BH3W6Z -OEChem-04022108303D 42 44 0 0 0 0 0 0 0999 V2000 -0.0581 0.3716 -0.5212 S 0 0 0 0 0 0 0 0 0 0 0 0 -2.7809 1.1479 0.6986 O 0 0 0 0 0 0 0 0 0 0 0 0 1.6804 -4.0012 -0.4419 O 0 0 0 0 0 0 0 0 0 0 0 0 2.0018 -2.5361 1.2692 O 0 0 0 0 0 0 0 0 0 0 0 0 2.5292 -0.4739 -0.5529 N 0 0 0 0 0 0 0 0 0 0 0 0 2.2569 1.6197 0.1424 N 0 0 0 0 0 0 0 0 0 0 0 0 3.7899 -0.0159 -0.2681 C 0 0 0 0 0 0 0 0 0 0 0 0 3.5934 1.2929 0.1638 C 0 0 0 0 0 0 0 0 0 0 0 0 1.6484 0.5386 -0.2917 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2179 -1.7995 -1.0431 C 0 0 0 0 0 0 0 0 0 0 0 0 5.0472 -0.6158 -0.3487 C 0 0 0 0 0 0 0 0 0 0 0 0 4.7057 2.0638 0.5415 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.6455 2.0130 -0.0142 C 0 0 0 0 0 0 0 0 0 0 0 0 6.1431 0.1660 0.0313 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.1579 2.1214 -0.1291 C 0 0 0 0 0 0 0 0 0 0 0 0 5.9776 1.4821 0.4687 C 0 0 0 0 0 0 0 0 0 0 0 0 1.9638 -2.7767 0.0718 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.0293 0.7251 0.3229 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.7102 -0.9972 0.2469 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.4397 -0.5671 0.6300 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.8721 1.5930 -0.3622 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.5614 -0.1322 -0.4406 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.1425 1.1628 -0.7451 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.1579 -2.3820 0.5719 C 0 0 0 0 0 0 0 0 0 0 0 0 3.0657 -2.1490 -1.6412 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3452 -1.7450 -1.6994 H 0 0 0 0 0 0 0 0 0 0 0 0 5.1819 -1.6377 -0.6841 H 0 0 0 0 0 0 0 0 0 0 0 0 4.5876 3.0872 0.8828 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3489 2.1712 1.0284 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1719 2.7816 -0.6336 H 0 0 0 0 0 0 0 0 0 0 0 0 7.1424 -0.2601 -0.0142 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.4324 1.9992 -1.1858 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.4670 3.1197 0.2028 H 0 0 0 0 0 0 0 0 0 0 0 0 6.8487 2.0647 0.7576 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.7692 -1.2356 1.1639 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.5958 2.6166 -0.5949 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.5534 -0.4557 -0.7450 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.8079 1.8379 -1.2753 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.8760 -3.0667 -0.2342 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.7064 -2.7339 1.5057 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.2442 -2.4257 0.7054 H 0 0 0 0 0 0 0 0 0 0 0 0 1.5106 -4.6627 0.2623 H 0 0 0 0 0 0 0 0 0 0 0 0 1 9 1 0 0 0 0 1 13 1 0 0 0 0 2 15 1 0 0 0 0 2 18 1 0 0 0 0 3 17 1 0 0 0 0 3 42 1 0 0 0 0 4 17 2 0 0 0 0 5 7 1 0 0 0 0 5 9 1 0 0 0 0 5 10 1 0 0 0 0 6 8 1 0 0 0 0 6 9 2 0 0 0 0 7 8 1 0 0 0 0 7 11 2 0 0 0 0 8 12 2 0 0 0 0 10 17 1 0 0 0 0 10 25 1 0 0 0 0 10 26 1 0 0 0 0 11 14 1 0 0 0 0 11 27 1 0 0 0 0 12 16 1 0 0 0 0 12 28 1 0 0 0 0 13 15 1 0 0 0 0 13 29 1 0 0 0 0 13 30 1 0 0 0 0 14 16 2 0 0 0 0 14 31 1 0 0 0 0 15 32 1 0 0 0 0 15 33 1 0 0 0 0 16 34 1 0 0 0 0 18 20 1 0 0 0 0 18 21 2 0 0 0 0 19 20 2 0 0 0 0 19 22 1 0 0 0 0 19 24 1 0 0 0 0 20 35 1 0 0 0 0 21 23 1 0 0 0 0 21 36 1 0 0 0 0 22 23 2 0 0 0 0 22 37 1 0 0 0 0 23 38 1 0 0 0 0 24 39 1 0 0 0 0 24 40 1 0 0 0 0 24 41 1 0 0 0 0 M END $$$$