IBS-ZINC02267680 MOE2007 3D CORINA 3.40 0006 02.08.2006 19 20 0 0 1 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 0.0250 -0.8600 1.1960 C 0 0 3 0 0 0 0 0 0 0 0 0 0.8760 -0.6550 1.8460 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0380 -2.2980 0.6170 C 0 0 3 0 0 0 0 0 0 0 0 0 0.8970 -2.8820 0.9480 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2420 -2.8650 1.0640 N 0 0 0 0 0 0 0 0 0 0 0 0 -1.9070 -1.9490 1.7780 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.9990 -2.1570 2.2700 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.2620 -0.7640 1.8990 N 0 0 0 0 0 0 0 0 0 0 0 0 0.0210 -2.0860 -0.8380 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.0040 -0.7720 -1.0940 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0260 -0.3180 -2.2220 O 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 -1.5550 -3.7620 0.8710 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.5820 0.0160 2.3790 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0240 -2.7890 -1.5070 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 14 1 0 0 0 0 1 15 1 0 0 0 0 1 16 1 0 0 0 0 2 3 1 0 0 0 0 2 12 1 0 0 0 0 3 4 1 0 0 0 0 3 5 1 0 0 0 0 3 10 1 0 0 0 0 5 6 1 0 0 0 0 5 7 1 0 0 0 0 5 11 1 0 0 0 0 7 8 1 0 0 0 0 7 17 1 0 0 0 0 8 9 2 0 0 0 0 8 10 1 0 0 0 0 10 18 1 0 0 0 0 11 12 1 0 0 0 0 11 19 1 0 0 0 0 12 13 2 0 0 0 0 M END