IFLAB-ZINC01137136 MOE2007 3D CORINA 3.40 0006 02.08.2006 25 26 0 0 1 0 0 0 0 0999 V2000 0.0920 1.0950 0.4920 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2550 -0.2360 0.8150 C 0 0 0 0 0 0 0 0 0 0 0 0 1.5360 -0.7910 0.8630 C 0 0 0 0 0 0 0 0 0 0 0 0 2.6470 0.0050 0.5830 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4720 1.3420 0.2600 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1930 1.8840 0.2150 C 0 0 0 0 0 0 0 0 0 0 0 0 3.5810 2.1440 -0.0200 N 0 0 0 0 0 0 0 0 0 0 0 0 4.7990 1.5440 -0.5710 C 0 0 3 0 0 0 0 0 0 0 0 0 5.4310 1.1550 0.2280 H 0 0 0 0 0 0 0 0 0 0 0 0 5.5560 2.5470 -1.4120 C 0 0 0 0 0 0 0 0 0 0 0 0 6.0070 3.5800 -0.9660 O 0 0 0 0 0 0 0 0 0 0 0 0 5.6830 2.1930 -2.6800 N 0 0 0 0 0 0 0 0 0 0 0 0 5.1730 1.0450 -3.1330 C 0 0 0 0 0 0 0 0 0 0 0 0 5.2360 0.6330 -4.2750 O 0 0 0 0 0 0 0 0 0 0 0 0 4.3860 0.2270 -1.7650 S 0 0 0 0 0 0 0 0 0 0 0 0 1.7140 -2.2170 1.2080 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8280 -2.6970 1.2500 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.8990 1.5220 0.4510 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6070 -0.8500 1.0310 H 0 0 0 0 0 0 0 0 0 0 0 0 3.6400 -0.4180 0.6190 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0580 2.9260 -0.0370 H 0 0 0 0 0 0 0 0 0 0 0 0 3.5450 3.0980 0.1500 H 0 0 0 0 0 0 0 0 0 0 0 0 6.1550 2.7780 -3.2930 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6390 -2.9840 1.4780 O 0 0 0 0 0 0 0 0 0 0 0 0 0.8060 -3.9100 1.6990 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 6 2 0 0 0 0 1 18 1 0 0 0 0 2 3 2 0 0 0 0 2 19 1 0 0 0 0 3 4 1 0 0 0 0 3 16 1 0 0 0 0 4 5 2 0 0 0 0 4 20 1 0 0 0 0 5 6 1 0 0 0 0 5 7 1 0 0 0 0 6 21 1 0 0 0 0 7 8 1 0 0 0 0 7 22 1 0 0 0 0 8 9 1 0 0 0 0 8 10 1 0 0 0 0 8 15 1 0 0 0 0 10 11 2 0 0 0 0 10 12 1 0 0 0 0 12 13 1 0 0 0 0 12 23 1 0 0 0 0 13 14 2 0 0 0 0 13 15 1 0 0 0 0 16 17 2 0 0 0 0 16 24 1 0 0 0 0 24 25 1 0 0 0 0 M END