ANALYTICONDISCOVERY-ZINC03839107 MOE2007 3D CORINA 3.40 0006 02.08.2006 52 52 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 0.7420 -0.5110 1.2420 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.3720 -0.5110 0.0120 N 0 0 0 0 0 0 0 0 0 0 0 0 -1.6430 -1.7340 -0.4850 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.7470 -2.4170 -0.9420 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.9080 -2.2010 -0.4750 N 0 0 0 0 0 0 0 0 0 0 0 0 -3.2020 -3.5300 -1.0160 C 0 0 3 0 0 0 0 0 0 0 0 0 -2.5530 -3.7530 -1.8630 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.0590 -4.6140 0.0850 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.0150 -5.7160 -0.4380 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.1470 -4.9820 -1.0330 N 0 0 0 0 0 0 0 0 0 0 0 0 -4.6870 -3.6380 -1.4220 C 0 0 3 0 0 0 0 0 0 0 0 0 -5.2700 -2.8810 -0.8980 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.8250 -3.4560 -2.9120 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.9500 -4.4230 -3.6320 O 0 0 0 0 0 0 0 0 0 0 0 0 -4.8090 -2.2170 -3.4440 N 0 0 0 0 0 0 0 0 0 0 0 0 -4.6580 -1.0480 -2.5740 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.9440 -2.0400 -4.8920 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.4010 -1.9010 -5.2480 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.2450 -1.9460 -4.3780 O 0 0 0 0 0 0 0 0 0 0 0 0 -6.7670 -1.7280 -6.5330 N 0 0 0 0 0 0 0 0 0 0 0 0 -6.3950 -5.4630 -1.1970 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.2510 -4.7670 -1.7020 O 0 0 0 0 0 0 0 0 0 0 0 0 -6.7270 -6.8640 -0.7550 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.4720 -7.2130 -1.1080 S 0 0 0 0 0 0 0 0 0 0 0 0 -8.6760 -8.9150 -0.5150 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 0.5120 -0.3560 -0.8950 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7570 -1.6010 1.2360 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7650 -0.1340 1.2340 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2320 -0.1590 2.1380 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.0870 0.0330 0.3770 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.6230 -1.6560 -0.1100 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.0340 -4.9810 0.1410 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.3910 -4.2360 1.0520 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.5170 -6.3230 -1.1930 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.3590 -6.3410 0.3860 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.5990 -0.8150 -2.4600 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.1720 -0.1960 -3.0180 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.0900 -1.2640 -1.5970 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.4070 -1.1430 -5.1990 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.5250 -2.9070 -5.4040 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.0930 -1.6920 -7.2290 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.7060 -1.6380 -6.7620 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.0990 -7.5740 -1.2930 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.5470 -6.9600 0.3160 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.4480 -8.9590 0.5500 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.7050 -9.2360 -0.6800 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.9990 -9.5730 -1.0600 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 4 1 0 0 0 0 2 31 1 0 0 0 0 3 32 1 0 0 0 0 3 33 1 0 0 0 0 3 34 1 0 0 0 0 4 5 1 0 0 0 0 4 35 1 0 0 0 0 5 6 2 0 0 0 0 5 7 1 0 0 0 0 7 8 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 8 13 1 0 0 0 0 10 11 1 0 0 0 0 10 37 1 0 0 0 0 10 38 1 0 0 0 0 11 12 1 0 0 0 0 11 39 1 0 0 0 0 11 40 1 0 0 0 0 12 13 1 0 0 0 0 12 23 1 0 0 0 0 13 14 1 0 0 0 0 13 15 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 19 1 0 0 0 0 18 41 1 0 0 0 0 18 42 1 0 0 0 0 18 43 1 0 0 0 0 19 20 1 0 0 0 0 19 44 1 0 0 0 0 19 45 1 0 0 0 0 20 21 2 0 0 0 0 20 22 1 0 0 0 0 22 46 1 0 0 0 0 22 47 1 0 0 0 0 23 24 2 0 0 0 0 23 25 1 0 0 0 0 25 26 1 0 0 0 0 25 48 1 0 0 0 0 25 49 1 0 0 0 0 26 27 1 0 0 0 0 27 50 1 0 0 0 0 27 51 1 0 0 0 0 27 52 1 0 0 0 0 M END