CHEMBRIDGE-ZINC04956164 MOE2007 3D CORINA 3.40 0006 02.08.2006 46 47 0 0 0 0 0 0 0 0999 V2000 1.6290 1.4730 3.3830 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3630 0.0290 2.9520 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3180 -0.9080 3.6940 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0560 -2.3300 3.2700 C 0 0 0 0 0 0 0 0 0 0 0 0 2.7380 -2.8650 2.1920 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5000 -4.1680 1.8000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.5760 -4.9410 2.4900 C 0 0 0 0 0 0 0 0 0 0 0 0 0.8940 -4.4020 3.5710 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1400 -3.1000 3.9620 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3400 -6.2230 2.1060 O 0 0 0 0 0 0 0 0 0 0 0 0 0.3760 -6.9590 2.8620 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2490 -8.3500 2.2950 C 0 0 0 0 0 0 0 0 0 0 0 0 0.9180 -8.6780 1.3380 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.6080 -9.2280 2.8520 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.7270 -10.5210 2.3240 N 0 0 0 0 0 0 0 0 0 0 0 0 -1.6340 -11.3280 2.7830 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.8160 -10.7880 3.4800 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.1120 -9.4240 3.4080 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.2190 -8.9240 4.0610 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.0390 -9.7680 4.7880 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.7540 -11.1240 4.8660 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.6480 -11.6390 4.2090 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.5630 -11.9480 5.5820 O 0 0 0 0 0 0 0 0 0 0 0 0 -6.6880 -11.3500 6.2290 C 0 0 0 0 0 0 0 0 0 0 0 0 2.6580 1.7400 3.1450 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9490 2.1410 2.8540 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4680 1.5670 4.4570 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3340 -0.2380 3.1900 H 0 0 0 0 0 0 0 0 0 0 0 0 1.5240 -0.0640 1.8780 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3470 -0.6420 3.4560 H 0 0 0 0 0 0 0 0 0 0 0 0 2.1570 -0.8150 4.7680 H 0 0 0 0 0 0 0 0 0 0 0 0 3.4560 -2.2630 1.6550 H 0 0 0 0 0 0 0 0 0 0 0 0 3.0320 -4.5860 0.9580 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1740 -5.0010 4.1090 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6120 -2.6820 4.8060 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6980 -7.0190 3.9020 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5890 -6.4550 2.8090 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1430 -8.9660 3.6170 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.5230 -12.3940 2.6530 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.4730 -8.7630 2.8410 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.4460 -7.8700 4.0040 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.9040 -9.3700 5.2980 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.4280 -12.6950 4.2660 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.3320 -10.8850 5.4820 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.2490 -12.1170 6.7650 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.3430 -10.5940 6.9340 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 25 1 0 0 0 0 1 26 1 0 0 0 0 1 27 1 0 0 0 0 2 3 1 0 0 0 0 2 28 1 0 0 0 0 2 29 1 0 0 0 0 3 4 1 0 0 0 0 3 30 1 0 0 0 0 3 31 1 0 0 0 0 4 5 1 0 0 0 0 4 9 2 0 0 0 0 5 6 2 0 0 0 0 5 32 1 0 0 0 0 6 7 1 0 0 0 0 6 33 1 0 0 0 0 7 8 2 0 0 0 0 7 10 1 0 0 0 0 8 9 1 0 0 0 0 8 34 1 0 0 0 0 9 35 1 0 0 0 0 10 11 1 0 0 0 0 11 12 1 0 0 0 0 11 36 1 0 0 0 0 11 37 1 0 0 0 0 12 13 2 0 0 0 0 12 14 1 0 0 0 0 14 15 1 0 0 0 0 14 38 1 0 0 0 0 15 16 2 0 0 0 0 16 17 1 0 0 0 0 16 39 1 0 0 0 0 17 18 1 0 0 0 0 17 22 2 0 0 0 0 18 19 2 0 0 0 0 18 40 1 0 0 0 0 19 20 1 0 0 0 0 19 41 1 0 0 0 0 20 21 2 0 0 0 0 20 42 1 0 0 0 0 21 22 1 0 0 0 0 21 23 1 0 0 0 0 22 43 1 0 0 0 0 23 24 1 0 0 0 0 24 44 1 0 0 0 0 24 45 1 0 0 0 0 24 46 1 0 0 0 0 M END