CHEMDIV-ZINC06947393 MOE2007 3D CORINA 3.40 0006 02.08.2006 52 54 0 0 0 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 0.6880 -0.4760 -1.2030 N 0 0 0 0 0 0 0 0 0 0 0 0 2.1350 -0.7010 -1.1820 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4210 -2.1450 -0.7640 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0130 -0.7040 -2.3320 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.2110 -0.5180 -2.3490 O 0 0 0 0 0 0 0 0 0 0 0 0 0.6920 -1.1900 -3.5720 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.2820 -1.3600 -4.6530 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.5530 -0.3240 -5.4870 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4100 -0.4300 -6.4580 N 0 0 0 0 0 0 0 0 0 0 0 0 -2.0780 -1.5800 -6.6920 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.8500 -2.6850 -5.8760 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.9000 -2.5470 -4.8170 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.6570 -3.4820 -4.0740 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.6490 -3.8280 -6.2690 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.4360 -3.6230 -7.3090 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.2720 -1.9870 -7.9170 S 0 0 0 0 0 0 0 0 0 0 0 0 -4.3560 -4.6620 -7.8970 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.5870 -5.1490 -5.5460 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1600 0.9880 -5.2800 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.3000 1.9790 -6.3180 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.3870 2.7940 -6.0610 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.8090 3.7030 -7.0130 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.1440 3.7970 -8.2220 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0570 2.9830 -8.4780 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3680 2.0770 -7.5240 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 2.5450 -0.5230 -2.1760 H 0 0 0 0 0 0 0 0 0 0 0 0 2.5990 -0.0180 -0.4700 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0110 -2.3230 0.2310 H 0 0 0 0 0 0 0 0 0 0 0 0 1.9580 -2.8280 -1.4750 H 0 0 0 0 0 0 0 0 0 0 0 0 3.4980 -2.3120 -0.7480 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4440 -0.4610 -3.8720 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1750 -2.1450 -3.3640 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.3300 -4.6020 -7.4100 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.4730 -4.4800 -8.9660 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.9320 -5.6530 -7.7420 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.3230 -5.1580 -4.7420 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.8030 -5.9570 -6.2450 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.5900 -5.2870 -5.1270 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0670 1.3720 -4.2850 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2350 0.8360 -5.3740 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.9060 2.7200 -5.1170 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.6580 4.3390 -6.8130 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.4740 4.5070 -8.9660 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4630 3.0560 -9.4220 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2200 1.4430 -7.7220 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 28 1 0 0 0 0 1 29 1 0 0 0 0 1 30 1 0 0 0 0 2 3 1 0 0 0 0 2 31 1 0 0 0 0 2 32 1 0 0 0 0 3 4 1 0 0 0 0 3 6 1 0 0 0 0 4 5 1 0 0 0 0 4 33 1 0 0 0 0 4 34 1 0 0 0 0 5 35 1 0 0 0 0 5 36 1 0 0 0 0 5 37 1 0 0 0 0 6 7 2 0 0 0 0 6 8 1 0 0 0 0 8 9 1 0 0 0 0 8 38 1 0 0 0 0 8 39 1 0 0 0 0 9 10 1 0 0 0 0 9 14 1 0 0 0 0 10 11 2 0 0 0 0 10 21 1 0 0 0 0 11 12 1 0 0 0 0 12 13 2 0 0 0 0 12 18 1 0 0 0 0 13 14 1 0 0 0 0 13 16 1 0 0 0 0 14 15 2 0 0 0 0 16 17 2 0 0 0 0 16 20 1 0 0 0 0 17 18 1 0 0 0 0 17 19 1 0 0 0 0 19 40 1 0 0 0 0 19 41 1 0 0 0 0 19 42 1 0 0 0 0 20 43 1 0 0 0 0 20 44 1 0 0 0 0 20 45 1 0 0 0 0 21 22 1 0 0 0 0 21 46 1 0 0 0 0 21 47 1 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 48 1 0 0 0 0 24 25 1 0 0 0 0 24 49 1 0 0 0 0 25 26 2 0 0 0 0 25 50 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 M END