BW4S3I -OEChem-04012119042D 42 41 0 0 0 0 0 0 0999 V2000 4.5981 -1.0670 0.0000 P 0 0 0 0 0 0 0 0 0 0 0 0 3.7320 -1.5670 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 4.0981 -0.2010 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 8.0622 -1.0670 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 7.1962 0.4330 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 5.0981 -1.9330 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 5.4641 -0.5670 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.3301 -1.0670 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.1962 -0.5670 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8660 -1.0670 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5981 0.6651 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.9282 -0.5670 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.0622 0.9330 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0000 -1.5670 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.0981 1.5311 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.7942 -1.0670 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.0622 1.9330 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.8626 -0.0920 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.0656 -0.0920 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.9316 -1.5419 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.7287 -1.5419 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.6592 -0.2570 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.2646 -0.5920 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.4675 -0.5920 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.0730 0.2665 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.0730 1.0636 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.3267 -0.0920 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.5297 -0.0920 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.2742 0.3504 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.6728 1.0407 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6900 -1.0300 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4631 -1.8770 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3100 -2.1039 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.6350 1.8411 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.7881 2.0680 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.5611 1.2211 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.4842 -1.6039 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.3312 -1.3770 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.1042 -0.5301 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.6822 1.9330 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.0622 2.5530 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.4422 1.9330 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 3 1 0 0 0 0 1 6 2 0 0 0 0 1 7 1 0 0 0 0 2 10 1 0 0 0 0 3 11 1 0 0 0 0 4 9 1 0 0 0 0 4 12 1 0 0 0 0 5 9 1 0 0 0 0 5 13 1 0 0 0 0 7 8 1 0 0 0 0 7 18 1 0 0 0 0 7 19 1 0 0 0 0 8 9 1 0 0 0 0 8 20 1 0 0 0 0 8 21 1 0 0 0 0 9 22 1 0 0 0 0 10 14 1 0 0 0 0 10 23 1 0 0 0 0 10 24 1 0 0 0 0 11 15 1 0 0 0 0 11 25 1 0 0 0 0 11 26 1 0 0 0 0 12 16 1 0 0 0 0 12 27 1 0 0 0 0 12 28 1 0 0 0 0 13 17 1 0 0 0 0 13 29 1 0 0 0 0 13 30 1 0 0 0 0 14 31 1 0 0 0 0 14 32 1 0 0 0 0 14 33 1 0 0 0 0 15 34 1 0 0 0 0 15 35 1 0 0 0 0 15 36 1 0 0 0 0 16 37 1 0 0 0 0 16 38 1 0 0 0 0 16 39 1 0 0 0 0 17 40 1 0 0 0 0 17 41 1 0 0 0 0 17 42 1 0 0 0 0 M END $$$$