IFLAB-ZINC04243219 MOE2007 3D CORINA 3.40 0006 02.08.2006 21 21 0 0 0 0 0 0 0 0999 V2000 -0.0180 1.4610 0.0100 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0020 -0.0040 0.0020 N 0 0 0 0 0 0 0 0 0 0 0 0 -1.4210 -0.8520 0.0110 S 0 0 0 0 0 0 0 0 0 0 0 0 -1.0680 -2.2270 -0.0340 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.2170 -0.2870 1.0430 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.2470 -0.4990 -1.5050 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.0250 -1.2890 -2.6240 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.6950 -0.9790 -3.7950 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.5620 0.1080 -3.8100 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.1260 0.5620 -1.5890 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.2410 0.4320 -4.9790 N 0 0 0 0 0 0 0 0 0 0 0 0 1.0050 1.8380 0.0020 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5450 1.8220 -0.8730 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5280 1.8120 0.9070 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8490 -0.4780 -0.0090 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.3450 -2.1270 -2.5830 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.5450 -1.5720 -4.6850 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.3050 1.1770 -0.7190 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.1090 -0.1000 -5.7790 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.8480 1.1890 -4.9940 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.7480 0.8380 -2.7200 N 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 12 1 0 0 0 0 1 13 1 0 0 0 0 1 14 1 0 0 0 0 2 3 1 0 0 0 0 2 15 1 0 0 0 0 3 4 2 0 0 0 0 3 5 2 0 0 0 0 3 6 1 0 0 0 0 6 7 2 0 0 0 0 6 10 1 0 0 0 0 7 8 1 0 0 0 0 7 16 1 0 0 0 0 8 9 2 0 0 0 0 8 17 1 0 0 0 0 9 11 1 0 0 0 0 9 21 1 0 0 0 0 10 18 1 0 0 0 0 10 21 2 0 0 0 0 11 19 1 0 0 0 0 11 20 1 0 0 0 0 M END