CHEMBRIDGE-ZINC01159237 MOE2007 3D CORINA 3.40 0006 02.08.2006 40 41 0 0 0 0 0 0 0 0999 V2000 0.1790 2.7050 0.6630 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.3430 1.3830 0.7170 O 0 0 0 0 0 0 0 0 0 0 0 0 0.1530 0.5590 1.6890 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.3920 -0.7260 1.7020 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0290 -1.6660 2.6460 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0020 -1.3370 3.5920 C 0 0 0 0 0 0 0 0 0 0 0 0 1.5490 -0.0530 3.5820 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1250 0.8910 2.6340 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3230 -2.3470 4.4560 O 0 0 0 0 0 0 0 0 0 0 0 0 2.3190 -2.0840 5.4310 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5610 -3.3180 6.3050 C 0 0 0 0 0 0 0 0 0 0 0 0 1.9640 -4.3760 6.1450 O 0 0 0 0 0 0 0 0 0 0 0 0 3.5610 -3.0780 7.2690 N 0 0 0 0 0 0 0 0 0 0 0 0 4.0180 -3.8690 8.3530 C 0 0 0 0 0 0 0 0 0 0 0 0 3.2940 -5.2890 8.8640 S 0 0 0 0 0 0 0 0 0 0 0 0 5.1810 -3.2920 8.8840 N 0 0 0 0 0 0 0 0 0 0 0 0 5.7650 -3.3890 10.1730 C 0 0 0 0 0 0 0 0 0 0 0 0 7.0810 -2.9320 10.3060 C 0 0 0 0 0 0 0 0 0 0 0 0 7.7310 -2.9650 11.5440 C 0 0 0 0 0 0 0 0 0 0 0 0 7.0800 -3.4450 12.6920 C 0 0 0 0 0 0 0 0 0 0 0 0 5.7500 -3.8640 12.5660 C 0 0 0 0 0 0 0 0 0 0 0 0 5.1010 -3.8330 11.3180 C 0 0 0 0 0 0 0 0 0 0 0 0 4.8020 -4.3650 13.9250 Cl 0 0 0 0 0 0 0 0 0 0 0 0 7.8390 -3.4700 13.9900 C 0 0 0 0 0 0 0 0 0 0 0 0 7.8220 -4.5500 14.6560 O 0 5 0 0 0 0 0 0 0 0 0 0 1.2540 2.6960 0.4530 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3170 3.2270 -0.1600 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0390 3.2530 1.5860 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1500 -0.9990 0.9720 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4050 -2.6630 2.6430 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3060 0.2530 4.2960 H 0 0 0 0 0 0 0 0 0 0 0 0 1.5780 1.8780 2.6640 H 0 0 0 0 0 0 0 0 0 0 0 0 3.2700 -1.8320 4.9440 H 0 0 0 0 0 0 0 0 0 0 0 0 1.9990 -1.2700 6.0920 H 0 0 0 0 0 0 0 0 0 0 0 0 4.0250 -2.1820 7.2040 H 0 0 0 0 0 0 0 0 0 0 0 0 5.7240 -2.7340 8.2360 H 0 0 0 0 0 0 0 0 0 0 0 0 7.6340 -2.5560 9.4480 H 0 0 0 0 0 0 0 0 0 0 0 0 8.7590 -2.6130 11.6210 H 0 0 0 0 0 0 0 0 0 0 0 0 4.0560 -4.1200 11.2830 H 0 0 0 0 0 0 0 0 0 0 0 0 8.4750 -2.4120 14.2900 O 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 26 1 0 0 0 0 1 27 1 0 0 0 0 1 28 1 0 0 0 0 2 3 1 0 0 0 0 3 4 1 0 0 0 0 3 8 2 0 0 0 0 4 5 2 0 0 0 0 4 29 1 0 0 0 0 5 6 1 0 0 0 0 5 30 1 0 0 0 0 6 7 2 0 0 0 0 6 9 1 0 0 0 0 7 8 1 0 0 0 0 7 31 1 0 0 0 0 8 32 1 0 0 0 0 9 10 1 0 0 0 0 10 11 1 0 0 0 0 10 33 1 0 0 0 0 10 34 1 0 0 0 0 11 12 2 0 0 0 0 11 13 1 0 0 0 0 13 14 1 0 0 0 0 13 35 1 0 0 0 0 14 15 2 0 0 0 0 14 16 1 0 0 0 0 16 17 1 0 0 0 0 16 36 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 37 1 0 0 0 0 19 20 1 0 0 0 0 19 38 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 23 1 0 0 0 0 22 39 1 0 0 0 0 24 25 1 0 0 0 0 24 40 2 0 0 0 0 M CHG 1 25 -1 M END