IBS-ZINC01269531 MOE2007 3D CORINA 3.40 0006 02.08.2006 53 56 0 0 0 0 0 0 0 0999 V2000 -0.1310 0.6300 -1.1850 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1680 -0.7960 -0.8510 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.0560 -1.2000 0.4690 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0950 -2.5600 0.7590 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.2460 -3.4820 -0.2920 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.2820 -4.6780 -0.0610 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.3500 -3.0280 -1.5580 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.3160 -1.7120 -1.8270 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.4180 -1.3390 -2.9800 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.5070 -3.9850 -2.6570 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0380 -2.6700 2.1370 N 0 0 0 0 0 0 0 0 0 0 0 0 0.1490 -1.4050 2.6220 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0910 -0.5470 1.6230 N 0 0 0 0 0 0 0 0 0 0 0 0 0.2980 -1.0720 3.9480 N 0 0 0 0 0 0 0 0 0 0 0 0 0.2840 0.3350 4.3570 C 0 0 0 0 0 0 0 0 0 0 0 0 0.4670 0.4280 5.8730 C 0 0 0 0 0 0 0 0 0 0 0 0 0.4520 1.8750 6.2930 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.7420 2.4830 6.6320 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.7580 3.8100 7.0180 C 0 0 0 0 0 0 0 0 0 0 0 0 0.4250 4.5320 7.0640 C 0 0 0 0 0 0 0 0 0 0 0 0 1.6220 3.9200 6.7220 C 0 0 0 0 0 0 0 0 0 0 0 0 1.6340 2.5910 6.3430 C 0 0 0 0 0 0 0 0 0 0 0 0 0.4120 5.8370 7.4420 O 0 0 0 0 0 0 0 0 0 0 0 0 0.0540 -3.9100 2.9170 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.3620 -4.3520 3.1870 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.0050 -5.1900 2.2960 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.3030 -5.5970 2.5430 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.9590 -5.1640 3.6830 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.3150 -4.3250 4.5740 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.0140 -3.9230 4.3290 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.2030 -2.8760 5.4510 Cl 0 0 0 0 0 0 0 0 0 0 0 0 -5.5890 -5.6740 3.9930 Cl 0 0 0 0 0 0 0 0 0 0 0 0 0.9000 0.9330 -1.3700 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7280 0.8100 -2.0790 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5360 1.2090 -0.3550 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.5670 -4.1720 -2.8270 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0600 -3.5750 -3.5620 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0100 -4.9200 -2.3980 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4120 -1.7690 4.6130 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0950 0.8660 3.8590 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6700 0.7840 4.0780 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3440 -0.1030 6.3700 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4200 -0.0220 6.1510 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.6630 1.9200 6.5960 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.6920 4.2840 7.2820 H 0 0 0 0 0 0 0 0 0 0 0 0 2.5450 4.4800 6.7570 H 0 0 0 0 0 0 0 0 0 0 0 0 2.5660 2.1130 6.0820 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5240 5.9720 8.3930 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5760 -4.6850 2.3570 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5670 -3.7370 3.8630 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.4940 -5.5280 1.4070 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.8060 -6.2520 1.8470 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.8260 -3.9870 5.4630 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 8 1 0 0 0 0 3 4 2 0 0 0 0 3 13 1 0 0 0 0 4 5 1 0 0 0 0 4 11 1 0 0 0 0 5 6 2 0 0 0 0 5 7 1 0 0 0 0 7 8 1 0 0 0 0 7 10 1 0 0 0 0 8 9 2 0 0 0 0 10 36 1 0 0 0 0 10 37 1 0 0 0 0 10 38 1 0 0 0 0 11 12 1 0 0 0 0 11 24 1 0 0 0 0 12 13 2 0 0 0 0 12 14 1 0 0 0 0 14 15 1 0 0 0 0 14 39 1 0 0 0 0 15 16 1 0 0 0 0 15 40 1 0 0 0 0 15 41 1 0 0 0 0 16 17 1 0 0 0 0 16 42 1 0 0 0 0 16 43 1 0 0 0 0 17 18 1 0 0 0 0 17 22 2 0 0 0 0 18 19 2 0 0 0 0 18 44 1 0 0 0 0 19 20 1 0 0 0 0 19 45 1 0 0 0 0 20 21 2 0 0 0 0 20 23 1 0 0 0 0 21 22 1 0 0 0 0 21 46 1 0 0 0 0 22 47 1 0 0 0 0 23 48 1 0 0 0 0 24 25 1 0 0 0 0 24 49 1 0 0 0 0 24 50 1 0 0 0 0 25 26 1 0 0 0 0 25 30 2 0 0 0 0 26 27 2 0 0 0 0 26 51 1 0 0 0 0 27 28 1 0 0 0 0 27 52 1 0 0 0 0 28 29 2 0 0 0 0 28 32 1 0 0 0 0 29 30 1 0 0 0 0 29 53 1 0 0 0 0 30 31 1 0 0 0 0 M END