IBS-ZINC02586868 MOE2007 3D CORINA 3.40 0006 02.08.2006 56 58 0 0 1 0 0 0 0 0999 V2000 -0.0130 1.0860 0.0080 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0720 1.0150 2.4280 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.7400 3.0270 1.2590 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.6690 3.4810 2.3870 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.7100 5.0090 2.4300 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.6000 5.4430 3.5100 N 0 0 0 0 0 0 0 0 0 0 0 0 -2.1670 5.6900 4.8860 C 0 0 3 0 0 0 0 0 0 0 0 0 -1.7530 4.7780 5.3160 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.4140 6.1240 5.6720 C 0 0 3 0 0 0 0 0 0 0 0 0 -3.6960 5.1540 6.7900 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.4460 5.5970 7.9810 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.7200 4.7120 9.0310 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.4250 5.1710 10.1260 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.8390 6.4210 10.1900 N 0 0 0 0 0 0 0 0 0 0 0 0 -5.6040 7.2870 9.2250 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.9010 6.9170 8.0950 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.3080 4.0120 6.7120 O 0 0 0 0 0 0 0 0 0 0 0 0 -4.5300 6.0950 4.6480 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.6920 6.3690 4.8360 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.9110 5.6700 3.3620 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.5160 5.5420 2.3180 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.1330 6.7870 4.9120 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0580 6.6980 5.7780 C 0 0 0 0 0 0 0 0 0 0 0 0 0.8920 7.6980 5.8070 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7670 8.8010 4.9600 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.3210 8.8830 4.0880 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.2610 7.8740 4.0660 C 0 0 0 0 0 0 0 0 0 0 0 0 1.7800 9.8760 4.9850 C 0 0 0 0 0 0 0 0 0 0 0 0 2.7250 9.8010 5.7450 O 0 0 0 0 0 0 0 0 0 0 0 0 1.6560 10.9380 4.1670 O 0 0 0 0 0 0 0 0 0 0 0 0 2.6890 11.9560 4.2460 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0020 -0.0040 0.0020 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0100 1.4630 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5400 1.4470 -0.8750 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9700 1.3320 2.4710 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1190 -0.0740 2.4030 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6000 1.3810 3.3080 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1100 3.4080 0.3070 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2640 3.4130 1.4380 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.6730 3.0950 2.2070 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2980 3.1000 3.3380 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7060 5.3950 2.6100 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.0800 5.3900 1.4790 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.3840 3.6870 8.9860 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.6410 4.4970 10.9420 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.9630 8.3010 9.3200 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.7080 7.6340 7.3100 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.2850 7.1320 6.0670 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0380 5.8450 6.4330 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7310 7.6280 6.4840 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4240 9.7340 3.4310 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.1010 7.9340 3.3900 H 0 0 0 0 0 0 0 0 0 0 0 0 2.4690 12.7530 3.5360 H 0 0 0 0 0 0 0 0 0 0 0 0 2.7180 12.3660 5.2550 H 0 0 0 0 0 0 0 0 0 0 0 0 3.6550 11.5120 4.0060 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7000 1.5600 1.2170 N 0 0 0 0 0 0 0 0 0 0 0 0 1 32 1 0 0 0 0 1 33 1 0 0 0 0 1 34 1 0 0 0 0 1 56 1 0 0 0 0 2 35 1 0 0 0 0 2 36 1 0 0 0 0 2 37 1 0 0 0 0 2 56 1 0 0 0 0 3 4 1 0 0 0 0 3 38 1 0 0 0 0 3 39 1 0 0 0 0 3 56 1 0 0 0 0 4 5 1 0 0 0 0 4 40 1 0 0 0 0 4 41 1 0 0 0 0 5 6 1 0 0 0 0 5 42 1 0 0 0 0 5 43 1 0 0 0 0 6 7 1 0 0 0 0 6 20 1 0 0 0 0 7 8 1 0 0 0 0 7 9 1 0 0 0 0 7 22 1 0 0 0 0 9 10 1 0 0 0 0 9 18 1 0 0 0 0 9 48 1 0 0 0 0 10 11 1 0 0 0 0 10 17 2 0 0 0 0 11 12 1 0 0 0 0 11 16 2 0 0 0 0 12 13 2 0 0 0 0 12 44 1 0 0 0 0 13 14 1 0 0 0 0 13 45 1 0 0 0 0 14 15 2 0 0 0 0 15 16 1 0 0 0 0 15 46 1 0 0 0 0 16 47 1 0 0 0 0 18 19 2 0 0 0 0 18 20 1 0 0 0 0 20 21 2 0 0 0 0 22 23 1 0 0 0 0 22 27 2 0 0 0 0 23 24 2 0 0 0 0 23 49 1 0 0 0 0 24 25 1 0 0 0 0 24 50 1 0 0 0 0 25 26 2 0 0 0 0 25 28 1 0 0 0 0 26 27 1 0 0 0 0 26 51 1 0 0 0 0 27 52 1 0 0 0 0 28 29 2 0 0 0 0 28 30 1 0 0 0 0 30 31 1 0 0 0 0 31 53 1 0 0 0 0 31 54 1 0 0 0 0 31 55 1 0 0 0 0 M END