NIH-ZINC03959167 MOE2007 3D CORINA 3.40 0006 02.08.2006 60 64 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 2.0520 -0.6840 -1.1700 C 0 0 0 0 0 0 0 0 0 0 0 0 2.7830 -0.4520 -0.0100 C 0 0 0 0 0 0 0 0 0 0 0 0 4.1440 -0.6690 -0.0060 C 0 0 0 0 0 0 0 0 0 0 0 0 4.7940 -1.1160 -1.1480 C 0 0 0 0 0 0 0 0 0 0 0 0 4.0940 -1.3500 -2.2980 C 0 0 0 0 0 0 0 0 0 0 0 0 2.7140 -1.1380 -2.3250 C 0 0 0 0 0 0 0 0 0 0 0 0 1.9300 -1.3790 -3.5440 C 0 0 0 0 0 0 0 0 0 0 0 0 0.5830 -1.1520 -3.5050 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0230 -0.7050 -2.3210 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.2280 -0.5140 -2.3070 O 0 0 0 0 0 0 0 0 0 0 0 0 2.5270 -1.8150 -4.6770 O 0 0 0 0 0 0 0 0 0 0 0 0 1.6870 -2.0230 -5.8140 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5210 -2.5050 -6.9730 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7170 -2.6550 -6.8380 O 0 0 0 0 0 0 0 0 0 0 0 0 1.9380 -2.7690 -8.1590 N 0 0 0 0 0 0 0 0 0 0 0 0 2.7340 -3.2400 -9.3030 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4150 -2.3570 -10.5140 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2530 -1.7400 -9.5890 C 0 0 0 0 0 0 0 0 0 0 0 0 0.4890 -2.5990 -8.3420 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6270 -1.6450 -11.9840 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.8310 -1.8560 -12.3010 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.7760 -0.9660 -11.8250 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.1150 -1.1550 -12.1130 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.5130 -2.2380 -12.8800 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.5610 -3.1340 -13.3590 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.2200 -2.9350 -13.0720 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.1980 -4.1030 -14.0800 O 0 0 0 0 0 0 0 0 0 0 0 0 -4.5000 -3.5660 -14.3790 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.7460 -2.6450 -13.3000 O 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 2.2870 -0.1040 0.8830 H 0 0 0 0 0 0 0 0 0 0 0 0 4.7120 -0.4880 0.8950 H 0 0 0 0 0 0 0 0 0 0 0 0 5.8610 -1.2800 -1.1280 H 0 0 0 0 0 0 0 0 0 0 0 0 4.6060 -1.6970 -3.1840 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0170 -1.3210 -4.3870 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9310 -2.7710 -5.5750 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2000 -1.0860 -6.0820 H 0 0 0 0 0 0 0 0 0 0 0 0 3.7950 -3.1660 -9.0660 H 0 0 0 0 0 0 0 0 0 0 0 0 2.4760 -4.2750 -9.5270 H 0 0 0 0 0 0 0 0 0 0 0 0 2.7670 -1.3420 -10.3280 H 0 0 0 0 0 0 0 0 0 0 0 0 2.9110 -2.7580 -11.3980 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8150 -1.6950 -9.8040 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6310 -0.7330 -9.4140 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0200 -3.5740 -8.4750 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0660 -2.1020 -7.4700 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2360 -2.0440 -12.7960 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8240 -0.5790 -11.8730 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.4670 -0.1220 -11.2260 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.8510 -0.4580 -11.7400 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4800 -3.6260 -13.4460 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.4880 -3.0420 -15.3340 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.2490 -4.3580 -14.3840 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9620 -2.3380 -10.7340 N 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 33 1 0 0 0 0 1 34 1 0 0 0 0 1 35 1 0 0 0 0 2 3 1 0 0 0 0 2 36 1 0 0 0 0 2 37 1 0 0 0 0 3 4 1 0 0 0 0 3 12 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 38 1 0 0 0 0 6 7 1 0 0 0 0 6 39 1 0 0 0 0 7 8 2 0 0 0 0 7 40 1 0 0 0 0 8 9 1 0 0 0 0 8 41 1 0 0 0 0 9 10 1 0 0 0 0 10 11 2 0 0 0 0 10 14 1 0 0 0 0 11 12 1 0 0 0 0 11 42 1 0 0 0 0 12 13 2 0 0 0 0 14 15 1 0 0 0 0 15 16 1 0 0 0 0 15 43 1 0 0 0 0 15 44 1 0 0 0 0 16 17 2 0 0 0 0 16 18 1 0 0 0 0 18 19 1 0 0 0 0 18 22 1 0 0 0 0 19 20 1 0 0 0 0 19 45 1 0 0 0 0 19 46 1 0 0 0 0 20 47 1 0 0 0 0 20 48 1 0 0 0 0 20 60 1 0 0 0 0 21 22 1 0 0 0 0 21 49 1 0 0 0 0 21 50 1 0 0 0 0 21 60 1 0 0 0 0 22 51 1 0 0 0 0 22 52 1 0 0 0 0 23 24 1 0 0 0 0 23 53 1 0 0 0 0 23 54 1 0 0 0 0 23 60 1 0 0 0 0 24 25 1 0 0 0 0 24 29 2 0 0 0 0 25 26 2 0 0 0 0 25 55 1 0 0 0 0 26 27 1 0 0 0 0 26 56 1 0 0 0 0 27 28 2 0 0 0 0 27 32 1 0 0 0 0 28 29 1 0 0 0 0 28 30 1 0 0 0 0 29 57 1 0 0 0 0 30 31 1 0 0 0 0 31 32 1 0 0 0 0 31 58 1 0 0 0 0 31 59 1 0 0 0 0 M END