ANALYTICONDISCOVERY-ZINC04260552 MOE2007 3D CORINA 3.40 0006 02.08.2006 66 70 0 0 1 0 0 0 0 0999 V2000 0.1710 1.3650 -0.4550 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1110 -0.1500 -0.6580 C 0 0 3 0 0 0 0 0 0 0 0 0 1.2440 -0.8220 0.1260 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0620 -0.5940 1.6250 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.2700 -1.2140 2.0580 C 0 0 3 0 0 0 0 0 0 0 0 0 -0.2760 -2.2760 1.8140 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.4030 -0.5100 1.3140 C 0 0 3 0 0 0 0 0 0 0 0 0 -1.2450 -0.6800 -0.1850 C 0 0 3 0 0 0 0 0 0 0 0 0 -1.3360 -1.7370 -0.4390 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.3640 0.1350 -0.8510 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.1000 0.2340 -2.3320 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.9210 -0.0300 -2.9280 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.9270 0.1330 -4.2410 N 0 0 0 0 0 0 0 0 0 0 0 0 -2.0340 0.5120 -4.8020 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.2670 0.7090 -3.5610 S 0 0 0 0 0 0 0 0 0 0 0 0 -2.2280 0.7430 -6.2500 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.4710 1.1530 -6.7450 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.6000 1.3550 -8.1070 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.5070 1.1480 -8.9290 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.3470 0.7620 -8.4340 N 0 0 0 0 0 0 0 0 0 0 0 0 -1.1730 0.5610 -7.1440 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3210 -0.4820 -2.1420 C 0 0 3 0 0 0 0 0 0 0 0 0 0.4650 -1.5560 -2.2570 H 0 0 0 0 0 0 0 0 0 0 0 0 1.5580 0.2550 -2.6580 C 0 0 0 0 0 0 0 0 0 0 0 0 1.9000 -0.2430 -4.0390 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2210 -1.1030 -4.5580 O 0 0 0 0 0 0 0 0 0 0 0 0 2.9600 0.2670 -4.6960 N 0 0 0 0 0 0 0 0 0 0 0 0 3.3490 -0.2770 -5.9280 C 0 0 0 0 0 0 0 0 0 0 0 0 3.0100 -1.5830 -6.2490 C 0 0 0 0 0 0 0 0 0 0 0 0 3.3940 -2.1170 -7.4640 C 0 0 0 0 0 0 0 0 0 0 0 0 4.1160 -1.3520 -8.3620 C 0 0 0 0 0 0 0 0 0 0 0 0 4.4580 -0.0500 -8.0490 C 0 0 0 0 0 0 0 0 0 0 0 0 4.0710 0.4950 -6.8350 C 0 0 0 0 0 0 0 0 0 0 0 0 4.4010 1.7770 -6.5270 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.7430 -1.1000 1.7570 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.3770 0.9830 1.6470 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.7020 1.1690 3.0260 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.4410 -1.0450 3.4670 O 0 0 0 0 0 0 0 0 0 0 0 0 0.6700 1.8260 -1.3070 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8410 1.7600 -0.3690 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7270 1.5870 0.4560 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2390 -1.8920 -0.0800 H 0 0 0 0 0 0 0 0 0 0 0 0 2.1990 -0.4010 -0.1900 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8790 -1.0680 2.1680 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0520 0.4760 1.8340 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.3220 -0.3580 -0.6850 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.3910 1.1360 -0.4190 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.3090 1.3060 -6.0800 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.5450 1.6710 -8.5250 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.6050 1.3050 -9.9930 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2060 0.2500 -6.7760 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3530 1.3250 -2.6980 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3970 0.0710 -1.9870 H 0 0 0 0 0 0 0 0 0 0 0 0 3.4540 1.0100 -4.3160 H 0 0 0 0 0 0 0 0 0 0 0 0 2.4470 -2.1830 -5.5490 H 0 0 0 0 0 0 0 0 0 0 0 0 3.1300 -3.1340 -7.7140 H 0 0 0 0 0 0 0 0 0 0 0 0 4.4140 -1.7740 -9.3110 H 0 0 0 0 0 0 0 0 0 0 0 0 5.0220 0.5450 -8.7520 H 0 0 0 0 0 0 0 0 0 0 0 0 5.2520 1.8680 -6.0760 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.8670 -0.9560 2.8300 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.5540 -0.6000 1.2270 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.7640 -2.1660 1.5300 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3820 1.3820 1.4510 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.1070 1.5060 1.0280 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.7050 2.0940 3.3090 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2520 -1.4600 4.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 39 1 0 0 0 0 1 40 1 0 0 0 0 1 41 1 0 0 0 0 2 3 1 0 0 0 0 2 8 1 0 0 0 0 2 22 1 0 0 0 0 3 4 1 0 0 0 0 3 42 1 0 0 0 0 3 43 1 0 0 0 0 4 5 1 0 0 0 0 4 44 1 0 0 0 0 4 45 1 0 0 0 0 5 6 1 0 0 0 0 5 7 1 0 0 0 0 5 38 1 0 0 0 0 7 8 1 0 0 0 0 7 35 1 0 0 0 0 7 36 1 0 0 0 0 8 9 1 0 0 0 0 8 10 1 0 0 0 0 10 11 1 0 0 0 0 10 46 1 0 0 0 0 10 47 1 0 0 0 0 11 12 2 0 0 0 0 11 15 1 0 0 0 0 12 13 1 0 0 0 0 12 22 1 0 0 0 0 13 14 2 0 0 0 0 14 15 1 0 0 0 0 14 16 1 0 0 0 0 16 17 1 0 0 0 0 16 21 2 0 0 0 0 17 18 2 0 0 0 0 17 48 1 0 0 0 0 18 19 1 0 0 0 0 18 49 1 0 0 0 0 19 20 2 0 0 0 0 19 50 1 0 0 0 0 20 21 1 0 0 0 0 21 51 1 0 0 0 0 22 23 1 0 0 0 0 22 24 1 0 0 0 0 24 25 1 0 0 0 0 24 52 1 0 0 0 0 24 53 1 0 0 0 0 25 26 2 0 0 0 0 25 27 1 0 0 0 0 27 28 1 0 0 0 0 27 54 1 0 0 0 0 28 29 1 0 0 0 0 28 33 2 0 0 0 0 29 30 2 0 0 0 0 29 55 1 0 0 0 0 30 31 1 0 0 0 0 30 56 1 0 0 0 0 31 32 2 0 0 0 0 31 57 1 0 0 0 0 32 33 1 0 0 0 0 32 58 1 0 0 0 0 33 34 1 0 0 0 0 34 59 1 0 0 0 0 35 60 1 0 0 0 0 35 61 1 0 0 0 0 35 62 1 0 0 0 0 36 37 1 0 0 0 0 36 63 1 0 0 0 0 36 64 1 0 0 0 0 37 65 1 0 0 0 0 38 66 1 0 0 0 0 M END