NIH-ZINC04039079 MOE2007 3D CORINA 3.40 0006 02.08.2006 58 62 0 0 1 0 0 0 0 0999 V2000 2.2700 -0.3760 0.3570 C 0 0 0 0 0 0 0 0 0 0 0 0 0.8500 -0.8460 0.1670 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1180 -0.9420 1.1620 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.2650 -1.4130 0.5450 N 0 0 0 0 0 0 0 0 0 0 0 0 -2.5070 -1.6970 1.0160 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.4720 -2.1550 0.1840 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.1960 -2.3410 -1.1770 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.9510 -2.0580 -1.6560 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.9640 -1.5830 -0.7760 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3070 -1.2310 -0.9730 N 0 0 0 0 0 0 0 0 0 0 0 0 0.0380 -0.6260 2.5230 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1220 0.7990 2.9880 C 0 0 3 0 0 0 0 0 0 0 0 0 0.7240 1.0510 4.2470 C 0 0 3 0 0 0 0 0 0 0 0 0 1.2640 0.1450 4.5210 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2070 1.4210 5.3140 N 0 0 0 0 0 0 0 0 0 0 0 0 -1.4730 1.4250 4.8780 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.4350 1.6980 5.5660 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.5460 1.0520 3.4380 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.5440 0.9680 2.7620 O 0 0 0 0 0 0 0 0 0 0 0 0 0.1950 1.7450 6.6840 C 0 0 0 0 0 0 0 0 0 0 0 0 0.4660 3.2470 6.7950 C 0 0 0 0 0 0 0 0 0 0 0 0 0.9090 5.0270 8.3770 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2750 5.3190 9.8340 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5240 4.6950 10.1420 O 0 0 0 0 0 0 0 0 0 0 0 0 2.5210 3.2770 9.9510 C 0 0 0 0 0 0 0 0 0 0 0 0 2.1680 2.9640 8.4950 C 0 0 0 0 0 0 0 0 0 0 0 0 1.6960 2.1760 3.9970 C 0 0 0 0 0 0 0 0 0 0 0 0 3.0220 1.9120 3.6930 C 0 0 0 0 0 0 0 0 0 0 0 0 3.8850 2.9690 3.4700 C 0 0 0 0 0 0 0 0 0 0 0 0 3.4590 4.2140 3.5440 N 0 0 0 0 0 0 0 0 0 0 0 0 2.2040 4.5020 3.8320 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2830 3.4980 4.0610 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3020 -1.5010 3.3240 O 0 0 0 0 0 0 0 0 0 0 0 0 2.8880 -1.2130 0.6830 H 0 0 0 0 0 0 0 0 0 0 0 0 2.6530 0.0120 -0.5870 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2950 0.4100 1.1110 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.7270 -1.5560 2.0640 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.4560 -2.3770 0.5700 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.9640 -2.7070 -1.8420 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.7250 -2.1980 -2.7030 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6040 1.4680 7.3720 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1000 1.1930 6.9380 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2650 3.5230 6.1060 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4390 3.7990 6.5420 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0700 5.4530 8.1540 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6560 5.4690 7.7180 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3610 6.3960 9.9790 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4990 4.9240 10.4900 H 0 0 0 0 0 0 0 0 0 0 0 0 3.5090 2.8770 10.1800 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7820 2.8230 10.6110 H 0 0 0 0 0 0 0 0 0 0 0 0 2.9360 3.3720 7.8380 H 0 0 0 0 0 0 0 0 0 0 0 0 2.1100 1.8840 8.3590 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3770 0.8940 3.6300 H 0 0 0 0 0 0 0 0 0 0 0 0 4.9200 2.7720 3.2320 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8920 5.5350 3.8850 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2560 3.7400 4.2920 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1580 1.4920 2.1950 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8700 3.5720 8.1690 N 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 34 1 0 0 0 0 1 35 1 0 0 0 0 1 36 1 0 0 0 0 2 3 2 0 0 0 0 2 10 1 0 0 0 0 3 4 1 0 0 0 0 3 11 1 0 0 0 0 4 5 1 0 0 0 0 4 9 1 0 0 0 0 5 6 2 0 0 0 0 5 37 1 0 0 0 0 6 7 1 0 0 0 0 6 38 1 0 0 0 0 7 8 2 0 0 0 0 7 39 1 0 0 0 0 8 9 1 0 0 0 0 8 40 1 0 0 0 0 9 10 2 0 0 0 0 11 12 1 0 0 0 0 11 33 2 0 0 0 0 12 13 1 0 0 0 0 12 18 1 0 0 0 0 12 57 1 0 0 0 0 13 14 1 0 0 0 0 13 15 1 0 0 0 0 13 27 1 0 0 0 0 15 16 1 0 0 0 0 15 20 1 0 0 0 0 16 17 2 0 0 0 0 16 18 1 0 0 0 0 18 19 2 0 0 0 0 20 21 1 0 0 0 0 20 41 1 0 0 0 0 20 42 1 0 0 0 0 21 43 1 0 0 0 0 21 44 1 0 0 0 0 21 58 1 0 0 0 0 22 23 1 0 0 0 0 22 45 1 0 0 0 0 22 46 1 0 0 0 0 22 58 1 0 0 0 0 23 24 1 0 0 0 0 23 47 1 0 0 0 0 23 48 1 0 0 0 0 24 25 1 0 0 0 0 25 26 1 0 0 0 0 25 49 1 0 0 0 0 25 50 1 0 0 0 0 26 51 1 0 0 0 0 26 52 1 0 0 0 0 26 58 1 0 0 0 0 27 28 1 0 0 0 0 27 32 2 0 0 0 0 28 29 2 0 0 0 0 28 53 1 0 0 0 0 29 30 1 0 0 0 0 29 54 1 0 0 0 0 30 31 2 0 0 0 0 31 32 1 0 0 0 0 31 55 1 0 0 0 0 32 56 1 0 0 0 0 M END