BWBH45 -OEChem-04042104413D 29 29 0 1 0 0 0 0 0999 V2000 -1.5065 -0.0696 0.3704 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.2580 1.0816 -0.5819 O 0 0 0 0 0 0 0 0 0 0 0 0 1.3336 -0.7306 -0.1453 N 0 3 0 0 0 0 0 0 0 0 0 0 -3.5863 -0.9504 0.4428 N 0 0 0 0 0 0 0 0 0 0 0 0 0.7870 0.5938 0.4549 C 0 0 1 0 0 0 0 0 0 0 0 0 2.8657 -0.5092 -0.2707 C 0 0 0 0 0 0 0 0 0 0 0 0 1.8513 1.6193 0.0969 C 0 0 0 0 0 0 0 0 0 0 0 0 3.1313 0.8517 0.3469 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0418 -1.8909 0.7974 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7719 -1.0665 -1.5237 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.6115 0.9621 -0.0105 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.8202 0.1088 0.0229 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7781 0.4481 1.5438 H 0 0 0 0 0 0 0 0 0 0 0 0 3.1257 -0.5119 -1.3350 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3966 -1.3200 0.2377 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7840 2.5175 0.7180 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7794 1.9223 -0.9544 H 0 0 0 0 0 0 0 0 0 0 0 0 4.0050 1.3398 -0.0943 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3116 0.7487 1.4237 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0391 -2.0146 0.8905 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4883 -2.7955 0.3733 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4917 -1.6724 1.7705 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2872 -1.3179 -1.4354 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9233 -0.2075 -2.1833 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3174 -1.9347 -1.9079 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6546 1.1256 -1.0932 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9155 1.8951 0.4802 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.5851 -0.9824 0.2682 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.1766 -1.7340 0.9400 H 0 0 0 0 0 0 0 0 0 0 0 0 1 11 1 0 0 0 0 1 12 1 0 0 0 0 2 12 2 0 0 0 0 3 5 1 0 0 0 0 3 6 1 0 0 0 0 3 9 1 0 0 0 0 3 10 1 0 0 0 0 4 12 1 0 0 0 0 4 28 1 0 0 0 0 4 29 1 0 0 0 0 5 7 1 0 0 0 0 5 11 1 0 0 0 0 5 13 1 0 0 0 0 6 8 1 0 0 0 0 6 14 1 0 0 0 0 6 15 1 0 0 0 0 7 8 1 0 0 0 0 7 16 1 0 0 0 0 7 17 1 0 0 0 0 8 18 1 0 0 0 0 8 19 1 0 0 0 0 9 20 1 0 0 0 0 9 21 1 0 0 0 0 9 22 1 0 0 0 0 10 23 1 0 0 0 0 10 24 1 0 0 0 0 10 25 1 0 0 0 0 11 26 1 0 0 0 0 11 27 1 0 0 0 0 M CHG 1 3 1 M END $$$$