BV8WM7 -OEChem-04022109572D 47 49 0 0 0 0 0 0 0999 V2000 3.4030 -0.4728 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 8.5991 -1.4728 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 12.1292 -0.4969 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 6.8671 -1.4728 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 2.9030 0.3933 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 3.9030 -1.3388 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 10.3591 -0.5074 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 6.0010 0.0272 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 7.7331 1.0272 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 2.5369 -0.9728 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 8.5991 3.5272 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 9.4651 0.0272 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.3475 -1.5074 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.4651 1.0272 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.5991 -0.4728 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.2651 0.0064 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.7331 0.0272 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.2077 -2.0173 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.3591 1.5619 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.5991 1.5272 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.2651 1.0481 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.1350 -0.4728 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.2690 0.0272 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.8671 -0.4728 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.1961 -3.0173 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.0795 -1.5274 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.0563 -3.5272 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.9396 -2.0374 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.9281 -3.0373 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.5991 2.5272 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.7382 -1.3926 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.1287 -2.0875 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.3519 2.1819 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.8009 1.3601 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.7365 -0.9477 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.5335 -0.9477 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.6675 0.5022 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.8705 0.5022 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.0010 0.6472 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.6557 -3.3210 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 12.0866 -0.9074 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.0622 -1.7828 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 12.0492 -4.1472 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 13.4801 -1.7336 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 13.4614 -3.3535 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0000 -0.6628 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.5369 -1.5928 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 5 2 0 0 0 0 1 6 2 0 0 0 0 1 10 1 0 0 0 0 1 23 1 0 0 0 0 2 15 1 0 0 0 0 2 42 1 0 0 0 0 3 16 2 0 0 0 0 4 24 2 0 0 0 0 7 12 1 0 0 0 0 7 13 1 0 0 0 0 7 16 1 0 0 0 0 8 22 1 0 0 0 0 8 24 1 0 0 0 0 8 39 1 0 0 0 0 9 17 2 0 0 0 0 9 20 1 0 0 0 0 10 46 1 0 0 0 0 10 47 1 0 0 0 0 11 30 3 0 0 0 0 12 14 1 0 0 0 0 12 15 2 0 0 0 0 13 18 1 0 0 0 0 13 31 1 0 0 0 0 13 32 1 0 0 0 0 14 19 1 0 0 0 0 14 20 2 0 0 0 0 15 17 1 0 0 0 0 16 21 1 0 0 0 0 17 24 1 0 0 0 0 18 25 2 0 0 0 0 18 26 1 0 0 0 0 19 21 2 0 0 0 0 19 33 1 0 0 0 0 20 30 1 0 0 0 0 21 34 1 0 0 0 0 22 23 1 0 0 0 0 22 35 1 0 0 0 0 22 36 1 0 0 0 0 23 37 1 0 0 0 0 23 38 1 0 0 0 0 25 27 1 0 0 0 0 25 40 1 0 0 0 0 26 28 2 0 0 0 0 26 41 1 0 0 0 0 27 29 2 0 0 0 0 27 43 1 0 0 0 0 28 29 1 0 0 0 0 28 44 1 0 0 0 0 29 45 1 0 0 0 0 M END $$$$