KEYORGANICS-ZINC04037162 MOE2007 3D CORINA 3.40 0006 02.08.2006 26 26 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 0.0230 -0.7190 1.2240 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.2730 -1.0300 1.7380 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0000 -0.8240 -1.4370 S 0 0 0 0 0 0 0 0 0 0 0 0 -0.6320 -2.0720 -1.1860 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.4560 0.0940 -2.4210 O 0 0 0 0 0 0 0 0 0 0 0 0 1.6780 -1.1870 -1.8330 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2510 -2.3670 -1.3970 C 0 0 0 0 0 0 0 0 0 0 0 0 3.5670 -2.6520 -1.7070 C 0 0 0 0 0 0 0 0 0 0 0 0 4.3110 -1.7570 -2.4550 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7370 -0.5760 -2.8910 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4180 -0.2950 -2.5850 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5320 0.3820 -3.6910 N 0 3 0 0 0 0 0 0 0 0 0 0 4.0260 1.4220 -4.0750 O 0 0 0 0 0 0 0 0 0 0 0 0 5.6920 0.1320 -3.9650 O 0 5 0 0 0 0 0 0 0 0 0 0 5.9640 -2.1140 -2.8450 Cl 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 -1.1710 -1.5770 2.6760 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.8250 -0.1060 1.9150 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.8130 -1.6430 1.0170 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6700 -3.0660 -0.8130 H 0 0 0 0 0 0 0 0 0 0 0 0 4.0150 -3.5740 -1.3660 H 0 0 0 0 0 0 0 0 0 0 0 0 1.9690 0.6250 -2.9290 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 5 1 0 0 0 0 3 4 1 0 0 0 0 4 21 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 2 0 0 0 0 5 8 1 0 0 0 0 8 9 1 0 0 0 0 8 13 2 0 0 0 0 9 10 2 0 0 0 0 9 24 1 0 0 0 0 10 11 1 0 0 0 0 10 25 1 0 0 0 0 11 12 2 0 0 0 0 11 17 1 0 0 0 0 12 13 1 0 0 0 0 12 14 1 0 0 0 0 13 26 1 0 0 0 0 14 15 2 0 0 0 0 14 16 1 0 0 0 0 M CHG 1 14 1 M CHG 1 16 -1 M END