CHEMBRIDGE-ZINC02317845 MOE2007 3D CORINA 3.40 0006 02.08.2006 34 36 0 0 0 0 0 0 0 0999 V2000 -0.0170 1.3830 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 1.2040 -0.6760 -0.0130 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4030 0.0330 -0.0200 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3980 1.4310 -0.0130 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1540 2.0980 0.0020 C 0 0 0 0 0 0 0 0 0 0 0 0 3.6370 1.9590 -0.0220 N 0 0 0 0 0 0 0 0 0 0 0 0 4.6380 1.1480 -0.0350 C 0 0 0 0 0 0 0 0 0 0 0 0 4.0760 -0.5180 -0.0390 S 0 0 0 0 0 0 0 0 0 0 0 0 5.9670 1.5340 -0.0470 N 0 0 0 0 0 0 0 0 0 0 0 0 6.9400 0.6010 -0.0610 C 0 0 0 0 0 0 0 0 0 0 0 0 6.6500 -0.5780 -0.0640 O 0 0 0 0 0 0 0 0 0 0 0 0 8.3740 1.0170 -0.0730 C 0 0 0 0 0 0 0 0 0 0 0 0 8.6640 2.1950 -0.0700 O 0 0 0 0 0 0 0 0 0 0 0 0 9.3460 0.0840 -0.0870 N 0 0 0 0 0 0 0 0 0 0 0 0 10.7530 0.4920 -0.0990 C 0 0 0 0 0 0 0 0 0 0 0 0 11.6310 -0.7330 -0.1140 C 0 0 0 0 0 0 0 0 0 0 0 0 12.0290 -1.2980 -1.3160 C 0 0 0 0 0 0 0 0 0 0 0 0 12.8360 -2.4240 -1.2810 C 0 0 0 0 0 0 0 0 0 0 0 0 13.2160 -2.9430 -0.0580 C 0 0 0 0 0 0 0 0 0 0 0 0 12.8190 -2.3790 1.0660 N 0 0 0 0 0 0 0 0 0 0 0 0 12.0550 -1.3040 1.0710 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.9620 1.9060 0.0170 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9260 -0.5570 0.0080 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2170 -1.7560 -0.0190 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1240 3.1770 0.0080 H 0 0 0 0 0 0 0 0 0 0 0 0 6.1990 2.4760 -0.0440 H 0 0 0 0 0 0 0 0 0 0 0 0 9.1140 -0.8580 -0.0890 H 0 0 0 0 0 0 0 0 0 0 0 0 10.9500 1.0910 -0.9880 H 0 0 0 0 0 0 0 0 0 0 0 0 10.9680 1.0820 0.7920 H 0 0 0 0 0 0 0 0 0 0 0 0 11.7160 -0.8700 -2.2580 H 0 0 0 0 0 0 0 0 0 0 0 0 13.1640 -2.8900 -2.1990 H 0 0 0 0 0 0 0 0 0 0 0 0 13.8450 -3.8200 -0.0220 H 0 0 0 0 0 0 0 0 0 0 0 0 11.7540 -0.8670 2.0120 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 23 1 0 0 0 0 2 3 2 0 0 0 0 2 24 1 0 0 0 0 3 4 1 0 0 0 0 3 25 1 0 0 0 0 4 5 2 0 0 0 0 4 9 1 0 0 0 0 5 6 1 0 0 0 0 5 7 1 0 0 0 0 6 26 1 0 0 0 0 7 8 2 0 0 0 0 8 9 1 0 0 0 0 8 10 1 0 0 0 0 10 11 1 0 0 0 0 10 27 1 0 0 0 0 11 12 2 0 0 0 0 11 13 1 0 0 0 0 13 14 2 0 0 0 0 13 15 1 0 0 0 0 15 16 1 0 0 0 0 15 28 1 0 0 0 0 16 17 1 0 0 0 0 16 29 1 0 0 0 0 16 30 1 0 0 0 0 17 18 1 0 0 0 0 17 22 2 0 0 0 0 18 19 2 0 0 0 0 18 31 1 0 0 0 0 19 20 1 0 0 0 0 19 32 1 0 0 0 0 20 21 2 0 0 0 0 20 33 1 0 0 0 0 21 22 1 0 0 0 0 22 34 1 0 0 0 0 M END