IBS-ZINC05026531 MOE2007 3D CORINA 3.40 0006 02.08.2006 54 56 0 0 0 0 0 0 0 0999 V2000 -1.0170 -1.3550 -0.9000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1820 -0.2710 -0.2150 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6340 -0.8910 0.8900 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1040 -1.0040 2.1620 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.3080 -0.6820 2.4370 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.0480 -0.3050 1.5480 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.7570 -0.8160 3.7020 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.9530 -1.2300 4.6910 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4200 -1.3310 5.8090 O 0 0 0 0 0 0 0 0 0 0 0 0 0.3390 -1.5400 4.5130 N 0 0 0 0 0 0 0 0 0 0 0 0 0.9230 -1.4580 3.2990 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0950 -1.7480 3.1490 O 0 0 0 0 0 0 0 0 0 0 0 0 1.0990 -1.9650 5.6110 C 0 0 0 0 0 0 0 0 0 0 0 0 0.8050 -3.1680 6.2370 C 0 0 0 0 0 0 0 0 0 0 0 0 1.5560 -3.5840 7.3190 C 0 0 0 0 0 0 0 0 0 0 0 0 2.6000 -2.8020 7.7790 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8960 -1.6030 7.1570 C 0 0 0 0 0 0 0 0 0 0 0 0 2.1520 -1.1850 6.0710 C 0 0 0 0 0 0 0 0 0 0 0 0 3.4180 -3.2580 8.9600 C 0 0 0 0 0 0 0 0 0 0 0 0 1.8820 -1.3340 0.6390 N 0 0 0 0 0 0 0 0 0 0 0 0 2.4680 -1.1580 -0.6930 C 0 0 0 0 0 0 0 0 0 0 0 0 3.8810 -1.7450 -0.7100 C 0 0 0 0 0 0 0 0 0 0 0 0 5.7230 -2.3230 -2.1720 C 0 0 0 0 0 0 0 0 0 0 0 0 6.2680 -2.1600 -3.5940 C 0 0 0 0 0 0 0 0 0 0 0 0 6.4420 -0.7690 -3.8750 O 0 0 0 0 0 0 0 0 0 0 0 0 5.2400 -0.0040 -3.7610 C 0 0 0 0 0 0 0 0 0 0 0 0 4.6840 -0.1450 -2.3420 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.6830 -1.8160 -0.1710 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.6080 -0.9070 -1.7000 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3560 -2.1130 -1.3190 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4840 0.1900 -0.9440 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8440 0.4870 0.2040 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.6840 -0.6070 3.9010 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0110 -3.7790 5.8790 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3270 -4.5200 7.8070 H 0 0 0 0 0 0 0 0 0 0 0 0 3.7110 -0.9940 7.5190 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3860 -0.2500 5.5830 H 0 0 0 0 0 0 0 0 0 0 0 0 4.2590 -3.8560 8.6100 H 0 0 0 0 0 0 0 0 0 0 0 0 3.7900 -2.3890 9.5020 H 0 0 0 0 0 0 0 0 0 0 0 0 2.7950 -3.8600 9.6220 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3930 -1.7700 1.3390 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8520 -1.6720 -1.4310 H 0 0 0 0 0 0 0 0 0 0 0 0 2.5130 -0.0960 -0.9320 H 0 0 0 0 0 0 0 0 0 0 0 0 4.4960 -1.2310 0.0290 H 0 0 0 0 0 0 0 0 0 0 0 0 3.8360 -2.8070 -0.4700 H 0 0 0 0 0 0 0 0 0 0 0 0 5.5350 -3.3780 -1.9740 H 0 0 0 0 0 0 0 0 0 0 0 0 6.4520 -1.9420 -1.4570 H 0 0 0 0 0 0 0 0 0 0 0 0 7.2280 -2.6710 -3.6760 H 0 0 0 0 0 0 0 0 0 0 0 0 5.5640 -2.5900 -4.3050 H 0 0 0 0 0 0 0 0 0 0 0 0 5.4550 1.0450 -3.9650 H 0 0 0 0 0 0 0 0 0 0 0 0 4.5050 -0.3710 -4.4780 H 0 0 0 0 0 0 0 0 0 0 0 0 5.3960 0.2720 -1.6290 H 0 0 0 0 0 0 0 0 0 0 0 0 3.7380 0.3910 -2.2660 H 0 0 0 0 0 0 0 0 0 0 0 0 4.4680 -1.5680 -2.0450 N 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 28 1 0 0 0 0 1 29 1 0 0 0 0 1 30 1 0 0 0 0 2 3 1 0 0 0 0 2 31 1 0 0 0 0 2 32 1 0 0 0 0 3 4 2 0 0 0 0 3 20 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 33 1 0 0 0 0 8 9 2 0 0 0 0 8 10 1 0 0 0 0 10 11 1 0 0 0 0 10 13 1 0 0 0 0 11 12 2 0 0 0 0 13 14 1 0 0 0 0 13 18 2 0 0 0 0 14 15 2 0 0 0 0 14 34 1 0 0 0 0 15 16 1 0 0 0 0 15 35 1 0 0 0 0 16 17 2 0 0 0 0 16 19 1 0 0 0 0 17 18 1 0 0 0 0 17 36 1 0 0 0 0 18 37 1 0 0 0 0 19 38 1 0 0 0 0 19 39 1 0 0 0 0 19 40 1 0 0 0 0 20 21 1 0 0 0 0 20 41 1 0 0 0 0 21 22 1 0 0 0 0 21 42 1 0 0 0 0 21 43 1 0 0 0 0 22 44 1 0 0 0 0 22 45 1 0 0 0 0 22 54 1 0 0 0 0 23 24 1 0 0 0 0 23 46 1 0 0 0 0 23 47 1 0 0 0 0 23 54 1 0 0 0 0 24 25 1 0 0 0 0 24 48 1 0 0 0 0 24 49 1 0 0 0 0 25 26 1 0 0 0 0 26 27 1 0 0 0 0 26 50 1 0 0 0 0 26 51 1 0 0 0 0 27 52 1 0 0 0 0 27 53 1 0 0 0 0 27 54 1 0 0 0 0 M END