IFLAB-ZINC04279286 MOE2007 3D CORINA 3.40 0006 02.08.2006 63 63 0 0 1 0 0 0 0 0999 V2000 -0.0190 1.5260 0.0100 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0020 -0.0040 0.0020 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7180 -0.4980 -1.2570 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7390 -2.0270 -1.2650 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4550 -2.5210 -2.5240 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4760 -4.0510 -2.5320 C 0 0 0 0 0 0 0 0 0 0 0 0 2.1450 -4.5110 -3.7080 O 0 0 0 0 0 0 0 0 0 0 0 0 2.2200 -5.9340 -3.8140 C 0 0 3 0 0 0 0 0 0 0 0 0 2.6010 -6.3490 -2.8810 H 0 0 0 0 0 0 0 0 0 0 0 0 3.1590 -6.3120 -4.9620 C 0 0 3 0 0 0 0 0 0 0 0 0 2.8000 -5.8640 -5.8890 H 0 0 0 0 0 0 0 0 0 0 0 0 3.1870 -7.8370 -5.1080 C 0 0 3 0 0 0 0 0 0 0 0 0 3.5920 -8.2830 -4.2000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7590 -8.3430 -5.3350 C 0 0 3 0 0 0 0 0 0 0 0 0 1.7630 -9.4320 -5.3850 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8740 -7.8870 -4.1720 C 0 0 3 0 0 0 0 0 0 0 0 0 1.2380 -8.3270 -3.2440 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9170 -6.4620 -4.0730 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.5670 -8.3380 -4.4210 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.3830 -8.0100 -3.2660 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.6820 -8.3420 -3.3230 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.1230 -8.8880 -4.3070 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.5910 -8.0330 -2.1620 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2440 -7.8020 -6.5800 O 0 0 0 0 0 0 0 0 0 0 0 0 0.3490 -8.5490 -7.2450 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0070 -9.6200 -6.8020 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.2290 -8.0520 -8.5450 C 0 0 0 0 0 0 0 0 0 0 0 0 4.0190 -8.2010 -6.2410 O 0 0 0 0 0 0 0 0 0 0 0 0 4.6550 -9.3810 -6.1760 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5210 -10.0860 -5.2040 O 0 0 0 0 0 0 0 0 0 0 0 0 5.5370 -9.8260 -7.3140 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5090 -5.8220 -4.6720 N 0 0 0 0 0 0 0 0 0 0 0 0 4.8470 -4.5550 -4.9840 C 0 0 0 0 0 0 0 0 0 0 0 0 4.0350 -3.8210 -5.5050 O 0 0 0 0 0 0 0 0 0 0 0 0 6.2360 -4.0510 -4.6850 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0040 1.9030 0.0030 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5460 1.8870 -0.8730 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5290 1.8770 0.9070 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5290 -0.3650 0.8850 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0200 -0.3810 0.0100 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1910 -0.1360 -2.1400 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7410 -0.1200 -1.2640 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2660 -2.3880 -0.3820 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2840 -2.4050 -1.2580 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9280 -2.1600 -3.4070 H 0 0 0 0 0 0 0 0 0 0 0 0 2.4780 -2.1440 -2.5320 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0030 -4.4120 -1.6490 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4530 -4.4280 -2.5250 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9600 -7.8290 -5.3000 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5870 -9.4150 -4.5860 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.0260 -7.0420 -2.2940 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.3870 -8.7760 -2.1160 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.0180 -8.0570 -1.2350 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3950 -8.3900 -9.3730 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2380 -8.4460 -8.6670 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2620 -6.9630 -8.5360 H 0 0 0 0 0 0 0 0 0 0 0 0 6.3390 -9.1020 -7.4570 H 0 0 0 0 0 0 0 0 0 0 0 0 5.9650 -10.8020 -7.0820 H 0 0 0 0 0 0 0 0 0 0 0 0 4.9440 -9.8970 -8.2260 H 0 0 0 0 0 0 0 0 0 0 0 0 5.1590 -6.4090 -4.2550 H 0 0 0 0 0 0 0 0 0 0 0 0 6.9660 -4.6580 -5.2200 H 0 0 0 0 0 0 0 0 0 0 0 0 6.3220 -3.0130 -5.0050 H 0 0 0 0 0 0 0 0 0 0 0 0 6.4240 -4.1180 -3.6130 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 36 1 0 0 0 0 1 37 1 0 0 0 0 1 38 1 0 0 0 0 2 3 1 0 0 0 0 2 39 1 0 0 0 0 2 40 1 0 0 0 0 3 4 1 0 0 0 0 3 41 1 0 0 0 0 3 42 1 0 0 0 0 4 5 1 0 0 0 0 4 43 1 0 0 0 0 4 44 1 0 0 0 0 5 6 1 0 0 0 0 5 45 1 0 0 0 0 5 46 1 0 0 0 0 6 7 1 0 0 0 0 6 47 1 0 0 0 0 6 48 1 0 0 0 0 7 8 1 0 0 0 0 8 9 1 0 0 0 0 8 10 1 0 0 0 0 8 18 1 0 0 0 0 10 11 1 0 0 0 0 10 12 1 0 0 0 0 10 32 1 0 0 0 0 12 13 1 0 0 0 0 12 14 1 0 0 0 0 12 28 1 0 0 0 0 14 15 1 0 0 0 0 14 16 1 0 0 0 0 14 24 1 0 0 0 0 16 17 1 0 0 0 0 16 18 1 0 0 0 0 16 19 1 0 0 0 0 19 20 1 0 0 0 0 19 49 1 0 0 0 0 19 50 1 0 0 0 0 20 21 1 0 0 0 0 21 22 2 0 0 0 0 21 23 1 0 0 0 0 23 51 1 0 0 0 0 23 52 1 0 0 0 0 23 53 1 0 0 0 0 24 25 1 0 0 0 0 25 26 2 0 0 0 0 25 27 1 0 0 0 0 27 54 1 0 0 0 0 27 55 1 0 0 0 0 27 56 1 0 0 0 0 28 29 1 0 0 0 0 29 30 2 0 0 0 0 29 31 1 0 0 0 0 31 57 1 0 0 0 0 31 58 1 0 0 0 0 31 59 1 0 0 0 0 32 33 1 0 0 0 0 32 60 1 0 0 0 0 33 34 2 0 0 0 0 33 35 1 0 0 0 0 35 61 1 0 0 0 0 35 62 1 0 0 0 0 35 63 1 0 0 0 0 M END