BPWS17 -OEChem-04022105493D 48 50 0 1 0 0 0 0 0999 V2000 0.0581 -1.4646 -2.3368 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.0259 -3.5583 -0.7267 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.7840 -3.8179 1.8516 O 0 0 0 0 0 0 0 0 0 0 0 0 4.8297 2.8771 1.0610 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.6020 -0.1467 -0.5430 N 0 0 0 0 0 0 0 0 0 0 0 0 -1.4332 -3.6978 1.4993 N 0 0 0 0 0 0 0 0 0 0 0 0 -1.4241 0.7764 -1.2801 C 0 0 2 0 0 0 0 0 0 0 0 0 -0.6286 2.0068 -1.7585 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.7340 3.0630 -0.6452 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.4544 1.4260 -0.4055 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.0642 2.7236 -0.0501 C 0 0 0 0 0 0 0 0 0 0 0 0 0.8619 -2.0353 -0.1187 C 0 0 2 0 0 0 0 0 0 0 0 0 0.0780 -1.2011 -1.1365 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.6421 0.8862 0.0616 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.8471 3.5024 0.7852 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3722 -1.9768 -0.4330 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3198 -3.4788 -0.1240 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.4437 1.6694 0.8948 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.0486 2.9676 1.2547 C 0 0 0 0 0 0 0 0 0 0 0 0 3.0289 -0.6789 -0.0334 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.1721 -3.5716 0.1562 C 0 0 0 0 0 0 0 0 0 0 0 0 3.0812 0.3655 -0.9434 C 0 0 0 0 0 0 0 0 0 0 0 0 3.5696 -0.5534 1.2369 C 0 0 0 0 0 0 0 0 0 0 0 0 3.6893 1.5652 -0.5739 C 0 0 0 0 0 0 0 0 0 0 0 0 4.1775 0.6464 1.6064 C 0 0 0 0 0 0 0 0 0 0 0 0 4.2374 1.7057 0.7010 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.8815 0.2666 -2.1353 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4114 1.7850 -2.0180 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1082 2.4081 -2.6629 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0576 2.9330 0.0999 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7035 4.0768 -1.0538 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4932 0.0105 0.4549 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6954 -1.6313 0.8887 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.9447 -0.1203 -0.2070 H 0 0 0 0 0 0 0 0 0 0 0 0 2.8851 -2.7966 0.0882 H 0 0 0 0 0 0 0 0 0 0 0 0 2.5506 -2.1608 -1.5009 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.5398 4.5024 1.0717 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4945 -3.9475 -1.1009 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8650 -4.0838 0.6112 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.3803 1.2691 1.2735 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.6831 3.5595 1.9089 H 0 0 0 0 0 0 0 0 0 0 0 0 2.6605 0.2663 -1.9398 H 0 0 0 0 0 0 0 0 0 0 0 0 3.5257 -1.3717 1.9500 H 0 0 0 0 0 0 0 0 0 0 0 0 3.7288 2.3829 -1.2885 H 0 0 0 0 0 0 0 0 0 0 0 0 4.6020 0.7502 2.6012 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7513 -3.8339 2.2366 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.9930 -2.8893 2.0499 H 0 0 0 0 0 0 0 0 0 0 0 0 4.7801 3.4980 0.3139 H 0 0 0 0 0 0 0 0 0 0 0 0 1 13 2 0 0 0 0 2 21 2 0 0 0 0 3 6 1 0 0 0 0 3 47 1 0 0 0 0 4 26 1 0 0 0 0 4 48 1 0 0 0 0 5 7 1 0 0 0 0 5 13 1 0 0 0 0 5 32 1 0 0 0 0 6 21 1 0 0 0 0 6 46 1 0 0 0 0 7 8 1 0 0 0 0 7 10 1 0 0 0 0 7 27 1 0 0 0 0 8 9 1 0 0 0 0 8 28 1 0 0 0 0 8 29 1 0 0 0 0 9 11 1 0 0 0 0 9 30 1 0 0 0 0 9 31 1 0 0 0 0 10 11 1 0 0 0 0 10 14 2 0 0 0 0 11 15 2 0 0 0 0 12 13 1 0 0 0 0 12 16 1 0 0 0 0 12 17 1 0 0 0 0 12 33 1 0 0 0 0 14 18 1 0 0 0 0 14 34 1 0 0 0 0 15 19 1 0 0 0 0 15 37 1 0 0 0 0 16 20 1 0 0 0 0 16 35 1 0 0 0 0 16 36 1 0 0 0 0 17 21 1 0 0 0 0 17 38 1 0 0 0 0 17 39 1 0 0 0 0 18 19 2 0 0 0 0 18 40 1 0 0 0 0 19 41 1 0 0 0 0 20 22 2 0 0 0 0 20 23 1 0 0 0 0 22 24 1 0 0 0 0 22 42 1 0 0 0 0 23 25 2 0 0 0 0 23 43 1 0 0 0 0 24 26 2 0 0 0 0 24 44 1 0 0 0 0 25 26 1 0 0 0 0 25 45 1 0 0 0 0 M END $$$$