MAYBRIDGE-ZINC04371021 MOE2007 3D CORINA 3.40 0006 02.08.2006 22 22 0 0 1 0 0 0 0 0999 V2000 -0.7150 1.0040 0.1780 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0440 -0.3120 -0.0770 C 0 0 0 0 0 0 0 0 0 0 0 0 0.8820 -0.7090 1.1540 C 0 0 3 0 0 0 0 0 0 0 0 0 1.3450 0.1980 1.5660 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0010 -2.1490 1.5200 C 0 0 3 0 0 0 0 0 0 0 0 0 -0.5990 -3.1690 1.5470 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1860 -1.6540 -0.2160 S 0 0 0 0 0 0 0 0 0 0 0 0 -2.4270 -2.1090 2.1570 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.9980 -0.9850 2.2900 O 0 0 0 0 0 0 0 0 0 0 0 0 2.0860 -1.7160 1.0860 C 0 0 0 0 0 0 0 0 0 0 0 0 2.1730 -2.4990 2.0840 O 0 0 0 0 0 0 0 0 0 0 0 0 0.8170 -0.1880 -1.3900 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0100 1.8380 0.2770 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.3900 1.2500 -0.6510 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.3120 0.9810 1.0960 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6400 0.5280 -1.2890 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2370 -1.1420 -1.7240 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1720 0.1740 -2.2010 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0730 -1.2150 2.2000 N 0 0 0 0 0 0 0 0 0 0 0 0 0.5160 -1.7900 2.8260 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.8790 -3.2530 2.4900 O 0 5 0 0 0 0 0 0 0 0 0 0 2.8630 -1.5960 0.0990 O 0 5 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 13 1 0 0 0 0 1 14 1 0 0 0 0 1 15 1 0 0 0 0 2 3 1 0 0 0 0 2 7 1 0 0 0 0 2 12 1 0 0 0 0 3 4 1 0 0 0 0 3 10 1 0 0 0 0 3 19 1 0 0 0 0 5 6 1 0 0 0 0 5 7 1 0 0 0 0 5 8 1 0 0 0 0 5 19 1 0 0 0 0 8 9 2 0 0 0 0 8 21 1 0 0 0 0 10 11 2 0 0 0 0 10 22 1 0 0 0 0 12 16 1 0 0 0 0 12 17 1 0 0 0 0 12 18 1 0 0 0 0 19 20 1 0 0 0 0 M CHG 1 21 -1 M CHG 1 22 -1 M END