CHEMBRIDGE-ZINC04818916 MOE2007 3D CORINA 3.40 0006 02.08.2006 47 49 0 0 1 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 -1.7080 4.9440 2.4290 N 0 0 0 0 0 0 0 0 0 0 0 0 -2.6630 5.7650 1.6840 C 0 0 3 0 0 0 0 0 0 0 0 0 -2.5470 5.5950 0.6140 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.3460 7.2310 2.0210 C 0 0 3 0 0 0 0 0 0 0 0 0 -1.1760 7.1490 2.9800 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.8780 5.7000 3.1580 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0040 5.2630 3.8680 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.6010 8.0750 3.5000 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.9580 7.9860 0.7760 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4950 7.3900 -0.1760 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.1340 9.3860 0.7150 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.8200 10.1820 -0.3570 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.0940 11.5090 -0.1440 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.6130 11.7980 1.0570 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.7960 10.3880 2.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 -4.0700 5.4310 2.1080 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.3470 5.1660 3.4370 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.6380 4.8600 3.8260 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.6520 4.8180 2.8870 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.3750 5.0840 1.5590 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.0850 5.3950 1.1700 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.4600 5.0390 0.5540 N 0 3 0 0 0 0 0 0 0 0 0 0 -8.5970 4.7680 0.8960 O 0 0 0 0 0 0 0 0 0 0 0 0 -7.2160 5.2730 -0.6170 O 0 5 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 -3.2010 7.7050 2.5030 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.4000 9.8020 -1.2770 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.9050 12.2670 -0.8910 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.8850 12.7910 1.3830 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.5550 5.1990 4.1700 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.8540 4.6530 4.8640 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.6600 4.5780 3.1910 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.8690 5.6060 0.1330 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 29 1 0 0 0 0 1 30 1 0 0 0 0 1 31 1 0 0 0 0 1 47 1 0 0 0 0 2 32 1 0 0 0 0 2 33 1 0 0 0 0 2 34 1 0 0 0 0 2 47 1 0 0 0 0 3 4 1 0 0 0 0 3 35 1 0 0 0 0 3 36 1 0 0 0 0 3 47 1 0 0 0 0 4 5 1 0 0 0 0 4 37 1 0 0 0 0 4 38 1 0 0 0 0 5 6 1 0 0 0 0 5 10 1 0 0 0 0 6 7 1 0 0 0 0 6 8 1 0 0 0 0 6 20 1 0 0 0 0 8 9 1 0 0 0 0 8 13 1 0 0 0 0 8 39 1 0 0 0 0 9 10 1 0 0 0 0 9 12 2 0 0 0 0 10 11 2 0 0 0 0 13 14 2 0 0 0 0 13 15 1 0 0 0 0 15 16 2 0 0 0 0 15 19 1 0 0 0 0 16 17 1 0 0 0 0 16 40 1 0 0 0 0 17 18 2 0 0 0 0 17 41 1 0 0 0 0 18 19 1 0 0 0 0 18 42 1 0 0 0 0 20 21 1 0 0 0 0 20 25 2 0 0 0 0 21 22 2 0 0 0 0 21 43 1 0 0 0 0 22 23 1 0 0 0 0 22 44 1 0 0 0 0 23 24 2 0 0 0 0 23 45 1 0 0 0 0 24 25 1 0 0 0 0 24 26 1 0 0 0 0 25 46 1 0 0 0 0 26 27 2 0 0 0 0 26 28 1 0 0 0 0 M CHG 1 26 1 M CHG 1 28 -1 M END