NIH-ZINC04245630 MOE2007 3D CORINA 3.40 0006 02.08.2006 61 62 0 0 1 0 0 0 0 0999 V2000 0.3820 1.0470 1.2040 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3500 -0.4440 0.8640 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.0950 -0.9450 0.9060 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.1270 -2.4370 0.5660 C 0 0 3 0 0 0 0 0 0 0 0 0 -0.6310 -2.6250 -0.3860 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.5820 -2.9600 0.5380 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.5210 -4.3540 1.1900 C 0 0 3 0 0 0 0 0 0 0 0 0 -3.1320 -4.3680 2.0930 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4760 -3.2710 1.6980 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.9990 -5.3960 2.7720 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.0130 -5.3960 0.2200 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.2180 -6.0700 -0.4010 O 0 0 0 0 0 0 0 0 0 0 0 0 -4.3360 -5.5810 0.0430 N 0 0 0 0 0 0 0 0 0 0 0 0 -4.8150 -6.5940 -0.9000 C 0 0 3 0 0 0 0 0 0 0 0 0 -4.1400 -7.4500 -0.8870 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.2190 -7.0460 -0.4940 C 0 0 3 0 0 0 0 0 0 0 0 0 -6.9190 -6.2200 -0.6250 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.2110 -7.4810 0.9740 C 0 0 3 0 0 0 0 0 0 0 0 0 -5.8620 -6.6570 1.5960 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.2720 -8.6800 1.1370 C 0 0 3 0 0 0 0 0 0 0 0 0 -5.3040 -9.0300 2.1690 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.7270 -9.8030 0.2000 C 0 0 3 0 0 0 0 0 0 0 0 0 -5.0320 -10.6400 0.2700 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.7540 -9.2780 -1.2370 C 0 0 3 0 0 0 0 0 0 0 0 0 -4.7480 -8.9860 -1.5360 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.6220 -8.1450 -1.3140 O 0 0 0 0 0 0 0 0 0 0 0 0 -6.3600 -10.5800 -2.3460 S 0 0 0 0 0 0 0 0 0 0 0 0 -6.0350 -9.8970 -3.9940 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.0360 -10.2370 0.5760 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.9380 -8.2900 0.8060 O 0 0 0 0 0 0 0 0 0 0 0 0 -7.5340 -7.8510 1.3690 O 0 0 0 0 0 0 0 0 0 0 0 0 -4.8580 -6.0000 -2.3100 C 0 0 3 0 0 0 0 0 0 0 0 0 -5.4810 -5.1060 -2.3080 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.4400 -5.6330 -2.7520 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.4060 -6.9610 -3.2150 O 0 0 0 0 0 0 0 0 0 0 0 0 1.4120 1.4050 1.1740 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2150 1.5990 0.4780 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0270 1.2010 2.2030 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7590 -0.5980 -0.1340 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9470 -0.9950 1.5900 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.5040 -0.7920 1.9050 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.6920 -0.3940 0.1800 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.2320 -2.3010 1.1140 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.9360 -3.0390 -0.4900 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6030 -3.3310 1.5590 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7150 -2.8490 2.6740 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.5040 -6.3520 2.6390 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.4650 -4.8490 3.5910 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0520 -5.5690 3.0020 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.9720 -5.0420 0.5400 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.3650 -10.6070 -4.7530 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.5790 -8.9600 -4.1120 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.9660 -9.7140 -4.1080 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.3880 -10.9490 0.0240 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.2880 -9.0020 0.8880 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.6030 -8.1390 2.2900 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.8170 -6.5280 -2.7530 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.4700 -5.2100 -3.7560 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.0220 -4.9010 -2.0610 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.3430 -7.1470 -3.0700 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1050 -4.6090 1.5350 N 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 6 1 0 0 0 0 4 9 1 0 0 0 0 6 7 1 0 0 0 0 6 43 1 0 0 0 0 6 44 1 0 0 0 0 7 8 1 0 0 0 0 7 11 1 0 0 0 0 7 61 1 0 0 0 0 9 45 1 0 0 0 0 9 46 1 0 0 0 0 9 61 1 0 0 0 0 10 47 1 0 0 0 0 10 48 1 0 0 0 0 10 49 1 0 0 0 0 10 61 1 0 0 0 0 11 12 2 0 0 0 0 11 13 1 0 0 0 0 13 14 1 0 0 0 0 13 50 1 0 0 0 0 14 15 1 0 0 0 0 14 16 1 0 0 0 0 14 32 1 0 0 0 0 16 17 1 0 0 0 0 16 18 1 0 0 0 0 16 26 1 0 0 0 0 18 19 1 0 0 0 0 18 20 1 0 0 0 0 18 31 1 0 0 0 0 20 21 1 0 0 0 0 20 22 1 0 0 0 0 20 30 1 0 0 0 0 22 23 1 0 0 0 0 22 24 1 0 0 0 0 22 29 1 0 0 0 0 24 25 1 0 0 0 0 24 26 1 0 0 0 0 24 27 1 0 0 0 0 27 28 1 0 0 0 0 28 51 1 0 0 0 0 28 52 1 0 0 0 0 28 53 1 0 0 0 0 29 54 1 0 0 0 0 30 55 1 0 0 0 0 31 56 1 0 0 0 0 32 33 1 0 0 0 0 32 34 1 0 0 0 0 32 35 1 0 0 0 0 34 57 1 0 0 0 0 34 58 1 0 0 0 0 34 59 1 0 0 0 0 35 60 1 0 0 0 0 M END