BDW2U3 -OEChem-04042105293D 42 43 0 0 0 0 0 0 0999 V2000 2.9587 -2.3679 0.3390 O 0 0 0 0 0 0 0 0 0 0 0 0 2.9325 2.3866 -0.2336 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.3265 -0.2986 -2.4152 O 0 0 0 0 0 0 0 0 0 0 0 0 4.2717 0.0673 0.4693 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.2102 -0.0698 -0.3732 N 0 0 0 0 0 0 0 0 0 0 0 0 -2.0462 0.1464 0.9526 N 0 0 0 0 0 0 0 0 0 0 0 0 -3.5395 -0.1198 -0.7290 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.2627 0.0497 0.4258 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.2917 0.2084 1.4265 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.0970 -0.1658 -1.2170 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3126 -0.1046 -0.7736 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.0106 -0.3291 -2.1140 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.7282 0.0653 0.5757 C 0 0 0 0 0 0 0 0 0 0 0 0 0.9707 1.1234 -0.7095 C 0 0 0 0 0 0 0 0 0 0 0 0 0.9839 -1.2751 -0.4199 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.5071 0.4289 2.8674 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3135 -1.2175 -0.0021 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3003 1.1811 -0.2919 C 0 0 0 0 0 0 0 0 0 0 0 0 2.9718 0.0107 0.0620 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8833 -2.7729 1.7043 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8491 3.1032 0.9965 C 0 0 0 0 0 0 0 0 0 0 0 0 5.2716 -0.0498 -0.5402 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.6475 -1.2795 -2.5182 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.1044 -0.3650 -2.1578 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.6948 0.4898 -2.7682 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.0331 0.2270 1.6141 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.1684 0.8662 -0.0275 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.1586 -0.8868 0.2483 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4502 2.0376 -0.9853 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4736 -2.2341 -0.4699 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.0699 -0.4027 3.3038 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.0720 1.3517 3.0350 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.5615 0.5136 3.4135 H 0 0 0 0 0 0 0 0 0 0 0 0 3.4509 -3.7005 1.8184 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3219 -2.0116 2.3572 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8438 -2.9608 1.9915 H 0 0 0 0 0 0 0 0 0 0 0 0 3.2937 2.5234 1.8115 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8070 3.3428 1.2308 H 0 0 0 0 0 0 0 0 0 0 0 0 3.4067 4.0374 0.8873 H 0 0 0 0 0 0 0 0 0 0 0 0 5.1841 0.7651 -1.2658 H 0 0 0 0 0 0 0 0 0 0 0 0 5.1942 -1.0157 -1.0493 H 0 0 0 0 0 0 0 0 0 0 0 0 6.2519 0.0142 -0.0600 H 0 0 0 0 0 0 0 0 0 0 0 0 1 17 1 0 0 0 0 1 20 1 0 0 0 0 2 18 1 0 0 0 0 2 21 1 0 0 0 0 3 10 2 0 0 0 0 4 19 1 0 0 0 0 4 22 1 0 0 0 0 5 6 1 0 0 0 0 5 7 1 0 0 0 0 5 10 1 0 0 0 0 6 9 2 0 0 0 0 7 8 2 0 0 0 0 7 12 1 0 0 0 0 8 9 1 0 0 0 0 8 13 1 0 0 0 0 9 16 1 0 0 0 0 10 11 1 0 0 0 0 11 14 2 0 0 0 0 11 15 1 0 0 0 0 12 23 1 0 0 0 0 12 24 1 0 0 0 0 12 25 1 0 0 0 0 13 26 1 0 0 0 0 13 27 1 0 0 0 0 13 28 1 0 0 0 0 14 18 1 0 0 0 0 14 29 1 0 0 0 0 15 17 2 0 0 0 0 15 30 1 0 0 0 0 16 31 1 0 0 0 0 16 32 1 0 0 0 0 16 33 1 0 0 0 0 17 19 1 0 0 0 0 18 19 2 0 0 0 0 20 34 1 0 0 0 0 20 35 1 0 0 0 0 20 36 1 0 0 0 0 21 37 1 0 0 0 0 21 38 1 0 0 0 0 21 39 1 0 0 0 0 22 40 1 0 0 0 0 22 41 1 0 0 0 0 22 42 1 0 0 0 0 M END $$$$