IBS-ZINC04729003 MOE2007 3D CORINA 3.40 0006 02.08.2006 46 49 0 0 0 0 0 0 0 0999 V2000 -0.0170 1.4250 0.0100 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0020 -0.0040 0.0020 O 0 0 0 0 0 0 0 0 0 0 0 0 0.6260 -0.6190 1.0420 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2070 0.1420 2.0480 C 0 0 0 0 0 0 0 0 0 0 0 0 1.8440 -0.4740 3.1090 C 0 0 0 0 0 0 0 0 0 0 0 0 1.9070 -1.8560 3.1760 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3230 -2.6300 2.1640 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6760 -2.0000 1.0980 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3850 -4.1010 2.2270 C 0 0 0 0 0 0 0 0 0 0 0 0 1.9830 -4.6830 3.2220 N 0 0 0 0 0 0 0 0 0 0 0 0 2.0420 -6.0810 3.2820 N 0 0 0 0 0 0 0 0 0 0 0 0 2.6780 -6.7000 4.3410 C 0 0 0 0 0 0 0 0 0 0 0 0 2.7480 -8.1050 4.4190 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2890 -9.1680 3.6110 C 0 0 0 0 0 0 0 0 0 0 0 0 2.6380 -10.2930 4.1700 N 0 0 0 0 0 0 0 0 0 0 0 0 3.3350 -10.0340 5.3570 N 0 0 0 0 0 0 0 0 0 0 0 0 3.4090 -8.6800 5.5220 C 0 0 0 0 0 0 0 0 0 0 0 0 3.9400 -7.8770 6.4420 N 0 0 0 0 0 0 0 0 0 0 0 0 3.8490 -6.5700 6.3260 C 0 0 0 0 0 0 0 0 0 0 0 0 3.2430 -5.9850 5.3080 N 0 0 0 0 0 0 0 0 0 0 0 0 3.8640 -10.9970 6.2250 C 0 0 0 0 0 0 0 0 0 0 0 0 3.1980 -12.2000 6.4190 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7230 -13.1480 7.2760 C 0 0 0 0 0 0 0 0 0 0 0 0 4.9090 -12.8990 7.9410 C 0 0 0 0 0 0 0 0 0 0 0 0 5.5740 -11.7020 7.7510 C 0 0 0 0 0 0 0 0 0 0 0 0 5.0590 -10.7530 6.8900 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5340 -2.4600 4.2190 O 0 0 0 0 0 0 0 0 0 0 0 0 3.1060 -1.6080 5.2130 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0050 1.8020 0.0020 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5440 1.7860 -0.8730 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5280 1.7760 0.9070 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1620 1.2200 2.0020 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2930 0.1230 3.8880 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2200 -2.5900 0.3170 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9340 -4.6950 1.4460 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6370 -6.6150 2.5810 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7400 -9.0670 2.6870 H 0 0 0 0 0 0 0 0 0 0 0 0 4.2900 -5.9500 7.0920 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2710 -12.3950 5.9000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.2050 -14.0840 7.4270 H 0 0 0 0 0 0 0 0 0 0 0 0 5.3170 -13.6420 8.6110 H 0 0 0 0 0 0 0 0 0 0 0 0 6.5010 -11.5110 8.2720 H 0 0 0 0 0 0 0 0 0 0 0 0 5.5810 -9.8200 6.7380 H 0 0 0 0 0 0 0 0 0 0 0 0 3.5740 -2.2160 5.9870 H 0 0 0 0 0 0 0 0 0 0 0 0 3.8570 -0.9660 4.7520 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3250 -0.9920 5.6580 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 29 1 0 0 0 0 1 30 1 0 0 0 0 1 31 1 0 0 0 0 2 3 1 0 0 0 0 3 4 1 0 0 0 0 3 8 2 0 0 0 0 4 5 2 0 0 0 0 4 32 1 0 0 0 0 5 6 1 0 0 0 0 5 33 1 0 0 0 0 6 7 2 0 0 0 0 6 27 1 0 0 0 0 7 8 1 0 0 0 0 7 9 1 0 0 0 0 8 34 1 0 0 0 0 9 10 2 0 0 0 0 9 35 1 0 0 0 0 10 11 1 0 0 0 0 11 12 1 0 0 0 0 11 36 1 0 0 0 0 12 13 1 0 0 0 0 12 20 2 0 0 0 0 13 14 1 0 0 0 0 13 17 2 0 0 0 0 14 15 2 0 0 0 0 14 37 1 0 0 0 0 15 16 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 18 19 2 0 0 0 0 19 20 1 0 0 0 0 19 38 1 0 0 0 0 21 22 1 0 0 0 0 21 26 2 0 0 0 0 22 23 2 0 0 0 0 22 39 1 0 0 0 0 23 24 1 0 0 0 0 23 40 1 0 0 0 0 24 25 2 0 0 0 0 24 41 1 0 0 0 0 25 26 1 0 0 0 0 25 42 1 0 0 0 0 26 43 1 0 0 0 0 27 28 1 0 0 0 0 28 44 1 0 0 0 0 28 45 1 0 0 0 0 28 46 1 0 0 0 0 M END