NCID-ZINC05441089 MOE2007 3D CORINA 3.40 0006 02.08.2006 83 85 0 0 1 0 0 0 0 0999 V2000 -0.0190 1.5260 0.0100 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0020 -0.0040 0.0020 C 0 0 3 0 0 0 0 0 0 0 0 0 -1.0200 -0.3820 0.0100 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7430 -0.5110 1.2420 C 0 0 3 0 0 0 0 0 0 0 0 0 1.7530 -0.1020 1.2560 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8120 -2.0410 1.1960 C 0 0 3 0 0 0 0 0 0 0 0 0 -0.1970 -2.4530 1.2320 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4950 -2.4710 -0.1060 C 0 0 3 0 0 0 0 0 0 0 0 0 1.4990 -3.5590 -0.1730 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7250 -1.8880 -1.2940 C 0 0 3 0 0 0 0 0 0 0 0 0 -0.2880 -2.2900 -1.3030 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6710 -0.4650 -1.1730 O 0 0 0 0 0 0 0 0 0 0 0 0 1.4050 -2.2480 -2.5410 N 0 0 0 0 0 0 0 0 0 0 0 0 0.6660 -2.5100 -3.6810 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3010 -2.8570 -4.8860 C 0 0 0 0 0 0 0 0 0 0 0 0 0.4980 -3.1120 -6.0100 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3620 -3.4220 -7.0300 N 0 0 0 0 0 0 0 0 0 0 0 0 2.6280 -3.3520 -6.5290 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5900 -3.0200 -5.2710 N 0 0 0 0 0 0 0 0 0 0 0 0 1.1170 -3.6490 -7.9400 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8230 -3.0180 -5.8950 N 0 0 0 0 0 0 0 0 0 0 0 0 -1.3740 -2.6900 -4.7460 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.6610 -2.4460 -3.6610 N 0 0 0 0 0 0 0 0 0 0 0 0 2.8390 -1.9870 -0.1230 O 0 0 0 0 0 0 0 0 0 0 0 0 1.5640 -2.5200 2.3130 O 0 0 0 0 0 0 0 0 0 0 0 0 0.0260 -0.0890 2.4480 N 0 0 0 0 0 0 0 0 0 0 0 0 0.2520 1.1320 2.9720 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0480 1.8810 2.4460 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.4860 1.5670 4.2130 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0500 2.9830 4.5950 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.7980 3.4240 5.8550 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.3620 4.8400 6.2370 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.1100 5.2810 7.4960 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.6740 6.6970 7.8790 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4230 7.1380 9.1380 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.9860 8.5540 9.5210 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.7350 8.9960 10.7800 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.2990 10.4110 11.1630 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.0470 10.8530 12.4220 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.6110 12.2680 12.8050 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.3590 12.7100 14.0640 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.9430 11.8260 15.2420 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.0180 14.1680 14.3760 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0040 1.9030 0.0030 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5460 1.8870 -0.8730 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5290 1.8770 0.9070 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3730 -2.3020 -2.5670 H 0 0 0 0 0 0 0 0 0 0 0 0 3.5290 -3.5440 -7.0920 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.4500 -2.6220 -4.6860 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3320 -2.2230 -0.9200 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6480 -3.4820 2.3470 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6100 -0.6880 2.8680 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.5590 1.5570 4.0200 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2570 0.8830 5.0300 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0230 2.9930 4.7880 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2780 3.6670 3.7780 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.8710 3.4140 5.6620 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5690 2.7400 6.6720 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7110 4.8500 6.4300 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5900 5.5240 5.4200 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.1830 5.2710 7.3040 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8820 4.5970 8.3140 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3990 6.7070 8.0720 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9030 7.3810 7.0620 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.4950 7.1280 8.9460 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1940 6.4540 9.9560 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0860 8.5640 9.7140 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2150 9.2380 8.7040 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.8080 8.9860 10.5880 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.5060 8.3110 11.5980 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2260 10.4210 11.3560 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.5270 11.0950 10.3460 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.1200 10.8430 12.2300 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.8180 10.1680 13.2400 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5380 12.2780 12.9980 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.8400 12.9520 11.9880 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.4330 12.6150 13.9010 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.1860 10.7870 15.0200 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8690 11.9200 15.4050 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.4760 12.1400 16.1390 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.3140 14.7980 13.5370 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.5510 14.4830 15.2730 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9440 14.2630 14.5390 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 3 1 0 0 0 0 2 4 1 0 0 0 0 2 12 1 0 0 0 0 4 5 1 0 0 0 0 4 6 1 0 0 0 0 4 26 1 0 0 0 0 6 7 1 0 0 0 0 6 8 1 0 0 0 0 6 25 1 0 0 0 0 8 9 1 0 0 0 0 8 10 1 0 0 0 0 8 24 1 0 0 0 0 10 11 1 0 0 0 0 10 12 1 0 0 0 0 10 13 1 0 0 0 0 13 14 1 0 0 0 0 13 47 1 0 0 0 0 14 15 1 0 0 0 0 14 23 2 0 0 0 0 15 16 2 0 0 0 0 15 19 1 0 0 0 0 16 17 1 0 0 0 0 16 21 1 0 0 0 0 17 18 1 0 0 0 0 17 20 1 0 0 0 0 18 19 2 0 0 0 0 18 48 1 0 0 0 0 21 22 2 0 0 0 0 22 23 1 0 0 0 0 22 49 1 0 0 0 0 24 50 1 0 0 0 0 25 51 1 0 0 0 0 26 27 1 0 0 0 0 26 52 1 0 0 0 0 27 28 2 0 0 0 0 27 29 1 0 0 0 0 29 30 1 0 0 0 0 29 53 1 0 0 0 0 29 54 1 0 0 0 0 30 31 1 0 0 0 0 30 55 1 0 0 0 0 30 56 1 0 0 0 0 31 32 1 0 0 0 0 31 57 1 0 0 0 0 31 58 1 0 0 0 0 32 33 1 0 0 0 0 32 59 1 0 0 0 0 32 60 1 0 0 0 0 33 34 1 0 0 0 0 33 61 1 0 0 0 0 33 62 1 0 0 0 0 34 35 1 0 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