NCID-ZINC01857008 MOE2007 3D CORINA 3.40 0006 02.08.2006 77 82 0 0 0 0 0 0 0 0999 V2000 0.0640 0.7890 0.2290 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0070 0.4500 2.6260 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.2150 -1.0580 2.4970 C 0 0 0 0 0 0 0 0 0 0 0 0 0.4050 -1.7420 3.6350 N 0 0 0 0 0 0 0 0 0 0 0 0 0.3360 -3.0840 3.7340 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.2400 -3.7280 2.8780 O 0 0 0 0 0 0 0 0 0 0 0 0 0.9620 -3.7750 4.8820 C 0 0 0 0 0 0 0 0 0 0 0 0 1.7250 -3.0830 5.8110 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3000 -3.7780 6.8860 C 0 0 0 0 0 0 0 0 0 0 0 0 2.1420 -5.0740 7.0500 N 0 0 0 0 0 0 0 0 0 0 0 0 1.4240 -5.8180 6.2060 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7950 -5.2140 5.0880 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0390 -5.9960 4.2080 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0900 -7.3340 4.4380 C 0 0 0 0 0 0 0 0 0 0 0 0 0.5210 -7.9320 5.5370 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2720 -7.2020 6.4070 C 0 0 0 0 0 0 0 0 0 0 0 0 3.1140 -3.0260 7.8720 C 0 0 0 0 0 0 0 0 0 0 0 0 3.6970 -3.6910 8.9500 C 0 0 0 0 0 0 0 0 0 0 0 0 4.4530 -2.9860 9.8640 C 0 0 0 0 0 0 0 0 0 0 0 0 4.6330 -1.6230 9.7120 C 0 0 0 0 0 0 0 0 0 0 0 0 4.0570 -0.9580 8.6440 C 0 0 0 0 0 0 0 0 0 0 0 0 3.3040 -1.6540 7.7200 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.6320 2.5900 1.6900 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4980 3.2470 0.6140 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.5150 4.6970 0.8190 N 0 0 0 0 0 0 0 0 0 0 0 0 -2.2200 5.4880 -0.0150 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.8410 4.9970 -0.9370 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.2370 6.9520 0.1910 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4470 7.5530 1.1610 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4950 8.9460 1.3220 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.2660 9.7140 0.5820 N 0 0 0 0 0 0 0 0 0 0 0 0 -3.0570 9.2210 -0.3730 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.0820 7.8260 -0.6230 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.9090 7.3130 -1.6280 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.6810 8.1630 -2.3640 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.6570 9.5360 -2.1260 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.8720 10.0660 -1.1490 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.6460 9.5760 2.3620 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.6720 10.9580 2.5450 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1200 11.5380 3.5140 C 0 0 0 0 0 0 0 0 0 0 0 0 0.9390 10.7510 4.3040 C 0 0 0 0 0 0 0 0 0 0 0 0 0.9690 9.3800 4.1270 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1770 8.7880 3.1650 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0010 -0.2870 0.0670 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1110 1.0860 0.2880 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4160 1.3100 -0.5990 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4440 0.8050 3.5530 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0760 0.6600 2.6380 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2840 -1.2690 2.4850 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2360 -1.4140 1.5700 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8650 -1.2290 4.3180 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8760 -2.0180 5.7080 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4390 -5.5420 3.3530 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6740 -7.9370 3.7580 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4040 -8.9930 5.6980 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7400 -7.6820 7.2540 H 0 0 0 0 0 0 0 0 0 0 0 0 3.5560 -4.7550 9.0700 H 0 0 0 0 0 0 0 0 0 0 0 0 4.9060 -3.5000 10.6990 H 0 0 0 0 0 0 0 0 0 0 0 0 5.2260 -1.0750 10.4300 H 0 0 0 0 0 0 0 0 0 0 0 0 4.2010 0.1060 8.5310 H 0 0 0 0 0 0 0 0 0 0 0 0 2.8580 -1.1350 6.8850 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3850 2.9780 1.6250 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0430 2.8130 2.6750 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0870 3.0230 -0.3700 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.5150 2.8590 0.6800 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0190 5.0890 1.5550 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8020 6.9540 1.7860 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.9350 6.2510 -1.8210 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.3190 7.7680 -3.1400 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.2770 10.1890 -2.7220 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.8660 11.1320 -0.9770 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.3110 11.5730 1.9280 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1000 12.6080 3.6570 H 0 0 0 0 0 0 0 0 0 0 0 0 1.5580 11.2100 5.0610 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6110 8.7700 4.7470 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1980 7.7160 3.0310 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6150 1.1350 1.4850 N 0 0 0 0 0 0 0 0 0 0 0 0 1 44 1 0 0 0 0 1 45 1 0 0 0 0 1 46 1 0 0 0 0 1 77 1 0 0 0 0 2 3 1 0 0 0 0 2 47 1 0 0 0 0 2 48 1 0 0 0 0 2 77 1 0 0 0 0 3 4 1 0 0 0 0 3 49 1 0 0 0 0 3 50 1 0 0 0 0 4 5 1 0 0 0 0 4 51 1 0 0 0 0 5 6 2 0 0 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