IBS-ZINC04043039 MOE2007 3D CORINA 3.40 0006 02.08.2006 43 45 0 0 0 0 0 0 0 0999 V2000 -0.0130 1.0860 0.0080 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0720 1.0150 2.4280 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.7400 3.0270 1.2590 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.6690 3.4810 2.3870 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.7100 5.0090 2.4300 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.6000 5.4430 3.5100 N 0 0 0 0 0 0 0 0 0 0 0 0 -2.7970 6.7960 3.7450 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.6450 7.2260 4.7740 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.8040 8.6040 4.9620 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.7330 8.7670 6.0910 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.2690 9.8800 6.7390 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.1390 9.7030 7.7980 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.4790 8.4210 8.2160 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.9550 7.3160 7.5840 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.0770 7.4740 6.5150 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.4140 6.5630 5.7120 N 0 0 0 0 0 0 0 0 0 0 0 0 -4.4790 5.5980 5.7950 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.6640 10.7860 8.4320 O 0 0 0 0 0 0 0 0 0 0 0 0 -7.5560 10.5310 9.5190 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.1510 9.4500 4.1650 N 0 0 0 0 0 0 0 0 0 0 0 0 -2.3650 8.9990 3.2120 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.1810 7.7090 3.0020 N 0 0 0 0 0 0 0 0 0 0 0 0 0.0020 -0.0040 0.0020 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0100 1.4630 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5400 1.4470 -0.8750 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9700 1.3320 2.4710 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1190 -0.0740 2.4030 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6000 1.3810 3.3080 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1100 3.4080 0.3070 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2640 3.4130 1.4380 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.6730 3.0950 2.2070 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2980 3.1000 3.3380 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7060 5.3950 2.6100 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.0800 5.3900 1.4790 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.0510 4.7850 4.0610 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.0050 10.8750 6.4150 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.1600 8.2900 9.0450 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.2250 6.3250 7.9170 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.4120 9.9590 9.1600 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.0370 9.9620 10.2900 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.9010 11.4770 9.9350 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.8490 9.7090 2.5820 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7000 1.5600 1.2170 N 0 0 0 0 0 0 0 0 0 0 0 0 1 23 1 0 0 0 0 1 24 1 0 0 0 0 1 25 1 0 0 0 0 1 43 1 0 0 0 0 2 26 1 0 0 0 0 2 27 1 0 0 0 0 2 28 1 0 0 0 0 2 43 1 0 0 0 0 3 4 1 0 0 0 0 3 29 1 0 0 0 0 3 30 1 0 0 0 0 3 43 1 0 0 0 0 4 5 1 0 0 0 0 4 31 1 0 0 0 0 4 32 1 0 0 0 0 5 6 1 0 0 0 0 5 33 1 0 0 0 0 5 34 1 0 0 0 0 6 7 1 0 0 0 0 6 35 1 0 0 0 0 7 8 1 0 0 0 0 7 22 2 0 0 0 0 8 9 2 0 0 0 0 8 16 1 0 0 0 0 9 10 1 0 0 0 0 9 20 1 0 0 0 0 10 11 1 0 0 0 0 10 15 2 0 0 0 0 11 12 2 0 0 0 0 11 36 1 0 0 0 0 12 13 1 0 0 0 0 12 18 1 0 0 0 0 13 14 2 0 0 0 0 13 37 1 0 0 0 0 14 15 1 0 0 0 0 14 38 1 0 0 0 0 15 16 1 0 0 0 0 16 17 1 0 0 0 0 18 19 1 0 0 0 0 19 39 1 0 0 0 0 19 40 1 0 0 0 0 19 41 1 0 0 0 0 20 21 2 0 0 0 0 21 22 1 0 0 0 0 21 42 1 0 0 0 0 M END