KEYORGANICS-ZINC02243912 MOE2007 3D CORINA 3.40 0006 02.08.2006 30 31 0 0 0 0 0 0 0 0999 V2000 -0.0350 1.2850 -0.0100 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0100 -0.1090 -0.0950 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2490 -0.7540 -0.1810 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4400 -0.0190 -0.1730 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3840 1.3740 -0.0880 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1490 2.0380 -0.0180 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0980 3.5450 0.0800 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0880 3.9970 1.4540 N 0 0 0 0 0 0 0 0 0 0 0 0 2.1930 4.1700 2.2230 C 0 0 0 0 0 0 0 0 0 0 0 0 3.3700 3.9900 1.9600 O 0 0 0 0 0 0 0 0 0 0 0 0 1.6900 4.6470 3.5570 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4170 4.8620 4.5110 O 0 0 0 0 0 0 0 0 0 0 0 0 0.3420 4.7390 3.4250 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.0410 4.3200 2.1720 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.1890 4.2220 1.7590 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.5620 5.2570 4.4460 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.7880 6.7770 4.3550 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.2130 7.3660 3.3940 O 0 0 0 0 0 0 0 0 0 0 0 0 1.3010 -2.2140 -0.2780 N 0 3 0 0 0 0 0 0 0 0 0 0 0.2440 -2.8400 -0.1070 O 0 0 0 0 0 0 0 0 0 0 0 0 2.3940 -2.7400 -0.5300 O 0 5 0 0 0 0 0 0 0 0 0 0 -1.0010 1.7840 0.0640 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9250 -0.6660 -0.0930 H 0 0 0 0 0 0 0 0 0 0 0 0 3.4110 -0.5050 -0.2290 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3120 1.9440 -0.0680 H 0 0 0 0 0 0 0 0 0 0 0 0 1.9720 3.9750 -0.4250 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2060 3.9200 -0.4350 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.5320 4.7570 4.3400 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1420 5.0280 5.4310 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.5290 7.2520 5.2630 O 0 5 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 6 2 0 0 0 0 1 22 1 0 0 0 0 2 3 2 0 0 0 0 2 23 1 0 0 0 0 3 4 1 0 0 0 0 3 19 1 0 0 0 0 4 5 2 0 0 0 0 4 24 1 0 0 0 0 5 6 1 0 0 0 0 5 25 1 0 0 0 0 6 7 1 0 0 0 0 7 8 1 0 0 0 0 7 26 1 0 0 0 0 7 27 1 0 0 0 0 8 9 1 0 0 0 0 8 14 1 0 0 0 0 9 10 2 0 0 0 0 9 11 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 17 1 0 0 0 0 16 28 1 0 0 0 0 16 29 1 0 0 0 0 17 18 2 0 0 0 0 17 30 1 0 0 0 0 19 20 2 0 0 0 0 19 21 1 0 0 0 0 M CHG 1 19 1 M CHG 1 21 -1 M CHG 1 30 -1 M END