BMB91L -OEChem-04022108543D 40 42 0 0 0 0 0 0 0999 V2000 -2.5430 1.9149 -0.7793 S 0 0 0 0 0 0 0 0 0 0 0 0 3.9337 -0.5897 -0.7301 S 0 0 0 0 0 0 0 0 0 0 0 0 0.0972 2.1616 -2.5349 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.6839 2.6540 -0.2717 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.3611 1.7638 -2.2101 O 0 0 0 0 0 0 0 0 0 0 0 0 3.5279 -2.1485 -0.4681 O 0 0 0 0 0 0 0 0 0 0 0 0 4.2627 -0.4607 -2.1387 O 0 0 0 0 0 0 0 0 0 0 0 0 4.8710 -0.1808 0.2998 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.5156 -4.2677 -0.2962 O 0 5 0 0 0 0 0 0 0 0 0 0 -0.8322 -2.9244 -1.8923 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.1130 2.5452 -0.0634 N 0 0 0 0 0 0 0 0 0 0 0 0 -1.4428 -3.1276 -0.8150 N 0 3 0 0 0 0 0 0 0 0 0 0 0.6965 1.2165 0.9744 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0991 1.7819 -0.1639 C 0 0 0 0 0 0 0 0 0 0 0 0 1.8914 0.4717 0.8311 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4537 0.3145 -0.4462 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6715 1.6158 -1.4254 C 0 0 0 0 0 0 0 0 0 0 0 0 1.8466 0.8834 -1.5662 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1342 1.3738 2.2515 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4889 -0.0936 1.9695 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.6255 0.2948 -0.0712 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7416 0.8054 3.3717 C 0 0 0 0 0 0 0 0 0 0 0 0 1.9167 0.0732 3.2310 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.0055 -0.7568 -0.7211 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.3088 0.1134 1.1176 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.0712 -2.0337 -0.1633 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.3744 -1.1634 1.6754 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.7556 -2.2369 1.0350 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.2240 3.1222 0.7786 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2673 0.7674 -2.5607 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7855 1.9284 2.4159 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3733 -0.7174 1.9400 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2942 0.9304 4.3535 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3816 -0.3787 4.1026 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.4789 -0.5848 -1.6551 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.7891 0.9372 1.6361 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.9051 -1.3208 2.6099 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6314 1.9374 -3.3161 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.8270 -3.2171 1.4993 H 0 0 0 0 0 0 0 0 0 0 0 0 2.8299 -2.5103 -1.0632 H 0 0 0 0 0 0 0 0 0 0 0 0 1 4 2 0 0 0 0 1 5 2 0 0 0 0 1 11 1 0 0 0 0 1 21 1 0 0 0 0 2 6 1 0 0 0 0 2 7 2 0 0 0 0 2 8 2 0 0 0 0 2 16 1 0 0 0 0 3 17 1 0 0 0 0 3 38 1 0 0 0 0 6 40 1 0 0 0 0 9 12 1 0 0 0 0 10 12 2 0 0 0 0 11 14 1 0 0 0 0 11 29 1 0 0 0 0 12 26 1 0 0 0 0 13 14 1 0 0 0 0 13 15 1 0 0 0 0 13 19 2 0 0 0 0 14 17 2 0 0 0 0 15 16 1 0 0 0 0 15 20 2 0 0 0 0 16 18 2 0 0 0 0 17 18 1 0 0 0 0 18 30 1 0 0 0 0 19 22 1 0 0 0 0 19 31 1 0 0 0 0 20 23 1 0 0 0 0 20 32 1 0 0 0 0 21 24 1 0 0 0 0 21 25 2 0 0 0 0 22 23 2 0 0 0 0 22 33 1 0 0 0 0 23 34 1 0 0 0 0 24 26 2 0 0 0 0 24 35 1 0 0 0 0 25 27 1 0 0 0 0 25 36 1 0 0 0 0 26 28 1 0 0 0 0 27 28 2 0 0 0 0 27 37 1 0 0 0 0 28 39 1 0 0 0 0 M CHG 2 9 -1 12 1 M END $$$$