CHEMBRIDGE-ZINC00891027 MOE2007 3D CORINA 3.40 0006 02.08.2006 52 54 0 0 0 0 0 0 0 0999 V2000 0.9780 1.0470 -0.0520 C 0 0 0 0 0 0 0 0 0 0 0 0 0.9450 -0.4560 -0.1430 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0700 -1.0760 -1.0170 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0370 -2.4540 -1.1030 C 0 0 0 0 0 0 0 0 0 0 0 0 0.8850 -3.2180 -0.3120 C 0 0 0 0 0 0 0 0 0 0 0 0 1.7630 -2.5930 0.5640 C 0 0 0 0 0 0 0 0 0 0 0 0 1.7940 -1.2140 0.6420 C 0 0 0 0 0 0 0 0 0 0 0 0 0.8540 -4.6140 -0.3960 N 0 0 0 0 0 0 0 0 0 0 0 0 0.5800 -5.2120 -1.5720 C 0 0 0 0 0 0 0 0 0 0 0 0 0.4510 -4.5440 -2.5770 O 0 0 0 0 0 0 0 0 0 0 0 0 0.4330 -6.7100 -1.6400 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1380 -7.1110 -3.0180 N 0 0 0 0 0 0 0 0 0 0 0 0 1.1680 -7.4010 -3.8750 C 0 0 0 0 0 0 0 0 0 0 0 0 0.8960 -7.7700 -5.1460 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.4560 -7.8500 -5.5650 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.7270 -8.1810 -6.7060 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.4390 -7.5560 -4.6900 N 0 0 0 0 0 0 0 0 0 0 0 0 -1.1400 -7.1950 -3.4290 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.0380 -6.9380 -2.6500 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.8390 -7.6350 -5.1140 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.3650 -9.0230 -4.8530 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.6420 -9.8640 -4.3620 O 0 0 0 0 0 0 0 0 0 0 0 0 -4.6400 -9.3300 -5.1660 N 0 0 0 0 0 0 0 0 0 0 0 0 -5.1610 -10.5840 -4.8260 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.7360 -11.2230 -3.6690 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.2520 -12.4610 -3.3360 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.1910 -13.0620 -4.1540 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.6160 -12.4280 -5.3070 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.1080 -11.1880 -5.6420 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.7520 -14.4120 -3.7880 C 0 0 0 0 0 0 0 0 0 0 0 0 1.8980 -8.0590 -6.0040 F 0 0 0 0 0 0 0 0 0 0 0 0 0.2710 1.3810 0.7070 H 0 0 0 0 0 0 0 0 0 0 0 0 1.9820 1.3730 0.2190 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7050 1.4760 -1.0160 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5890 -0.4810 -1.6320 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6470 -2.9370 -1.7850 H 0 0 0 0 0 0 0 0 0 0 0 0 2.4240 -3.1840 1.1810 H 0 0 0 0 0 0 0 0 0 0 0 0 2.4800 -0.7280 1.3200 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0300 -5.1520 0.3920 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3600 -7.1810 -1.3150 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3820 -7.0250 -0.9880 H 0 0 0 0 0 0 0 0 0 0 0 0 2.1910 -7.3340 -3.5370 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.4300 -6.9110 -4.5520 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.9100 -7.4140 -6.1790 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.1960 -8.6830 -5.6260 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.0020 -10.7540 -3.0300 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.9210 -12.9590 -2.4360 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.3490 -12.9010 -5.9430 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.4440 -10.6910 -6.5400 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.6400 -14.2810 -3.1700 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.0170 -14.9540 -4.6950 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.0040 -14.9780 -3.2320 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 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 2 3 1 0 0 0 0 2 7 2 0 0 0 0 3 4 2 0 0 0 0 3 35 1 0 0 0 0 4 5 1 0 0 0 0 4 36 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 37 1 0 0 0 0 7 38 1 0 0 0 0 8 9 1 0 0 0 0 8 39 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 40 1 0 0 0 0 11 41 1 0 0 0 0 12 13 1 0 0 0 0 12 18 1 0 0 0 0 13 14 2 0 0 0 0 13 42 1 0 0 0 0 14 15 1 0 0 0 0 14 31 1 0 0 0 0 15 16 2 0 0 0 0 15 17 1 0 0 0 0 17 18 1 0 0 0 0 17 20 1 0 0 0 0 18 19 2 0 0 0 0 20 21 1 0 0 0 0 20 43 1 0 0 0 0 20 44 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 45 1 0 0 0 0 24 25 1 0 0 0 0 24 29 2 0 0 0 0 25 26 2 0 0 0 0 25 46 1 0 0 0 0 26 27 1 0 0 0 0 26 47 1 0 0 0 0 27 28 2 0 0 0 0 27 30 1 0 0 0 0 28 29 1 0 0 0 0 28 48 1 0 0 0 0 29 49 1 0 0 0 0 30 50 1 0 0 0 0 30 51 1 0 0 0 0 30 52 1 0 0 0 0 M END