IFLAB-ZINC05258731 MOE2007 3D CORINA 3.40 0006 02.08.2006 44 44 0 0 1 0 0 0 0 0999 V2000 -0.0160 1.1130 -0.0160 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0850 1.0300 2.4030 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.7370 3.0520 1.2420 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.6690 3.5040 2.3690 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.7020 5.0330 2.4210 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.6530 6.9330 3.5820 C 0 0 3 0 0 0 0 0 0 0 0 0 -1.6770 7.3480 3.3320 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.0360 7.3520 5.0020 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.9460 6.9420 5.9590 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.9590 6.3710 5.5450 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.0680 7.2100 7.2740 N 0 0 0 0 0 0 0 0 0 0 0 0 -1.1000 6.7480 8.1760 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2320 6.6810 7.7910 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1860 6.2250 8.6820 C 0 0 0 0 0 0 0 0 0 0 0 0 0.8140 5.8350 9.9570 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.5140 5.9000 10.3440 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4710 6.3610 9.4580 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.7660 6.4310 9.8380 F 0 0 0 0 0 0 0 0 0 0 0 0 1.7480 5.3890 10.8250 F 0 0 0 0 0 0 0 0 0 0 0 0 -3.6830 7.4490 2.6100 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.3050 6.6760 1.9220 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.0060 0.0230 -0.0270 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0090 1.4850 -0.0170 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5370 1.4810 -0.8990 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9580 1.3420 2.4520 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1380 -0.0590 2.3730 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6150 1.3940 3.2830 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1020 3.4400 0.2910 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2680 3.4310 1.4280 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.6740 3.1250 2.1830 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.3040 3.1160 3.3200 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6970 5.4120 2.6060 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.0670 5.4210 1.4700 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.1650 8.4330 5.0400 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.9700 6.8640 5.2850 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.8250 7.7230 7.5960 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5240 6.9840 6.7970 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2220 6.1730 8.3820 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8020 5.5950 11.3400 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7060 1.5840 1.1930 N 0 0 0 0 0 0 0 0 0 0 0 0 -2.5960 5.4670 3.5020 N 0 0 0 0 0 0 0 0 0 0 0 0 -3.5190 5.0750 3.3870 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.9080 8.7690 2.5100 O 0 0 0 0 0 0 0 0 0 0 0 0 -4.5780 9.0520 1.8730 H 0 0 0 0 0 0 0 0 0 0 0 0 1 22 1 0 0 0 0 1 23 1 0 0 0 0 1 24 1 0 0 0 0 1 40 1 0 0 0 0 2 25 1 0 0 0 0 2 26 1 0 0 0 0 2 27 1 0 0 0 0 2 40 1 0 0 0 0 3 4 1 0 0 0 0 3 28 1 0 0 0 0 3 29 1 0 0 0 0 3 40 1 0 0 0 0 4 5 1 0 0 0 0 4 30 1 0 0 0 0 4 31 1 0 0 0 0 5 32 1 0 0 0 0 5 33 1 0 0 0 0 5 41 1 0 0 0 0 6 7 1 0 0 0 0 6 8 1 0 0 0 0 6 20 1 0 0 0 0 6 41 1 0 0 0 0 8 9 1 0 0 0 0 8 34 1 0 0 0 0 8 35 1 0 0 0 0 9 10 2 0 0 0 0 9 11 1 0 0 0 0 11 12 1 0 0 0 0 11 36 1 0 0 0 0 12 13 1 0 0 0 0 12 17 2 0 0 0 0 13 14 2 0 0 0 0 13 37 1 0 0 0 0 14 15 1 0 0 0 0 14 38 1 0 0 0 0 15 16 2 0 0 0 0 15 19 1 0 0 0 0 16 17 1 0 0 0 0 16 39 1 0 0 0 0 17 18 1 0 0 0 0 20 21 2 0 0 0 0 20 43 1 0 0 0 0 41 42 1 0 0 0 0 43 44 1 0 0 0 0 M END