CHEMBRIDGE-ZINC00100023 MOE2007 3D CORINA 3.40 0006 02.08.2006 39 41 0 0 1 0 0 0 0 0999 V2000 -0.2120 1.6020 0.5670 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1530 0.0790 0.4320 C 0 0 3 0 0 0 0 0 0 0 0 0 0.3460 -0.1860 -0.5000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6200 -0.5110 1.6150 C 0 0 0 0 0 0 0 0 0 0 0 0 0.8940 -1.9910 1.3450 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.4120 -2.6730 0.9580 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4970 -2.0020 0.5570 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.8280 -3.0910 0.1870 S 0 0 0 0 0 0 0 0 0 0 0 0 -1.8820 -4.5010 0.5900 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.5970 -4.1090 0.9880 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3460 -5.1050 1.3630 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0850 -6.3640 1.3000 N 0 0 0 0 0 0 0 0 0 0 0 0 -1.3120 -6.6850 0.9160 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.2310 -5.7950 0.5570 N 0 0 0 0 0 0 0 0 0 0 0 0 -1.7500 -8.3910 0.8800 S 0 0 0 0 0 0 0 0 0 0 0 0 -0.1940 -9.1270 1.4400 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.3380 -10.6490 1.4900 C 0 0 3 0 0 0 0 0 0 0 0 0 -1.1930 -10.9130 2.1130 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9330 -11.2630 2.0800 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.5400 -11.1520 0.1670 O 0 0 0 0 0 0 0 0 0 0 0 0 1.6310 -4.7870 1.7660 N 0 0 0 0 0 0 0 0 0 0 0 0 -1.5740 -0.4910 0.4330 C 0 0 0 0 0 0 0 0 0 0 0 0 0.8000 2.0060 0.5700 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7670 2.0200 -0.2740 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7120 1.8660 1.4990 H 0 0 0 0 0 0 0 0 0 0 0 0 1.5660 0.0190 1.7330 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0290 -0.4100 2.5250 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6110 -2.0860 0.5290 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2970 -2.4580 2.2430 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6040 -8.8600 0.7480 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0480 -8.7530 2.4350 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0860 -10.8800 3.0890 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8300 -12.3480 2.1150 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7870 -10.9990 1.4570 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1840 -10.9530 -0.4430 H 0 0 0 0 0 0 0 0 0 0 0 0 1.9610 -3.8810 1.6620 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2010 -5.4700 2.1520 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.1300 -0.0840 1.2780 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.0750 -0.2240 -0.4980 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 23 1 0 0 0 0 1 24 1 0 0 0 0 1 25 1 0 0 0 0 2 3 1 0 0 0 0 2 4 1 0 0 0 0 2 22 1 0 0 0 0 4 5 1 0 0 0 0 4 26 1 0 0 0 0 4 27 1 0 0 0 0 5 6 1 0 0 0 0 5 28 1 0 0 0 0 5 29 1 0 0 0 0 6 7 2 0 0 0 0 6 10 1 0 0 0 0 7 8 1 0 0 0 0 7 22 1 0 0 0 0 8 9 1 0 0 0 0 9 10 1 0 0 0 0 9 14 2 0 0 0 0 10 11 2 0 0 0 0 11 12 1 0 0 0 0 11 21 1 0 0 0 0 12 13 2 0 0 0 0 13 14 1 0 0 0 0 13 15 1 0 0 0 0 15 16 1 0 0 0 0 16 17 1 0 0 0 0 16 30 1 0 0 0 0 16 31 1 0 0 0 0 17 18 1 0 0 0 0 17 19 1 0 0 0 0 17 20 1 0 0 0 0 19 32 1 0 0 0 0 19 33 1 0 0 0 0 19 34 1 0 0 0 0 20 35 1 0 0 0 0 21 36 1 0 0 0 0 21 37 1 0 0 0 0 22 38 1 0 0 0 0 22 39 1 0 0 0 0 M END