Amb89818 OpenBabel05172507542D 27 30 0 0 1 0 0 0 0 0999 V2000 4.1613 0.5356 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.2952 1.0356 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 3.2952 2.0356 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.1613 2.5356 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 2.4292 2.5356 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 1.5632 2.0356 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.5632 1.0356 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6972 0.5356 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1689 1.0356 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1689 2.0356 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6972 2.5356 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.0349 0.5356 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 -1.0349 -0.4644 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.9009 -0.9644 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.7669 -0.4644 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.7669 0.5356 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.9009 1.0356 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4292 0.5356 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 2.4292 -0.4644 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.2382 -1.0522 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 2.9292 -2.0032 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 1.9292 -2.0032 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.6202 -1.0522 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 0.6691 -0.7431 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.3090 -0.9511 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0000 0.0000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3414 -2.8122 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 2 3 1 0 0 0 0 2 18 1 0 0 0 0 3 4 2 0 0 0 0 3 5 1 0 0 0 0 5 6 1 0 0 0 0 6 11 2 0 0 0 0 6 7 1 0 0 0 0 7 8 2 0 0 0 0 8 9 1 0 0 0 0 9 10 2 0 0 0 0 9 12 1 0 0 0 0 10 11 1 0 0 0 0 12 17 1 0 0 0 0 12 13 1 0 0 0 0 13 14 1 0 0 0 0 14 15 1 0 0 0 0 15 16 1 0 0 0 0 16 17 1 0 0 0 0 18 19 1 0 0 0 0 19 23 1 0 0 0 0 19 20 2 0 0 0 0 20 21 1 0 0 0 0 21 22 2 0 0 0 0 22 23 1 0 0 0 0 22 27 1 0 0 0 0 23 24 1 0 0 0 0 24 26 1 0 0 0 0 24 25 1 0 0 0 0 25 26 1 0 0 0 0 M END > www.ambinter.com > Amb89818 > 387.499 $$$$