CHEMBRIDGE-ZINC04673291 MOE2007 3D CORINA 3.40 0006 02.08.2006 27 27 0 0 1 0 0 0 0 0999 V2000 -0.0430 1.3310 -0.2680 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0360 -0.0570 -0.4070 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2520 -0.7090 -0.2240 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3960 0.0360 0.0980 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3230 1.4300 0.2330 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0950 2.0870 0.0550 C 0 0 0 0 0 0 0 0 0 0 0 0 0.9990 3.5910 0.2030 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1930 4.1120 1.6380 C 0 0 3 0 0 0 0 0 0 0 0 0 2.1280 3.7430 2.0770 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2700 5.6580 1.4730 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2160 6.2750 1.8230 O 0 0 0 0 0 0 0 0 0 0 0 0 0.0870 3.7320 2.5300 N 0 0 0 0 0 0 0 0 0 0 0 0 0.0100 2.5690 3.2420 C 0 0 0 0 0 0 0 0 0 0 0 0 0.8390 1.6700 3.2800 O 0 0 0 0 0 0 0 0 0 0 0 0 3.6820 -0.6360 0.2880 N 0 3 0 0 0 0 0 0 0 0 0 0 4.6790 0.0560 0.5320 O 0 0 0 0 0 0 0 0 0 0 0 0 3.6900 -1.8770 0.1810 O 0 5 0 0 0 0 0 0 0 0 0 0 -1.0040 1.8230 -0.4060 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8550 -0.6280 -0.6530 H 0 0 0 0 0 0 0 0 0 0 0 0 3.2050 2.0170 0.4850 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7470 4.0280 -0.4730 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0270 3.9310 -0.1830 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6370 4.4470 2.6030 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9230 2.5210 3.8280 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3600 6.1040 1.0190 O 0 5 0 0 0 0 0 0 0 0 0 0 1.2380 -2.0720 -0.3810 O 0 0 0 0 0 0 0 0 0 0 0 0 2.1420 -2.4100 -0.1960 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 18 1 0 0 0 0 2 3 2 0 0 0 0 2 19 1 0 0 0 0 3 4 1 0 0 0 0 3 26 1 0 0 0 0 4 5 2 0 0 0 0 4 15 1 0 0 0 0 5 6 1 0 0 0 0 5 20 1 0 0 0 0 6 7 1 0 0 0 0 7 8 1 0 0 0 0 7 21 1 0 0 0 0 7 22 1 0 0 0 0 8 9 1 0 0 0 0 8 10 1 0 0 0 0 8 12 1 0 0 0 0 10 11 2 0 0 0 0 10 25 1 0 0 0 0 12 13 1 0 0 0 0 12 23 1 0 0 0 0 13 14 2 0 0 0 0 13 24 1 0 0 0 0 15 16 2 0 0 0 0 15 17 1 0 0 0 0 26 27 1 0 0 0 0 M CHG 1 15 1 M CHG 1 17 -1 M CHG 1 25 -1 M END