CHEMBRIDGE-ZINC00122802 MOE2007 3D CORINA 3.40 0006 02.08.2006 31 34 0 0 0 0 0 0 0 0999 V2000 -0.0170 1.3840 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 1.1860 -0.6850 -0.0130 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3940 0.0190 -0.0210 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3750 1.4240 -0.0130 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1620 2.0980 0.0020 C 0 0 0 0 0 0 0 0 0 0 0 0 3.6970 1.8220 -0.0230 N 0 0 0 0 0 0 0 0 0 0 0 0 4.0220 2.7360 -0.0210 H 0 0 0 0 0 0 0 0 0 0 0 0 4.4590 0.6950 -0.0360 C 0 0 0 0 0 0 0 0 0 0 0 0 3.6980 -0.3600 -0.0340 N 0 0 0 0 0 0 0 0 0 0 0 0 5.9660 0.6730 -0.0500 C 0 0 0 0 0 0 0 0 0 0 0 0 6.5850 0.6550 1.6510 S 0 0 0 0 0 0 0 0 0 0 0 0 8.3200 0.6300 1.3450 C 0 0 0 0 0 0 0 0 0 0 0 0 9.2290 0.6110 2.2600 N 0 0 0 0 0 0 0 0 0 0 0 0 10.5180 0.5940 1.8660 C 0 0 0 0 0 0 0 0 0 0 0 0 11.6840 0.5710 2.6620 C 0 0 0 0 0 0 0 0 0 0 0 0 12.9240 0.5550 2.0760 C 0 0 0 0 0 0 0 0 0 0 0 0 13.0540 0.5600 0.6960 C 0 0 0 0 0 0 0 0 0 0 0 0 11.9300 0.5820 -0.1010 C 0 0 0 0 0 0 0 0 0 0 0 0 10.6630 0.5980 0.4760 C 0 0 0 0 0 0 0 0 0 0 0 0 9.0580 0.6190 -0.2510 S 0 0 0 0 0 0 0 0 0 0 0 0 -0.9610 1.9070 0.0170 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9290 -0.5510 0.0080 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1900 -1.7650 -0.0180 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1420 3.1780 0.0080 H 0 0 0 0 0 0 0 0 0 0 0 0 6.3110 -0.2200 -0.5710 H 0 0 0 0 0 0 0 0 0 0 0 0 6.3380 1.5600 -0.5620 H 0 0 0 0 0 0 0 0 0 0 0 0 11.5980 0.5670 3.7380 H 0 0 0 0 0 0 0 0 0 0 0 0 13.8080 0.5390 2.6970 H 0 0 0 0 0 0 0 0 0 0 0 0 14.0350 0.5480 0.2450 H 0 0 0 0 0 0 0 0 0 0 0 0 12.0320 0.5860 -1.1760 H 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 24 1 0 0 0 0 4 5 2 0 0 0 0 4 10 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 9 1 0 0 0 0 9 10 2 0 0 0 0 9 11 1 0 0 0 0 11 12 1 0 0 0 0 11 26 1 0 0 0 0 11 27 1 0 0 0 0 12 13 1 0 0 0 0 13 14 2 0 0 0 0 13 21 1 0 0 0 0 14 15 1 0 0 0 0 15 16 1 0 0 0 0 15 20 2 0 0 0 0 16 17 2 0 0 0 0 16 28 1 0 0 0 0 17 18 1 0 0 0 0 17 29 1 0 0 0 0 18 19 2 0 0 0 0 18 30 1 0 0 0 0 19 20 1 0 0 0 0 19 31 1 0 0 0 0 20 21 1 0 0 0 0 M END