NCID-ZINC05351066 MOE2007 3D CORINA 3.40 0006 02.08.2006 79 82 0 0 1 0 0 0 0 0999 V2000 3.7920 1.0120 -3.6950 C 0 0 0 0 0 0 0 0 0 0 0 0 3.2560 -0.2780 -3.1320 C 0 0 0 0 0 0 0 0 0 0 0 0 4.0050 -1.2110 -2.9340 O 0 0 0 0 0 0 0 0 0 0 0 0 1.9430 -0.3970 -2.8500 N 0 0 0 0 0 0 0 0 0 0 0 0 1.4220 -1.6520 -2.3040 C 0 0 3 0 0 0 0 0 0 0 0 0 0.3480 -1.5590 -2.1410 H 0 0 0 0 0 0 0 0 0 0 0 0 2.1140 -1.9560 -0.9740 C 0 0 0 0 0 0 0 0 0 0 0 0 1.6740 -0.6830 0.2420 S 0 0 0 0 0 0 0 0 0 0 0 0 2.5750 -1.2070 1.7260 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3080 -0.2350 2.8460 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2420 -0.4420 3.7010 C 0 0 0 0 0 0 0 0 0 0 0 0 0.9970 0.4500 4.7280 C 0 0 0 0 0 0 0 0 0 0 0 0 1.8180 1.5490 4.9000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8840 1.7560 4.0450 C 0 0 0 0 0 0 0 0 0 0 0 0 3.1320 0.8610 3.0210 C 0 0 0 0 0 0 0 0 0 0 0 0 1.6880 -2.7720 -3.2760 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5450 -2.6480 -4.1240 O 0 0 0 0 0 0 0 0 0 0 0 0 0.9720 -3.9120 -3.2020 N 0 0 0 0 0 0 0 0 0 0 0 0 1.2310 -5.0010 -4.1480 C 0 0 3 0 0 0 0 0 0 0 0 0 2.2950 -5.0370 -4.3780 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7990 -6.3300 -3.5240 C 0 0 0 0 0 0 0 0 0 0 0 0 1.7390 -6.6170 -2.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 1.0620 -8.1870 -1.3920 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.4360 -8.0760 -1.2770 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.9970 -7.1940 -0.3730 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.3720 -7.0930 -0.2680 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.1850 -7.8740 -1.0670 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.6250 -8.7560 -1.9720 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.2500 -8.8540 -2.0800 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4120 -9.2910 -2.3560 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0020 -10.5860 -2.1010 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3230 -11.6000 -2.9850 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0540 -11.3180 -4.1240 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4640 -10.0220 -4.3790 C 0 0 0 0 0 0 0 0 0 0 0 0 2.1390 -9.0080 -3.4970 C 0 0 0 0 0 0 0 0 0 0 0 0 1.6490 -8.4960 -0.0390 C 0 0 0 0 0 0 0 0 0 0 0 0 2.9220 -8.0610 0.2790 C 0 0 0 0 0 0 0 0 0 0 0 0 3.4600 -8.3450 1.5200 C 0 0 0 0 0 0 0 0 0 0 0 0 2.7240 -9.0630 2.4440 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4510 -9.4980 2.1270 C 0 0 0 0 0 0 0 0 0 0 0 0 0.9110 -9.2100 0.8870 C 0 0 0 0 0 0 0 0 0 0 0 0 0.4500 -4.7630 -5.4140 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.2510 -3.7840 -5.5170 O 0 0 0 0 0 0 0 0 0 0 0 0 0.5330 -5.6390 -6.4280 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.2470 -5.3450 -7.6180 C 0 0 0 0 0 0 0 0 0 0 0 0 4.8660 0.9200 -3.8570 H 0 0 0 0 0 0 0 0 0 0 0 0 3.2990 1.2290 -4.6420 H 0 0 0 0 0 0 0 0 0 0 0 0 3.6000 1.8230 -2.9920 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3440 0.3490 -3.0100 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7920 -2.9320 -0.6110 H 0 0 0 0 0 0 0 0 0 0 0 0 3.1940 -1.9610 -1.1190 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2410 -2.2020 2.0220 H 0 0 0 0 0 0 0 0 0 0 0 0 3.6440 -1.2310 1.5130 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6010 -1.3000 3.5670 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1640 0.2890 5.3960 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6260 2.2470 5.7020 H 0 0 0 0 0 0 0 0 0 0 0 0 3.5250 2.6140 4.1790 H 0 0 0 0 0 0 0 0 0 0 0 0 3.9670 1.0200 2.3550 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2860 -4.0120 -2.5240 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2660 -6.2950 -3.2940 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9910 -7.1410 -4.2280 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3610 -6.5840 0.2510 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.8100 -6.4040 0.4400 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.2590 -7.7960 -0.9840 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.2600 -9.3660 -2.5960 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8120 -9.5400 -2.7900 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4300 -10.8070 -1.2120 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0030 -12.6120 -2.7860 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3060 -12.1090 -4.8140 H 0 0 0 0 0 0 0 0 0 0 0 0 3.0360 -9.8020 -5.2680 H 0 0 0 0 0 0 0 0 0 0 0 0 2.4560 -7.9960 -3.6980 H 0 0 0 0 0 0 0 0 0 0 0 0 3.4960 -7.5000 -0.4430 H 0 0 0 0 0 0 0 0 0 0 0 0 4.4540 -8.0060 1.7680 H 0 0 0 0 0 0 0 0 0 0 0 0 3.1440 -9.2860 3.4140 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8760 -10.0590 2.8490 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0850 -9.5460 0.6400 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.3040 -5.2980 -7.3570 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0680 -4.3870 -8.0310 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0900 -6.1300 -8.3580 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 46 1 0 0 0 0 1 47 1 0 0 0 0 1 48 1 0 0 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