IFLAB-ZINC02699283 MOE2007 3D CORINA 3.40 0006 02.08.2006 30 31 0 0 1 0 0 0 0 0999 V2000 -0.0090 1.5200 0.0220 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0040 -0.0090 0.0060 C 0 0 3 0 0 0 0 0 0 0 0 0 0.5290 -0.3780 0.8870 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7190 -0.4990 -1.2550 C 0 0 3 0 0 0 0 0 0 0 0 0 0.6520 -1.5840 -1.3380 H 0 0 0 0 0 0 0 0 0 0 0 0 2.1640 -0.0510 -1.2590 C 0 0 0 0 0 0 0 0 0 0 0 0 2.9640 -0.3860 -0.4120 O 0 0 0 0 0 0 0 0 0 0 0 0 2.4740 0.7400 -2.2730 N 0 0 0 0 0 0 0 0 0 0 0 0 1.5640 1.0860 -3.1860 C 0 0 0 0 0 0 0 0 0 0 0 0 1.7510 1.8040 -4.1490 O 0 0 0 0 0 0 0 0 0 0 0 0 0.0300 0.3040 -2.7420 S 0 0 0 0 0 0 0 0 0 0 0 0 -1.4120 -0.5240 0.0120 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.8100 -1.2150 -0.9020 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.2360 -0.2170 1.0330 N 0 0 0 0 0 0 0 0 0 0 0 0 -3.5790 -0.6130 0.9930 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.9300 -1.8230 0.4090 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.2540 -2.2120 0.3700 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.2320 -1.3960 0.9140 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.8850 -0.1890 1.4970 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.5600 0.2010 1.5420 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.5280 -1.7780 0.8740 F 0 0 0 0 0 0 0 0 0 0 0 0 1.0150 1.8930 0.0170 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5340 1.8890 -0.8600 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5190 1.8700 0.9200 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3810 1.0760 -2.3540 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.8990 0.2790 1.7960 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.1670 -2.4590 -0.0160 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.5280 -3.1520 -0.0850 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.6490 0.4460 1.9200 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.2890 1.1400 2.0010 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 22 1 0 0 0 0 1 23 1 0 0 0 0 1 24 1 0 0 0 0 2 3 1 0 0 0 0 2 4 1 0 0 0 0 2 12 1 0 0 0 0 4 5 1 0 0 0 0 4 6 1 0 0 0 0 4 11 1 0 0 0 0 6 7 2 0 0 0 0 6 8 1 0 0 0 0 8 9 1 0 0 0 0 8 25 1 0 0 0 0 9 10 2 0 0 0 0 9 11 1 0 0 0 0 12 13 2 0 0 0 0 12 14 1 0 0 0 0 14 15 1 0 0 0 0 14 26 1 0 0 0 0 15 16 1 0 0 0 0 15 20 2 0 0 0 0 16 17 2 0 0 0 0 16 27 1 0 0 0 0 17 18 1 0 0 0 0 17 28 1 0 0 0 0 18 19 2 0 0 0 0 18 21 1 0 0 0 0 19 20 1 0 0 0 0 19 29 1 0 0 0 0 20 30 1 0 0 0 0 M END