ANALYTICONDISCOVERY-ZINC04221466 MOE2007 3D CORINA 3.40 0006 02.08.2006 78 82 0 0 1 0 0 0 0 0999 V2000 1.9840 -2.9630 -0.3770 C 0 0 0 0 0 0 0 0 0 0 0 0 2.1470 -1.7160 0.3740 N 0 0 0 0 0 0 0 0 0 0 0 0 2.4310 -1.6190 1.6950 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5070 -0.3100 2.0330 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2620 0.4450 0.8820 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0440 -0.4460 -0.1480 C 0 0 0 0 0 0 0 0 0 0 0 0 1.7520 -0.1030 -1.5440 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4770 -0.9800 -2.3410 O 0 0 0 0 0 0 0 0 0 0 0 0 1.7890 1.1840 -1.9430 N 0 0 0 0 0 0 0 0 0 0 0 0 1.3910 1.5380 -3.3080 C 0 0 3 0 0 0 0 0 0 0 0 0 0.5850 0.8930 -3.6580 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9850 3.0330 -3.3980 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2710 3.3810 -4.8740 C 0 0 3 0 0 0 0 0 0 0 0 0 0.3520 3.3130 -5.4560 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2510 2.4040 -5.3710 N 0 0 0 0 0 0 0 0 0 0 0 0 2.6030 1.4860 -4.2710 C 0 0 0 0 0 0 0 0 0 0 0 0 2.7440 2.3540 -6.6240 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3090 3.0980 -7.4770 O 0 0 0 0 0 0 0 0 0 0 0 0 3.8370 1.3730 -6.9650 C 0 0 3 0 0 0 0 0 0 0 0 0 4.5870 1.3760 -6.1740 H 0 0 0 0 0 0 0 0 0 0 0 0 3.2400 -0.0300 -7.0960 C 0 0 0 0 0 0 0 0 0 0 0 0 4.3490 -1.0250 -7.4430 C 0 0 0 0 0 0 0 0 0 0 0 0 5.0010 -0.6220 -8.7660 C 0 0 0 0 0 0 0 0 0 0 0 0 5.5980 0.7800 -8.6350 C 0 0 0 0 0 0 0 0 0 0 0 0 4.4890 1.7760 -8.2890 C 0 0 3 0 0 0 0 0 0 0 0 0 3.7390 1.7730 -9.0790 H 0 0 0 0 0 0 0 0 0 0 0 0 5.0770 3.1580 -8.1590 C 0 0 0 0 0 0 0 0 0 0 0 0 5.4240 3.5690 -7.0720 O 0 0 0 0 0 0 0 0 0 0 0 0 5.2170 3.9360 -9.2500 N 0 0 0 0 0 0 0 0 0 0 0 0 4.7520 3.6020 -10.6090 C 0 0 0 0 0 0 0 0 0 0 0 0 5.6490 4.4400 -11.5530 C 0 0 3 0 0 0 0 0 0 0 0 0 6.6130 3.9560 -11.7070 H 0 0 0 0 0 0 0 0 0 0 0 0 5.8100 5.7550 -10.7440 C 0 0 0 0 0 0 0 0 0 0 0 0 5.8540 5.2600 -9.2820 C 0 0 3 0 0 0 0 0 0 0 0 0 6.8900 5.1810 -8.9510 H 0 0 0 0 0 0 0 0 0 0 0 0 5.1000 6.2140 -8.3920 C 0 0 0 0 0 0 0 0 0 0 0 0 4.1250 5.8330 -7.7880 O 0 0 0 0 0 0 0 0 0 0 0 0 4.9780 4.6890 -12.8310 N 0 0 0 0 0 0 0 0 0 0 0 0 5.0730 3.7870 -13.8280 C 0 0 0 0 0 0 0 0 0 0 0 0 5.7140 2.7700 -13.6670 O 0 0 0 0 0 0 0 0 0 0 0 0 4.3840 4.0420 -15.1440 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5290 2.9800 -16.2350 C 0 0 0 0 0 0 0 0 0 0 0 0 5.2660 4.3150 -16.3630 C 0 0 0 0 0 0 0 0 0 0 0 0 1.8370 4.7740 -4.9720 C 0 0 0 0 0 0 0 0 0 0 0 0 2.9450 4.9460 -5.4230 O 0 0 0 0 0 0 0 0 0 0 0 0 0.9430 -3.2830 -0.3270 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2650 -2.8010 -1.4170 H 0 0 0 0 0 0 0 0 0 0 0 0 2.6220 -3.7340 0.0560 H 0 0 0 0 0 0 0 0 0 0 0 0 2.5740 -2.4510 2.3690 H 0 0 0 0 0 0 0 0 0 0 0 0 2.7190 0.0820 3.0170 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2490 1.5230 0.8120 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0790 1.8750 -1.3280 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0740 3.1600 -3.1700 H 0 0 0 0 0 0 0 0 0 0 0 0 1.5990 3.6400 -2.7330 H 0 0 0 0 0 0 0 0 0 0 0 0 3.5050 1.8300 -3.7650 H 0 0 0 0 0 0 0 0 0 0 0 0 2.7420 0.4740 -4.6510 H 0 0 0 0 0 0 0 0 0 0 0 0 2.7750 -0.3170 -6.1530 H 0 0 0 0 0 0 0 0 0 0 0 0 2.4900 -0.0330 -7.8870 H 0 0 0 0 0 0 0 0 0 0 0 0 5.0990 -1.0230 -6.6520 H 0 0 0 0 0 0 0 0 0 0 0 0 3.9240 -2.0250 -7.5360 H 0 0 0 0 0 0 0 0 0 0 0 0 5.7910 -1.3320 -9.0130 H 0 0 0 0 0 0 0 0 0 0 0 0 4.2510 -0.6250 -9.5570 H 0 0 0 0 0 0 0 0 0 0 0 0 6.3480 0.7830 -7.8440 H 0 0 0 0 0 0 0 0 0 0 0 0 6.0630 1.0680 -9.5780 H 0 0 0 0 0 0 0 0 0 0 0 0 4.8840 2.5380 -10.8050 H 0 0 0 0 0 0 0 0 0 0 0 0 3.7060 3.8830 -10.7310 H 0 0 0 0 0 0 0 0 0 0 0 0 6.7380 6.2610 -11.0100 H 0 0 0 0 0 0 0 0 0 0 0 0 4.9530 6.4100 -10.8990 H 0 0 0 0 0 0 0 0 0 0 0 0 4.4660 5.5020 -12.9600 H 0 0 0 0 0 0 0 0 0 0 0 0 3.4340 4.5730 -15.0810 H 0 0 0 0 0 0 0 0 0 0 0 0 5.1240 2.0970 -16.0030 H 0 0 0 0 0 0 0 0 0 0 0 0 3.6750 2.8130 -16.8920 H 0 0 0 0 0 0 0 0 0 0 0 0 4.8970 5.0250 -17.1030 H 0 0 0 0 0 0 0 0 0 0 0 0 6.3460 4.3090 -16.2140 H 0 0 0 0 0 0 0 0 0 0 0 0 5.5100 7.4860 -8.2710 O 0 0 0 0 0 0 0 0 0 0 0 0 1.1110 5.8240 -4.5580 O 0 0 0 0 0 0 0 0 0 0 0 0 1.5160 6.6980 -4.6410 H 0 0 0 0 0 0 0 0 0 0 0 0 4.9930 8.0600 -7.6890 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 0 0 2 3 1 0 0 0 0 2 6 1 0 0 0 0 3 4 2 0 0 0 0 3 49 1 0 0 0 0 4 5 1 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