0028 0.1628 C 0 0 0 0 0 0 0 0 0 0 0 0 4.7084 -0.3572 0.0062 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.0914 -3.2127 -0.4002 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4920 2.2346 -0.1366 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0597 -2.4004 0.1775 H 0 0 0 0 0 0 0 0 0 0 0 0 4.7021 -2.5224 0.1480 H 0 0 0 0 0 0 0 0 0 0 0 0 5.7622 -0.1187 -0.0245 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.6248 1.0374 0.0002 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.6543 -4.0894 -0.8854 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.9793 -2.9065 -0.9617 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.3561 -3.4758 0.6285 H 0 0 0 0 0 0 0 0 0 0 0 0 1 9 1 0 0 0 0 1 16 1 0 0 0 0 2 11 1 0 0 0 0 2 22 1 0 0 0 0 3 15 1 0 0 0 0 3 17 1 0 0 0 0 4 12 2 0 0 0 0 5 15 2 0 0 0 0 6 8 1 0 0 0 0 6 12 1 0 0 0 0 6 18 1 0 0 0 0 7 8 2 0 0 0 0 7 10 1 0 0 0 0 8 9 1 0 0 0 0 9 13 2 0 0 0 0 10 11 2 0 0 0 0 10 15 1 0 0 0 0 11 12 1 0 0 0 0 13 14 1 0 0 0 0 13 19 1 0 0 0 0 14 16 2 0 0 0 0 14 20 1 0 0 0 0 16 21 1 0 0 0 0 17 23 1 0 0 0 0 17 24 1 0 0 0 0 17 25 1 0 0 0 0 M END $$$$