IBS-ZINC04870514 MOE2007 3D CORINA 3.40 0006 02.08.2006 52 55 0 0 1 0 0 0 0 0999 V2000 -2.9600 1.1650 1.4400 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.9660 -0.3590 1.5670 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.3280 -0.9350 0.4260 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.2490 -2.2890 0.3810 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.6400 -2.9120 -0.7030 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.5570 -4.2850 -0.7520 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.0870 -5.0540 0.2910 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.6990 -4.4210 1.3800 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.7720 -3.0480 1.4230 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.0010 -6.5220 0.2430 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.1040 -7.2700 0.4580 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.7920 -7.1350 -0.0230 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.5680 -8.5040 -0.2270 C 0 0 0 0 0 0 0 0 0 0 0 0 0.8840 -8.7050 -0.4790 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4110 -9.7780 -0.6950 O 0 0 0 0 0 0 0 0 0 0 0 0 1.5270 -7.5260 -0.4350 N 0 0 0 0 0 0 0 0 0 0 0 0 0.5560 -6.4640 -0.1580 C 0 0 3 0 0 0 0 0 0 0 0 0 0.5360 -5.7500 -0.9810 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9150 -5.7630 1.1260 C 0 0 0 0 0 0 0 0 0 0 0 0 0.8650 -4.3830 1.1980 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1940 -3.7400 2.3760 C 0 0 0 0 0 0 0 0 0 0 0 0 1.5730 -4.4760 3.4830 C 0 0 0 0 0 0 0 0 0 0 0 0 1.6220 -5.8560 3.4120 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2890 -6.4990 2.2350 C 0 0 0 0 0 0 0 0 0 0 0 0 1.9330 -3.7750 4.7680 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8900 -7.3440 -0.6260 C 0 0 0 0 0 0 0 0 0 0 0 0 3.6540 -8.3960 -0.8760 N 0 0 0 0 0 0 0 0 0 0 0 0 4.9560 -8.2560 -1.0640 C 0 0 0 0 0 0 0 0 0 0 0 0 5.5170 -6.9910 -0.9960 C 0 0 0 0 0 0 0 0 0 0 0 0 4.6880 -5.9120 -0.7320 C 0 0 0 0 0 0 0 0 0 0 0 0 3.3930 -6.1200 -0.5600 N 0 0 0 0 0 0 0 0 0 0 0 0 -1.4160 -9.3780 -0.2010 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.4470 1.6040 2.3110 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.9320 1.5210 1.3810 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.4980 1.4570 0.5380 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.4280 -0.6510 2.4700 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.9950 -0.7150 1.6270 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2320 -2.3180 -1.5070 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0840 -4.7680 -1.5950 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.1090 -5.0100 2.1870 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.2390 -2.5590 2.2640 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5690 -3.8080 0.3330 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1560 -2.6620 2.4320 H 0 0 0 0 0 0 0 0 0 0 0 0 1.9190 -6.4310 4.2760 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3240 -7.5770 2.1800 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0390 -3.6560 5.3800 H 0 0 0 0 0 0 0 0 0 0 0 0 2.6690 -4.3670 5.3110 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3510 -2.7940 4.5410 H 0 0 0 0 0 0 0 0 0 0 0 0 5.5740 -9.1180 -1.2670 H 0 0 0 0 0 0 0 0 0 0 0 0 6.5770 -6.8490 -1.1450 H 0 0 0 0 0 0 0 0 0 0 0 0 5.0930 -4.9130 -0.6730 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.9500 -8.2230 0.4060 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 33 1 0 0 0 0 1 34 1 0 0 0 0 1 35 1 0 0 0 0 2 3 1 0 0 0 0 2 36 1 0 0 0 0 2 37 1 0 0 0 0 3 4 1 0 0 0 0 4 5 1 0 0 0 0 4 9 2 0 0 0 0 5 6 2 0 0 0 0 5 38 1 0 0 0 0 6 7 1 0 0 0 0 6 39 1 0 0 0 0 7 8 2 0 0 0 0 7 10 1 0 0 0 0 8 9 1 0 0 0 0 8 40 1 0 0 0 0 9 41 1 0 0 0 0 10 11 1 0 0 0 0 10 12 2 0 0 0 0 11 52 1 0 0 0 0 12 13 1 0 0 0 0 12 17 1 0 0 0 0 13 14 1 0 0 0 0 13 32 2 0 0 0 0 14 15 2 0 0 0 0 14 16 1 0 0 0 0 16 17 1 0 0 0 0 16 26 1 0 0 0 0 17 18 1 0 0 0 0 17 19 1 0 0 0 0 19 20 1 0 0 0 0 19 24 2 0 0 0 0 20 21 2 0 0 0 0 20 42 1 0 0 0 0 21 22 1 0 0 0 0 21 43 1 0 0 0 0 22 23 2 0 0 0 0 22 25 1 0 0 0 0 23 24 1 0 0 0 0 23 44 1 0 0 0 0 24 45 1 0 0 0 0 25 46 1 0 0 0 0 25 47 1 0 0 0 0 25 48 1 0 0 0 0 26 27 1 0 0 0 0 26 31 2 0 0 0 0 27 28 2 0 0 0 0 28 29 1 0 0 0 0 28 49 1 0 0 0 0 29 30 2 0 0 0 0 29 50 1 0 0 0 0 30 31 1 0 0 0 0 30 51 1 0 0 0 0 M END