CHEMBRIDGE-ZINC04818916 MOE2007 3D CORINA 3.40 0006 02.08.2006 48 50 0 0 1 0 0 0 0 0999 V2000 0.3890 1.6720 -1.4540 C 0 0 0 0 0 0 0 0 0 0 0 0 0.9080 1.3180 0.9430 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.3760 3.3700 0.2180 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.2710 3.5820 1.4500 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.3810 4.9930 1.8030 N 0 0 0 0 0 0 0 0 0 0 0 0 -2.5640 5.8100 1.5330 C 0 0 3 0 0 0 0 0 0 0 0 0 -2.7400 5.7450 0.4520 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.1210 7.2160 1.9040 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.8040 7.1030 2.5510 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.3550 5.6820 2.4130 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7410 5.2670 2.7480 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.1370 7.9610 3.1070 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.8110 8.3330 1.6580 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.0270 8.2610 0.9990 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.3870 9.6400 2.0150 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.2840 10.3840 1.6400 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.2680 11.6770 2.2400 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.3620 11.8860 3.0470 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.4050 10.5320 3.0740 S 0 0 0 0 0 0 0 0 0 0 0 0 -3.7890 5.3440 2.3110 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.7330 5.0790 3.6910 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.8780 4.6980 4.3990 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.1040 4.5800 3.7470 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.1750 4.8430 2.3770 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.0300 5.2200 1.6560 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.4620 4.7210 1.6850 N 0 3 0 0 0 0 0 0 0 0 0 0 -8.4950 4.7390 2.3710 O 0 0 0 0 0 0 0 0 0 0 0 0 -7.4340 4.5900 0.4520 O 0 5 0 0 0 0 0 0 0 0 0 0 0.5400 0.5990 -1.5940 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3200 2.2260 -1.6040 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3930 2.0270 -2.1310 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8410 1.8830 0.8750 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0670 0.2680 0.6810 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4820 1.3780 1.9460 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8900 3.7580 -0.6690 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5880 3.8820 0.3070 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.2700 3.1680 1.2780 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8430 3.0750 2.3210 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.4060 9.1600 0.9800 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5120 10.0220 0.9720 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4900 12.4160 2.0890 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.6000 12.7700 3.6220 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.7970 5.1730 4.2380 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.8130 4.5020 5.4680 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.9830 4.2870 4.3170 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.1000 5.4430 0.5920 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0820 1.8990 -0.0370 N 0 3 0 0 0 0 0 0 0 0 0 0 -0.9600 1.3700 0.0620 H 0 0 0 0 0 0 0 0 0 0 0 0 1 29 1 0 0 0 0 1 30 1 0 0 0 0 1 31 1 0 0 0 0 1 47 1 0 0 0 0 2 32 1 0 0 0 0 2 33 1 0 0 0 0 2 34 1 0 0 0 0 2 47 1 0 0 0 0 3 4 1 0 0 0 0 3 35 1 0 0 0 0 3 36 1 0 0 0 0 3 47 1 0 0 0 0 4 5 1 0 0 0 0 4 37 1 0 0 0 0 4 38 1 0 0 0 0 5 6 1 0 0 0 0 5 10 1 0 0 0 0 6 7 1 0 0 0 0 6 8 1 0 0 0 0 6 20 1 0 0 0 0 8 9 1 0 0 0 0 8 13 2 0 0 0 0 9 10 1 0 0 0 0 9 12 2 0 0 0 0 10 11 2 0 0 0 0 13 14 1 0 0 0 0 13 15 1 0 0 0 0 14 39 1 0 0 0 0 15 16 2 0 0 0 0 15 19 1 0 0 0 0 16 17 1 0 0 0 0 16 40 1 0 0 0 0 17 18 2 0 0 0 0 17 41 1 0 0 0 0 18 19 1 0 0 0 0 18 42 1 0 0 0 0 20 21 1 0 0 0 0 20 25 2 0 0 0 0 21 22 2 0 0 0 0 21 43 1 0 0 0 0 22 23 1 0 0 0 0 22 44 1 0 0 0 0 23 24 2 0 0 0 0 23 45 1 0 0 0 0 24 25 1 0 0 0 0 24 26 1 0 0 0 0 25 46 1 0 0 0 0 26 27 2 0 0 0 0 26 28 1 0 0 0 0 47 48 1 0 0 0 0 M CHG 1 26 1 M CHG 1 28 -1 M CHG 1 47 1 M END