IBS-ZINC05451971 MOE2007 3D CORINA 3.40 0006 02.08.2006 54 56 0 0 1 0 0 0 0 0999 V2000 -0.1080 1.7110 -0.4440 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0640 0.2090 -0.1530 C 0 0 3 0 0 0 0 0 0 0 0 0 0.4990 -0.2960 -0.9380 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6090 -0.0250 1.1770 C 0 0 0 0 0 0 0 0 0 0 0 0 1.9790 0.1870 1.2530 C 0 0 0 0 0 0 0 0 0 0 0 0 2.6540 0.0000 2.4460 C 0 0 0 0 0 0 0 0 0 0 0 0 1.9500 -0.4030 3.5770 C 0 0 0 0 0 0 0 0 0 0 0 0 0.5870 -0.6160 3.4950 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0870 -0.4330 2.2930 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.5670 -0.7120 2.2750 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.2360 -0.0300 1.0830 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4310 -0.3210 -0.1140 N 0 0 0 0 0 0 0 0 0 0 0 0 -1.9310 -1.0450 -1.1350 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.2660 -1.2260 -2.1330 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.3160 -1.6300 -1.0360 C 0 0 3 0 0 0 0 0 0 0 0 0 -4.0220 -0.8470 -0.7590 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.3310 -2.7300 0.0280 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.7000 -2.1980 -2.3310 N 0 0 0 0 0 0 0 0 0 0 0 0 -5.0030 -2.3150 -2.6550 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.8600 -1.9500 -1.8740 O 0 0 0 0 0 0 0 0 0 0 0 0 -5.3910 -2.8880 -3.9620 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.7390 -3.0110 -4.3010 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.0940 -3.5460 -5.5220 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.1160 -3.9600 -6.4100 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.7780 -3.8410 -6.0800 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.4100 -3.3030 -4.8640 C 0 0 0 0 0 0 0 0 0 0 0 0 2.6000 -0.5870 4.7570 O 0 0 0 0 0 0 0 0 0 0 0 0 1.8120 -1.0000 5.8750 C 0 0 0 0 0 0 0 0 0 0 0 0 3.9960 0.2060 2.5120 O 0 0 0 0 0 0 0 0 0 0 0 0 4.6500 0.6180 1.3100 C 0 0 0 0 0 0 0 0 0 0 0 0 0.9070 2.1050 -0.4740 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5930 1.8800 -1.4050 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6710 2.2160 0.3410 H 0 0 0 0 0 0 0 0 0 0 0 0 2.5230 0.5010 0.3740 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0400 -0.9270 4.3730 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.7280 -1.7880 2.2090 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.0130 -0.3400 3.1980 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.2450 -0.4210 0.9530 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.2750 1.0470 1.2480 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.5420 -3.4510 -0.1840 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.1650 -2.2870 1.0100 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.2970 -3.2340 0.0160 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.0170 -2.4890 -2.9540 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.5030 -2.6880 -3.6090 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.1370 -3.6420 -5.7860 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.4000 -4.3790 -7.3640 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.0200 -4.1670 -6.7770 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.3650 -3.2060 -4.6090 H 0 0 0 0 0 0 0 0 0 0 0 0 2.4520 -1.1100 6.7500 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0460 -0.2510 6.0760 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3370 -1.9550 5.6510 H 0 0 0 0 0 0 0 0 0 0 0 0 5.7150 0.7470 1.5010 H 0 0 0 0 0 0 0 0 0 0 0 0 4.5080 -0.1420 0.5410 H 0 0 0 0 0 0 0 0 0 0 0 0 4.2240 1.5620 0.9700 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 31 1 0 0 0 0 1 32 1 0 0 0 0 1 33 1 0 0 0 0 2 3 1 0 0 0 0 2 4 1 0 0 0 0 2 12 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 34 1 0 0 0 0 6 7 1 0 0 0 0 6 29 1 0 0 0 0 7 8 2 0 0 0 0 7 27 1 0 0 0 0 8 9 1 0 0 0 0 8 35 1 0 0 0 0 9 10 1 0 0 0 0 10 11 1 0 0 0 0 10 36 1 0 0 0 0 10 37 1 0 0 0 0 11 12 1 0 0 0 0 11 38 1 0 0 0 0 11 39 1 0 0 0 0 12 13 1 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 17 1 0 0 0 0 15 18 1 0 0 0 0 17 40 1 0 0 0 0 17 41 1 0 0 0 0 17 42 1 0 0 0 0 18 19 1 0 0 0 0 18 43 1 0 0 0 0 19 20 2 0 0 0 0 19 21 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 44 1 0 0 0 0 23 24 1 0 0 0 0 23 45 1 0 0 0 0 24 25 2 0 0 0 0 24 46 1 0 0 0 0 25 26 1 0 0 0 0 25 47 1 0 0 0 0 26 48 1 0 0 0 0 27 28 1 0 0 0 0 28 49 1 0 0 0 0 28 50 1 0 0 0 0 28 51 1 0 0 0 0 29 30 1 0 0 0 0 30 52 1 0 0 0 0 30 53 1 0 0 0 0 30 54 1 0 0 0 0 M END