IBS-ZINC04820205 MOE2007 3D CORINA 3.40 0006 02.08.2006 48 50 0 0 1 0 0 0 0 0999 V2000 2.1350 -5.8480 -2.0410 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4540 -4.6000 -2.1870 O 0 0 0 0 0 0 0 0 0 0 0 0 1.7000 -3.6750 -1.1260 C 0 0 0 0 0 0 0 0 0 0 0 0 0.9250 -2.3820 -1.3860 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.5130 -2.6590 -1.3520 N 0 0 0 0 0 0 0 0 0 0 0 0 -1.3280 -2.9350 -2.5350 C 0 0 3 0 0 0 0 0 0 0 0 0 -0.9600 -3.8280 -3.0410 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.7640 -3.1670 -2.0400 C 0 0 3 0 0 0 0 0 0 0 0 0 -2.6740 -3.0000 -0.5370 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.2470 -2.6960 -0.2320 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.8090 -2.5060 0.8830 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.5780 -3.0980 0.2580 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.2250 -4.5580 -2.3920 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.4210 -5.4620 -2.4670 O 0 0 0 0 0 0 0 0 0 0 0 0 -4.6510 -4.8190 -2.6430 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.0820 -6.1090 -2.9700 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.4190 -6.3460 -3.2030 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.3360 -5.3110 -3.1160 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.9160 -4.0300 -2.7930 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.5820 -3.7790 -2.5510 C 0 0 0 0 0 0 0 0 0 0 0 0 -9.0180 -5.6190 -3.4120 Cl 0 0 0 0 0 0 0 0 0 0 0 0 -1.2890 -1.7570 -3.4740 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4520 -0.4750 -2.9820 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4160 0.6070 -3.8400 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.2190 0.4110 -5.1940 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.0550 -0.8740 -5.6900 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.0850 -1.9590 -4.8250 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.8610 -1.0700 -7.0210 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.8360 0.0930 -7.8510 C 0 0 0 0 0 0 0 0 0 0 0 0 3.2100 -5.6730 -2.0080 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8170 -6.3280 -1.1160 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8970 -6.4930 -2.8860 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3720 -4.1110 -0.1820 H 0 0 0 0 0 0 0 0 0 0 0 0 2.7660 -3.4560 -1.0740 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1730 -1.6490 -0.6180 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1960 -1.9870 -2.3650 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.4390 -2.4240 -2.4660 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.3690 -6.9170 -3.0390 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.7540 -7.3420 -3.4560 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.6360 -3.2280 -2.7270 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.2570 -2.7820 -2.2950 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.6070 -0.3200 -1.9240 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.5440 1.6070 -3.4540 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1920 1.2570 -5.8640 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9540 -2.9600 -5.2090 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6740 -0.2040 -8.8870 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.7880 0.6180 -7.7680 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0290 0.7510 -7.5310 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 30 1 0 0 0 0 1 31 1 0 0 0 0 1 32 1 0 0 0 0 2 3 1 0 0 0 0 3 4 1 0 0 0 0 3 33 1 0 0 0 0 3 34 1 0 0 0 0 4 5 1 0 0 0 0 4 35 1 0 0 0 0 4 36 1 0 0 0 0 5 6 1 0 0 0 0 5 10 1 0 0 0 0 6 7 1 0 0 0 0 6 8 1 0 0 0 0 6 22 1 0 0 0 0 8 9 1 0 0 0 0 8 13 1 0 0 0 0 8 37 1 0 0 0 0 9 10 1 0 0 0 0 9 12 2 0 0 0 0 10 11 2 0 0 0 0 13 14 2 0 0 0 0 13 15 1 0 0 0 0 15 16 1 0 0 0 0 15 20 2 0 0 0 0 16 17 2 0 0 0 0 16 38 1 0 0 0 0 17 18 1 0 0 0 0 17 39 1 0 0 0 0 18 19 2 0 0 0 0 18 21 1 0 0 0 0 19 20 1 0 0 0 0 19 40 1 0 0 0 0 20 41 1 0 0 0 0 22 23 1 0 0 0 0 22 27 2 0 0 0 0 23 24 2 0 0 0 0 23 42 1 0 0 0 0 24 25 1 0 0 0 0 24 43 1 0 0 0 0 25 26 2 0 0 0 0 25 44 1 0 0 0 0 26 27 1 0 0 0 0 26 28 1 0 0 0 0 27 45 1 0 0 0 0 28 29 1 0 0 0 0 29 46 1 0 0 0 0 29 47 1 0 0 0 0 29 48 1 0 0 0 0 M END