ASINEX-ZINC00845555 MOE2007 3D CORINA 3.40 0006 02.08.2006 27 28 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 -0.8800 -0.7040 1.7840 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0400 -2.2980 0.6160 C 0 0 3 0 0 0 0 0 0 0 0 0 -0.8590 -2.8320 0.9230 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0230 -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 -0.0370 -0.1320 -2.6820 S 0 0 0 0 0 0 0 0 0 0 0 0 1.2300 -3.1060 0.9240 N 0 0 0 0 0 0 0 0 0 0 0 0 2.2220 -2.5910 1.6650 C 0 0 0 0 0 0 0 0 0 0 0 0 3.1830 -3.3010 1.8900 O 0 0 0 0 0 0 0 0 0 0 0 0 2.2340 -1.3570 2.1730 N 0 0 0 0 0 0 0 0 0 0 0 0 1.2410 -0.4470 2.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3060 0.6590 2.4920 O 0 0 0 0 0 0 0 0 0 0 0 0 3.4000 -0.9500 2.9610 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3320 -4.4780 0.4210 C 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 0.0260 -2.7880 -1.5080 H 0 0 0 0 0 0 0 0 0 0 0 0 4.1130 -1.7730 3.0070 H 0 0 0 0 0 0 0 0 0 0 0 0 3.8720 -0.0860 2.4920 H 0 0 0 0 0 0 0 0 0 0 0 0 3.0820 -0.6880 3.9700 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8140 -4.4720 -0.5570 H 0 0 0 0 0 0 0 0 0 0 0 0 1.9240 -5.0760 1.1140 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3340 -4.9070 0.3320 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 18 1 0 0 0 0 1 19 1 0 0 0 0 1 20 1 0 0 0 0 2 3 1 0 0 0 0 2 8 1 0 0 0 0 3 4 1 0 0 0 0 3 5 1 0 0 0 0 3 14 1 0 0 0 0 5 6 1 0 0 0 0 5 7 1 0 0 0 0 5 10 1 0 0 0 0 7 8 1 0 0 0 0 7 21 1 0 0 0 0 8 9 2 0 0 0 0 10 11 1 0 0 0 0 10 17 1 0 0 0 0 11 12 2 0 0 0 0 11 13 1 0 0 0 0 13 14 1 0 0 0 0 13 16 1 0 0 0 0 14 15 2 0 0 0 0 16 22 1 0 0 0 0 16 23 1 0 0 0 0 16 24 1 0 0 0 0 17 25 1 0 0 0 0 17 26 1 0 0 0 0 17 27 1 0 0 0 0 M END