NCID-ZINC05542229 MOE2007 3D CORINA 3.40 0006 02.08.2006 80 84 0 0 0 0 0 0 0 0999 V2000 0.3720 2.2100 0.1900 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2860 0.6830 0.1680 C 0 0 0 0 0 0 0 0 0 0 0 0 0.9820 0.1230 1.3820 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3890 -0.2180 2.5560 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3880 -0.6940 3.4270 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1440 -1.1320 4.7230 C 0 0 0 0 0 0 0 0 0 0 0 0 2.1510 -1.5860 5.5790 C 0 0 0 0 0 0 0 0 0 0 0 0 3.4590 -1.6800 5.3300 N 0 0 0 0 0 0 0 0 0 0 0 0 4.0990 -2.1500 6.4000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.4690 -2.3930 6.5500 C 0 0 0 0 0 0 0 0 0 0 0 0 6.3870 -2.1920 5.5270 C 0 0 0 0 0 0 0 0 0 0 0 0 7.7790 -2.4520 5.6540 C 0 0 0 0 0 0 0 0 0 0 0 0 8.3700 -2.1400 4.4410 C 0 0 0 0 0 0 0 0 0 0 0 0 7.3580 -1.6880 3.5770 C 0 0 0 0 0 0 0 0 0 0 0 0 6.1620 -1.7260 4.2580 N 0 0 0 0 0 0 0 0 0 0 0 0 5.2990 -1.4670 3.8970 H 0 0 0 0 0 0 0 0 0 0 0 0 7.5900 -1.2850 2.2680 C 0 0 0 0 0 0 0 0 0 0 0 0 6.5840 -0.8150 1.4170 C 0 0 0 0 0 0 0 0 0 0 0 0 5.2840 -0.6850 1.6780 N 0 0 0 0 0 0 0 0 0 0 0 0 4.6470 -0.1950 0.6140 C 0 0 0 0 0 0 0 0 0 0 0 0 3.2810 0.0860 0.4840 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3600 -0.1450 1.4960 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5900 -0.6380 2.7610 N 0 0 0 0 0 0 0 0 0 0 0 0 3.4520 -0.9040 3.1190 H 0 0 0 0 0 0 0 0 0 0 0 0 5.6300 0.0160 -0.4580 C 0 0 0 0 0 0 0 0 0 0 0 0 6.8260 -0.3690 0.0370 C 0 0 0 0 0 0 0 0 0 0 0 0 8.1500 -0.3450 -0.6830 C 0 0 0 0 0 0 0 0 0 0 0 0 8.8880 0.9530 -0.3510 C 0 0 0 0 0 0 0 0 0 0 0 0 5.3570 0.5550 -1.8380 C 0 0 0 0 0 0 0 0 0 0 0 0 9.8340 -2.2640 4.1070 C 0 0 0 0 0 0 0 0 0 0 0 0 8.4660 -2.9600 6.8550 C 0 0 0 0 0 0 0 0 0 0 0 0 8.5950 -4.1560 7.0220 O 0 0 0 0 0 0 0 0 0 0 0 0 5.9730 -2.8940 7.8880 C 0 0 0 0 0 0 0 0 0 0 0 0 6.3650 -1.7200 8.7480 C 0 0 0 0 0 0 0 0 0 0 0 0 6.2480 -0.5940 8.3240 O 0 0 0 0 0 0 0 0 0 0 0 0 3.1090 -2.3960 7.4610 C 0 0 0 0 0 0 0 0 0 0 0 0 1.9080 -2.0500 6.9540 C 0 0 0 0 0 0 0 0 0 0 0 0 0.5780 -2.1240 7.6570 C 0 0 0 0 0 0 0 0 0 0 0 0 3.3840 -2.9300 8.8430 C 0 0 0 0 0 0 0 0 0 0 0 0 3.4170 -4.4590 8.8020 C 0 0 0 0 0 0 0 0 0 0 0 0 3.5960 -4.9960 10.1980 C 0 0 0 0 0 0 0 0 0 0 0 0 3.6880 -4.2330 11.1310 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.0810 -0.1060 2.8720 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4180 2.5150 0.1820 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1320 2.6150 -0.6880 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1100 2.5880 1.0920 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7610 0.3780 0.1760 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7670 0.3050 -0.7340 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1180 -1.1240 5.0890 H 0 0 0 0 0 0 0 0 0 0 0 0 8.6080 -1.3410 1.8830 H 0 0 0 0 0 0 0 0 0 0 0 0 2.9250 0.5040 -0.4560 H 0 0 0 0 0 0 0 0 0 0 0 0 8.7520 -1.1960 -0.3660 H 0 0 0 0 0 0 0 0 0 0 0 0 7.9790 -0.4010 -1.7580 H 0 0 0 0 0 0 0 0 0 0 0 0 8.2860 1.8050 -0.6680 H 0 0 0 0 0 0 0 0 0 0 0 0 9.0580 1.0090 0.7240 H 0 0 0 0 0 0 0 0 0 0 0 0 9.8450 0.9710 -0.8720 H 0 0 0 0 0 0 0 0 0 0 0 0 4.2950 0.7760 -1.9390 H 0 0 0 0 0 0 0 0 0 0 0 0 5.9340 1.4660 -1.9930 H 0 0 0 0 0 0 0 0 0 0 0 0 5.6460 -0.1880 -2.5820 H 0 0 0 0 0 0 0 0 0 0 0 0 10.0320 -3.2570 3.7040 H 0 0 0 0 0 0 0 0 0 0 0 0 10.1030 -1.5110 3.3670 H 0 0 0 0 0 0 0 0 0 0 0 0 10.4260 -2.1140 5.0100 H 0 0 0 0 0 0 0 0 0 0 0 0 5.1860 -3.4610 8.3840 H 0 0 0 0 0 0 0 0 0 0 0 0 6.8410 -3.5350 7.7320 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2080 -1.7760 6.9870 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3770 -3.1560 7.9470 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6010 -1.4950 8.5470 H 0 0 0 0 0 0 0 0 0 0 0 0 4.3460 -2.5550 9.1930 H 0 0 0 0 0 0 0 0 0 0 0 0 2.5970 -2.6020 9.5220 H 0 0 0 0 0 0 0 0 0 0 0 0 2.4810 -4.8320 8.3860 H 0 0 0 0 0 0 0 0 0 0 0 0 4.2480 -4.7880 8.1770 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.5830 -1.0330 2.5960 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2100 0.0750 3.9390 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.5110 0.7220 2.3080 H 0 0 0 0 0 0 0 0 0 0 0 0 8.9520 -2.0960 7.7690 O 0 0 0 0 0 0 0 0 0 0 0 0 6.8430 -1.9250 9.9850 O 0 0 0 0 0 0 0 0 0 0 0 0 3.6540 -6.3210 10.4060 O 0 0 0 0 0 0 0 0 0 0 0 0 3.7700 -6.6170 11.3190 H 0 0 0 0 0 0 0 0 0 0 0 0 7.0800 -1.1410 10.4990 H 0 0 0 0 0 0 0 0 0 0 0 0 9.3940 -2.4760 8.5400 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 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 2 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