PUBCHEM-ZINC00241648 MOE2007 3D CORINA 3.40 0006 02.08.2006 30 31 0 0 0 0 0 0 0 0999 V2000 1.2270 -0.3860 0.7580 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0950 -0.1330 -0.0150 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0220 1.0100 -0.8250 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1180 1.8930 -0.8440 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2580 1.6500 -0.0720 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3030 0.5020 0.7290 C 0 0 0 0 0 0 0 0 0 0 0 0 3.3880 2.5000 -0.0440 N 0 0 0 0 0 0 0 0 0 0 0 0 3.5580 3.6780 -0.7490 C 0 0 0 0 0 0 0 0 0 0 0 0 2.7540 4.2400 -1.4800 O 0 0 0 0 0 0 0 0 0 0 0 0 4.8660 4.3510 -0.5550 C 0 0 0 0 0 0 0 0 0 0 0 0 6.0610 3.6310 -0.4310 C 0 0 0 0 0 0 0 0 0 0 0 0 7.2760 4.3100 -0.2690 C 0 0 0 0 0 0 0 0 0 0 0 0 7.3070 5.7070 -0.2440 C 0 0 0 0 0 0 0 0 0 0 0 0 6.1070 6.4030 -0.3890 C 0 0 0 0 0 0 0 0 0 0 0 0 4.8840 5.7490 -0.5440 C 0 0 0 0 0 0 0 0 0 0 0 0 6.0950 7.8430 -0.3850 N 0 3 0 0 0 0 0 0 0 0 0 0 5.7450 8.3960 0.6650 O 0 0 0 0 0 0 0 0 0 0 0 0 6.4190 8.4090 -1.4360 O 0 5 0 0 0 0 0 0 0 0 0 0 8.8280 6.4880 -0.0280 Cl 0 0 0 0 0 0 0 0 0 0 0 0 -1.2100 1.2910 -1.6580 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.2210 2.3700 -2.3300 O 0 5 0 0 0 0 0 0 0 0 0 0 1.2680 -1.2750 1.3810 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7420 -0.8290 0.0130 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0440 2.7720 -1.4780 H 0 0 0 0 0 0 0 0 0 0 0 0 3.1730 0.2840 1.3430 H 0 0 0 0 0 0 0 0 0 0 0 0 4.1340 2.2030 0.5720 H 0 0 0 0 0 0 0 0 0 0 0 0 6.0740 2.5450 -0.4880 H 0 0 0 0 0 0 0 0 0 0 0 0 8.1960 3.7370 -0.1740 H 0 0 0 0 0 0 0 0 0 0 0 0 3.9580 6.3100 -0.6600 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.1420 0.4270 -1.6220 O 0 0 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 20 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 7 1 0 0 0 0 6 25 1 0 0 0 0 7 8 1 0 0 0 0 7 26 1 0 0 0 0 8 9 2 0 0 0 0 8 10 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 27 1 0 0 0 0 12 13 1 0 0 0 0 12 28 1 0 0 0 0 13 14 2 0 0 0 0 13 19 1 0 0 0 0 14 15 1 0 0 0 0 14 16 1 0 0 0 0 15 29 1 0 0 0 0 16 17 2 0 0 0 0 16 18 1 0 0 0 0 20 21 1 0 0 0 0 20 30 2 0 0 0 0 M CHG 1 16 1 M CHG 1 18 -1 M CHG 1 21 -1 M END