IFLAB-ZINC04855298 MOE2007 3D CORINA 3.40 0006 02.08.2006 55 57 0 0 0 0 0 0 0 0999 V2000 3.5010 -1.1400 -0.8810 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4880 -2.1580 -0.4450 C 0 0 0 0 0 0 0 0 0 0 0 0 1.6710 -1.9110 0.6670 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7480 -2.8660 1.0920 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6420 -4.0740 0.3990 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4710 -4.3500 -0.6890 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3920 -3.3890 -1.1080 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.5300 -5.2880 0.9450 S 0 0 0 0 0 0 0 0 0 0 0 0 -0.2180 -6.5380 0.2800 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.5770 -5.2190 2.3920 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.0080 -4.6970 0.2950 N 0 0 0 0 0 0 0 0 0 0 0 0 -2.0650 -4.6750 -1.1990 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.5130 -4.7900 -1.6580 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.4320 -5.0900 -0.8940 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.8270 -4.5430 -3.0930 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.1750 -4.4840 -3.4760 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.5230 -4.2570 -4.8090 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.5270 -4.0870 -5.7680 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.1850 -4.1480 -5.3950 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.8320 -4.3760 -4.0600 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.6820 -3.6680 1.0110 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.6240 -2.5090 0.6150 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.4520 -4.0520 2.0970 N 0 0 0 0 0 0 0 0 0 0 0 0 -4.1200 -3.0450 2.9150 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.6340 -3.2710 2.9130 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.2260 -5.7200 2.4780 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.7170 -5.4430 2.4750 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.4210 -4.9570 3.4150 C 0 0 0 0 0 0 0 0 0 0 0 0 3.6740 -1.1990 -1.9600 H 0 0 0 0 0 0 0 0 0 0 0 0 3.1540 -0.1250 -0.6630 H 0 0 0 0 0 0 0 0 0 0 0 0 4.4490 -1.3100 -0.3600 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7490 -0.9700 1.2070 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1210 -2.6560 1.9550 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4170 -5.3010 -1.2140 H 0 0 0 0 0 0 0 0 0 0 0 0 3.0410 -3.6060 -1.9540 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.6340 -3.7350 -1.5580 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.5240 -5.5270 -1.6200 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.9660 -4.6150 -2.7410 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.5700 -4.2120 -5.1000 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.7960 -3.9100 -6.8070 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.4100 -4.0190 -6.1470 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.7730 -4.4240 -3.8220 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.7220 -3.1330 3.9330 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.8970 -2.0330 2.5620 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.1320 -2.5960 3.6160 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.0590 -3.1470 1.9100 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.6560 -5.6340 1.4750 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.4390 -6.7110 2.8910 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.2330 -6.1500 1.7980 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.3000 -5.5960 3.4770 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.8350 -4.8470 2.4100 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.8640 -4.2320 4.1030 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.5720 -5.9710 3.7930 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.9430 -4.6980 3.3580 N 0 3 0 0 0 0 0 0 0 0 0 0 -5.5810 -4.8100 4.3150 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 29 1 0 0 0 0 1 30 1 0 0 0 0 1 31 1 0 0 0 0 2 3 1 0 0 0 0 2 7 2 0 0 0 0 3 4 2 0 0 0 0 3 32 1 0 0 0 0 4 5 1 0 0 0 0 4 33 1 0 0 0 0 5 6 2 0 0 0 0 5 8 1 0 0 0 0 6 7 1 0 0 0 0 6 34 1 0 0 0 0 7 35 1 0 0 0 0 8 9 2 0 0 0 0 8 10 2 0 0 0 0 8 11 1 0 0 0 0 11 12 1 0 0 0 0 11 21 1 0 0 0 0 12 13 1 0 0 0 0 12 36 1 0 0 0 0 12 37 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 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 40 1 0 0 0 0 19 20 1 0 0 0 0 19 41 1 0 0 0 0 20 42 1 0 0 0 0 21 22 2 0 0 0 0 21 23 1 0 0 0 0 23 24 1 0 0 0 0 23 27 1 0 0 0 0 24 25 1 0 0 0 0 24 43 1 0 0 0 0 24 44 1 0 0 0 0 25 45 1 0 0 0 0 25 46 1 0 0 0 0 25 54 1 0 0 0 0 26 27 1 0 0 0 0 26 47 1 0 0 0 0 26 48 1 0 0 0 0 26 54 1 0 0 0 0 27 49 1 0 0 0 0 27 50 1 0 0 0 0 28 51 1 0 0 0 0 28 52 1 0 0 0 0 28 53 1 0 0 0 0 28 54 1 0 0 0 0 54 55 1 0 0 0 0 M CHG 1 54 1 M END