PUBCHEM-ZINC06134929 MOE2007 3D CORINA 3.40 0006 02.08.2006 81 81 0 0 1 0 0 0 0 0999 V2000 0.5170 -1.0730 -0.9050 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.3390 -0.6430 0.2880 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.6640 -1.4070 0.2660 C 0 0 0 0 0 0 0 0 0 0 0 0 0.4060 -0.9510 1.5880 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.3790 -0.3830 2.7730 C 0 0 3 0 0 0 0 0 0 0 0 0 -1.4010 -0.7610 2.7460 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2800 -0.8060 4.0600 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6930 0.0310 4.8340 O 0 0 0 0 0 0 0 0 0 0 0 0 0.4090 -2.1160 4.3530 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.3960 1.0790 2.6910 N 0 0 0 0 0 0 0 0 0 0 0 0 -1.3720 1.7770 3.3050 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.1800 1.2020 4.0040 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.4600 3.2700 3.1240 C 0 0 3 0 0 0 0 0 0 0 0 0 -0.5180 3.7290 3.4250 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.7350 3.5900 1.6530 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.1320 3.0930 1.2750 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.4910 3.5960 -0.1250 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.1490 1.5630 1.2880 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.5480 3.8000 3.9500 N 0 0 0 0 0 0 0 0 0 0 0 0 -2.5510 5.0990 4.3080 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.7040 5.8500 3.8720 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.6070 5.6190 5.2490 C 0 0 3 0 0 0 0 0 0 0 0 0 -4.5670 5.1650 5.0040 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.2270 5.2630 6.6880 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.2820 5.6520 7.5690 O 0 0 0 0 0 0 0 0 0 0 0 0 -4.0270 5.3620 8.9450 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.1990 5.8120 9.7790 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.2440 4.9420 10.0290 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.3180 5.3550 10.7940 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.3480 6.6380 11.3090 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.3030 7.5070 11.0600 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.2260 7.0930 10.2980 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.7060 7.0740 5.1160 N 0 0 0 0 0 0 0 0 0 0 0 0 -2.6330 7.8490 5.3710 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.5830 7.3400 5.7110 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.7240 9.1870 5.2480 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.5290 9.9580 5.5380 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.4060 9.5340 4.5900 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.8240 11.4470 5.3460 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.0980 9.7060 6.9850 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7870 -2.1240 -0.7980 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0480 -0.9350 -1.8260 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4230 -0.4670 -0.9400 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5360 0.4280 0.2270 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.4680 -2.4770 0.3280 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.2740 -1.1000 1.1160 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.1950 -1.1870 -0.6600 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5070 -2.0300 1.7020 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3960 -0.4950 1.5560 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0780 -2.7860 3.7340 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8320 -2.3880 5.1820 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2940 1.5460 2.1940 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.6780 4.6680 1.4980 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9920 3.0940 1.0280 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.8580 3.4710 1.9940 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.7640 3.2180 -0.8440 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.4860 3.2420 -0.3940 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.4780 4.6860 -0.1340 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.1250 1.2080 2.3180 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.0580 1.2060 0.8020 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.2780 1.1850 0.7520 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.2660 3.2150 4.2390 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.0660 4.1880 6.7660 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.3120 5.7880 6.9630 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.8830 4.2890 9.0700 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.1280 5.8900 9.2670 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.2200 3.9400 9.6270 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.1350 4.6760 10.9890 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.1890 6.9600 11.9060 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.3270 8.5090 11.4620 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.4080 7.7710 10.1070 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.5440 7.4800 4.8450 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7130 9.7140 3.5600 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4920 10.1140 4.8080 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1950 8.4740 4.7270 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.6240 11.7490 6.0220 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9260 12.0260 5.5640 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.1310 11.6270 4.3160 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8880 8.6450 7.1220 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2000 10.2850 7.2020 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.8980 10.0080 7.6600 H 0 0 0 0 0 0 0 0 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