ASINEX-ZINC04141212 MOE2007 3D CORINA 3.40 0006 02.08.2006 28 28 0 0 1 0 0 0 0 0999 V2000 -0.0190 1.5260 0.0100 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0020 -0.0040 0.0020 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4330 -0.5340 0.0130 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7180 -0.4980 -1.2570 C 0 0 0 0 0 0 0 0 0 0 0 0 2.1650 -0.0790 -1.2080 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5830 0.5510 -0.2600 O 0 0 0 0 0 0 0 0 0 0 0 0 2.9960 -0.4060 -2.2180 N 0 0 0 0 0 0 0 0 0 0 0 0 4.4020 0.0000 -2.1710 C 0 0 3 0 0 0 0 0 0 0 0 0 4.4800 0.9690 -1.6780 H 0 0 0 0 0 0 0 0 0 0 0 0 4.9420 0.1160 -3.5970 C 0 0 0 0 0 0 0 0 0 0 0 0 6.4710 -0.0560 -3.5130 C 0 0 0 0 0 0 0 0 0 0 0 0 6.7200 -1.2160 -2.1340 S 0 0 0 0 0 0 0 0 0 0 0 0 5.1870 -1.0180 -1.3890 C 0 0 0 0 0 0 0 0 0 0 0 0 4.8010 -1.6010 -0.3970 O 0 0 0 0 0 0 0 0 0 0 0 0 1.0040 1.9030 0.0030 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5460 1.8870 -0.8730 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5290 1.8770 0.9070 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5290 -0.3650 0.8850 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.9600 -0.1730 -0.8700 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.4180 -1.6240 0.0070 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.9440 -0.1820 0.9100 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6560 -1.5840 -1.3080 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2440 -0.0640 -2.1380 H 0 0 0 0 0 0 0 0 0 0 0 0 2.6620 -0.9100 -2.9760 H 0 0 0 0 0 0 0 0 0 0 0 0 4.5140 -0.6680 -4.2220 H 0 0 0 0 0 0 0 0 0 0 0 0 4.7000 1.0950 -4.0090 H 0 0 0 0 0 0 0 0 0 0 0 0 6.8580 -0.4780 -4.4400 H 0 0 0 0 0 0 0 0 0 0 0 0 6.9500 0.9000 -3.2990 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 15 1 0 0 0 0 1 16 1 0 0 0 0 1 17 1 0 0 0 0 2 3 1 0 0 0 0 2 4 1 0 0 0 0 2 18 1 0 0 0 0 3 19 1 0 0 0 0 3 20 1 0 0 0 0 3 21 1 0 0 0 0 4 5 1 0 0 0 0 4 22 1 0 0 0 0 4 23 1 0 0 0 0 5 6 2 0 0 0 0 5 7 1 0 0 0 0 7 8 1 0 0 0 0 7 24 1 0 0 0 0 8 9 1 0 0 0 0 8 10 1 0 0 0 0 8 13 1 0 0 0 0 10 11 1 0 0 0 0 10 25 1 0 0 0 0 10 26 1 0 0 0 0 11 12 1 0 0 0 0 11 27 1 0 0 0 0 11 28 1 0 0 0 0 12 13 1 0 0 0 0 13 14 2 0 0 0 0 M END