IFLAB-ZINC05258682 MOE2007 3D CORINA 3.40 0006 02.08.2006 45 45 0 0 1 0 0 0 0 0999 V2000 0.4440 2.3890 1.2210 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3570 0.8740 1.0230 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0900 0.1680 2.1650 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0040 -1.3470 1.9670 C 0 0 0 0 0 0 0 0 0 0 0 0 1.7370 -2.0540 3.1090 C 0 0 0 0 0 0 0 0 0 0 0 0 1.6500 -3.5680 2.9110 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2910 -5.7060 3.8500 C 0 0 3 0 0 0 0 0 0 0 0 0 2.3290 -5.9590 2.7910 H 0 0 0 0 0 0 0 0 0 0 0 0 3.4780 -6.3480 4.5710 C 0 0 0 0 0 0 0 0 0 0 0 0 4.7600 -5.9290 3.8990 C 0 0 0 0 0 0 0 0 0 0 0 0 4.7280 -5.1900 2.9380 O 0 0 0 0 0 0 0 0 0 0 0 0 5.9430 -6.3760 4.3660 N 0 0 0 0 0 0 0 0 0 0 0 0 7.1240 -6.0780 3.6780 C 0 0 0 0 0 0 0 0 0 0 0 0 8.3090 -5.8880 4.3780 C 0 0 0 0 0 0 0 0 0 0 0 0 9.4740 -5.5950 3.6970 C 0 0 0 0 0 0 0 0 0 0 0 0 9.4630 -5.4890 2.3190 C 0 0 0 0 0 0 0 0 0 0 0 0 8.2850 -5.6770 1.6160 C 0 0 0 0 0 0 0 0 0 0 0 0 7.1160 -5.9770 2.2930 C 0 0 0 0 0 0 0 0 0 0 0 0 8.2780 -5.5730 0.2690 F 0 0 0 0 0 0 0 0 0 0 0 0 1.0050 -6.2200 4.4440 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2210 -5.4500 4.9460 O 0 0 0 0 0 0 0 0 0 0 0 0 1.4900 2.6950 1.2260 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0780 2.8920 0.4070 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0180 2.6580 2.1710 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6890 0.5680 1.0180 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8190 0.6050 0.0730 H 0 0 0 0 0 0 0 0 0 0 0 0 2.1360 0.4740 2.1700 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6280 0.4370 3.1150 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0420 -1.6540 1.9620 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4660 -1.6160 1.0170 H 0 0 0 0 0 0 0 0 0 0 0 0 2.7830 -1.7470 3.1140 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2750 -1.7840 4.0590 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6040 -3.8750 2.9060 H 0 0 0 0 0 0 0 0 0 0 0 0 2.1120 -3.8380 1.9610 H 0 0 0 0 0 0 0 0 0 0 0 0 3.4900 -6.0230 5.6120 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3840 -7.4330 4.5300 H 0 0 0 0 0 0 0 0 0 0 0 0 5.9750 -6.9040 5.1780 H 0 0 0 0 0 0 0 0 0 0 0 0 8.3180 -5.9700 5.4550 H 0 0 0 0 0 0 0 0 0 0 0 0 10.3940 -5.4480 4.2420 H 0 0 0 0 0 0 0 0 0 0 0 0 10.3760 -5.2580 1.7890 H 0 0 0 0 0 0 0 0 0 0 0 0 6.1980 -6.1280 1.7450 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3540 -4.2460 4.0080 N 0 0 0 0 0 0 0 0 0 0 0 0 3.3100 -3.9310 4.0740 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7300 -7.5340 4.4140 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.1070 -7.8160 4.8080 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 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 2 3 1 0 0 0 0 2 25 1 0 0 0 0 2 26 1 0 0 0 0 3 4 1 0 0 0 0 3 27 1 0 0 0 0 3 28 1 0 0 0 0 4 5 1 0 0 0 0 4 29 1 0 0 0 0 4 30 1 0 0 0 0 5 6 1 0 0 0 0 5 31 1 0 0 0 0 5 32 1 0 0 0 0 6 33 1 0 0 0 0 6 34 1 0 0 0 0 6 42 1 0 0 0 0 7 8 1 0 0 0 0 7 9 1 0 0 0 0 7 20 1 0 0 0 0 7 42 1 0 0 0 0 9 10 1 0 0 0 0 9 35 1 0 0 0 0 9 36 1 0 0 0 0 10 11 2 0 0 0 0 10 12 1 0 0 0 0 12 13 1 0 0 0 0 12 37 1 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 38 1 0 0 0 0 15 16 1 0 0 0 0 15 39 1 0 0 0 0 16 17 2 0 0 0 0 16 40 1 0 0 0 0 17 18 1 0 0 0 0 17 19 1 0 0 0 0 18 41 1 0 0 0 0 20 21 2 0 0 0 0 20 44 1 0 0 0 0 42 43 1 0 0 0 0 44 45 1 0 0 0 0 M END