B7V1PO -OEChem-04042104093D 35 36 0 0 0 0 0 0 0999 V2000 -2.1640 -3.6604 -1.8093 Cl 0 0 0 0 0 0 0 0 0 0 0 0 4.5842 -0.1850 0.0122 S 0 0 0 0 0 0 0 0 0 0 0 0 5.1734 -0.1250 -1.3187 O 0 0 0 0 0 0 0 0 0 0 0 0 5.2571 0.4608 1.1301 O 0 0 0 0 0 0 0 0 0 0 0 0 -4.4868 1.1330 0.0457 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.5523 3.1556 -0.3946 O 0 0 0 0 0 0 0 0 0 0 0 0 2.9530 0.4334 -0.0631 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3467 1.4207 -0.1845 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3487 0.9495 1.0832 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2543 0.4109 -1.2701 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0456 1.4430 1.0225 C 0 0 0 0 0 0 0 0 0 0 0 0 0.9512 0.9044 -1.3307 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.0117 1.9365 -0.2480 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.1472 1.2192 -0.0524 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.1145 -0.2259 0.2413 C 0 0 0 0 0 0 0 0 0 0 0 0 4.3865 -1.9064 0.4135 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.1505 -1.1513 -0.8017 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.0479 -0.6668 1.5631 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.4356 1.9634 -0.1557 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.1196 -2.5177 -0.5231 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.0171 -2.0332 1.8416 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.0531 -2.9587 0.7986 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8713 0.9702 2.0354 H 0 0 0 0 0 0 0 0 0 0 0 0 2.7033 0.0075 -2.1733 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5876 1.8409 1.9249 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4192 0.8791 -2.2789 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0618 3.0013 -0.4661 H 0 0 0 0 0 0 0 0 0 0 0 0 5.3799 -2.3551 0.4803 H 0 0 0 0 0 0 0 0 0 0 0 0 3.8749 -1.9904 1.3742 H 0 0 0 0 0 0 0 0 0 0 0 0 3.8109 -2.3919 -0.3769 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.2032 -0.8082 -1.8331 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.0199 0.0423 2.3869 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.9652 -2.3764 2.8707 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.0284 -4.0203 1.0308 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.3447 1.6040 -0.0210 H 0 0 0 0 0 0 0 0 0 0 0 0 1 20 1 0 0 0 0 2 3 2 0 0 0 0 2 4 2 0 0 0 0 2 7 1 0 0 0 0 2 16 1 0 0 0 0 5 19 1 0 0 0 0 5 35 1 0 0 0 0 6 19 2 0 0 0 0 7 9 2 0 0 0 0 7 10 1 0 0 0 0 8 11 2 0 0 0 0 8 12 1 0 0 0 0 8 13 1 0 0 0 0 9 11 1 0 0 0 0 9 23 1 0 0 0 0 10 12 2 0 0 0 0 10 24 1 0 0 0 0 11 25 1 0 0 0 0 12 26 1 0 0 0 0 13 14 2 0 0 0 0 13 27 1 0 0 0 0 14 15 1 0 0 0 0 14 19 1 0 0 0 0 15 17 2 0 0 0 0 15 18 1 0 0 0 0 16 28 1 0 0 0 0 16 29 1 0 0 0 0 16 30 1 0 0 0 0 17 20 1 0 0 0 0 17 31 1 0 0 0 0 18 21 2 0 0 0 0 18 32 1 0 0 0 0 20 22 2 0 0 0 0 21 22 1 0 0 0 0 21 33 1 0 0 0 0 22 34 1 0 0 0 0 M END $$$$