CHEMBRIDGE-ZINC04750458 MOE2007 3D CORINA 3.40 0006 02.08.2006 40 42 0 0 0 0 0 0 0 0999 V2000 -0.0180 1.5030 0.0100 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0020 -0.0040 0.0020 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0230 -0.7000 1.1980 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0420 -2.0790 1.1970 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0400 -2.7720 -0.0130 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0190 -2.0660 -1.2150 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0060 -0.6860 -1.2010 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0350 0.0780 -2.4990 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0600 -4.2550 -0.0210 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.7900 -5.0030 -0.7340 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.4640 -6.7100 -0.4940 S 0 0 0 0 0 0 0 0 0 0 0 0 0.8260 -6.3970 0.5730 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0100 -5.0500 0.7390 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0490 -4.4730 1.5940 C 0 0 0 0 0 0 0 0 0 0 0 0 1.8150 -4.2460 2.7670 O 0 0 0 0 0 0 0 0 0 0 0 0 3.2640 -4.1930 1.0830 N 0 0 0 0 0 0 0 0 0 0 0 0 1.5920 -7.3740 1.1880 N 0 0 0 0 0 0 0 0 0 0 0 0 1.3350 -8.6760 0.9540 C 0 0 0 0 0 0 0 0 0 0 0 0 0.4310 -8.9940 0.2040 O 0 0 0 0 0 0 0 0 0 0 0 0 2.1440 -9.7100 1.6040 C 0 0 0 0 0 0 0 0 0 0 0 0 1.9820 -11.0590 1.4490 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8810 -11.8020 2.1770 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7500 -11.0890 2.9040 C 0 0 0 0 0 0 0 0 0 0 0 0 3.4850 -9.4150 2.7040 S 0 0 0 0 0 0 0 0 0 0 0 0 1.0040 1.8800 0.0030 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5460 1.8640 -0.8730 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5290 1.8540 0.9070 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0250 -0.1610 2.1340 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0580 -2.6210 2.1310 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0170 -2.5980 -2.1550 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9860 0.2770 -2.8270 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5510 -0.5110 -3.2570 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5590 1.0220 -2.3530 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.5700 -4.6110 -1.3690 H 0 0 0 0 0 0 0 0 0 0 0 0 3.4500 -4.3740 0.1480 H 0 0 0 0 0 0 0 0 0 0 0 0 3.9520 -3.8110 1.6490 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3120 -7.1210 1.7860 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2240 -11.4970 0.8170 H 0 0 0 0 0 0 0 0 0 0 0 0 2.8860 -12.8810 2.1630 H 0 0 0 0 0 0 0 0 0 0 0 0 4.5190 -11.5160 3.5300 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 25 1 0 0 0 0 1 26 1 0 0 0 0 1 27 1 0 0 0 0 2 3 1 0 0 0 0 2 7 2 0 0 0 0 3 4 2 0 0 0 0 3 28 1 0 0 0 0 4 5 1 0 0 0 0 4 29 1 0 0 0 0 5 6 2 0 0 0 0 5 9 1 0 0 0 0 6 7 1 0 0 0 0 6 30 1 0 0 0 0 7 8 1 0 0 0 0 8 31 1 0 0 0 0 8 32 1 0 0 0 0 8 33 1 0 0 0 0 9 10 2 0 0 0 0 9 13 1 0 0 0 0 10 11 1 0 0 0 0 10 34 1 0 0 0 0 11 12 1 0 0 0 0 12 13 2 0 0 0 0 12 17 1 0 0 0 0 13 14 1 0 0 0 0 14 15 2 0 0 0 0 14 16 1 0 0 0 0 16 35 1 0 0 0 0 16 36 1 0 0 0 0 17 18 1 0 0 0 0 17 37 1 0 0 0 0 18 19 2 0 0 0 0 18 20 1 0 0 0 0 20 21 2 0 0 0 0 20 24 1 0 0 0 0 21 22 1 0 0 0 0 21 38 1 0 0 0 0 22 23 2 0 0 0 0 22 39 1 0 0 0 0 23 24 1 0 0 0 0 23 40 1 0 0 0 0 M END