NIH-ZINC04195753 MOE2007 3D CORINA 3.40 0006 02.08.2006 60 62 0 0 0 0 0 0 0 0999 V2000 -0.0170 1.4250 0.0100 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0020 -0.0040 0.0020 O 0 0 0 0 0 0 0 0 0 0 0 0 0.6260 -0.6190 1.0420 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2070 0.1370 2.0480 C 0 0 0 0 0 0 0 0 0 0 0 0 1.8410 -0.4900 3.1050 C 0 0 0 0 0 0 0 0 0 0 0 0 1.8980 -1.8700 3.1610 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3200 -2.6300 2.1610 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6780 -2.0080 1.1020 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1050 -2.7540 0.1200 O 0 0 0 0 0 0 0 0 0 0 0 0 0.1970 -4.1740 0.2470 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5910 -2.5480 4.3150 C 0 0 0 0 0 0 0 0 0 0 0 0 1.5830 -2.7980 5.4390 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2570 -3.4570 6.5610 N 0 0 0 0 0 0 0 0 0 0 0 0 1.5620 -3.7770 7.6700 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3790 -3.5190 7.7400 O 0 0 0 0 0 0 0 0 0 0 0 0 2.2550 -4.4540 8.8240 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3140 -4.6880 9.8740 O 0 0 0 0 0 0 0 0 0 0 0 0 1.7800 -5.2970 10.9960 C 0 0 0 0 0 0 0 0 0 0 0 0 0.9210 -5.5540 12.0550 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3980 -6.1730 13.1940 C 0 0 0 0 0 0 0 0 0 0 0 0 2.7290 -6.5350 13.2800 C 0 0 0 0 0 0 0 0 0 0 0 0 3.5880 -6.2790 12.2270 C 0 0 0 0 0 0 0 0 0 0 0 0 3.1150 -5.6660 11.0830 C 0 0 0 0 0 0 0 0 0 0 0 0 3.3340 -7.3240 14.7350 S 0 0 0 0 0 0 0 0 0 0 0 0 4.7320 -7.0730 14.7760 O 0 0 0 0 0 0 0 0 0 0 0 0 2.4480 -6.9620 15.7860 O 0 0 0 0 0 0 0 0 0 0 0 0 3.1580 -8.9560 14.5170 N 0 0 0 0 0 0 0 0 0 0 0 0 4.2300 -9.7590 13.9080 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5040 -10.9660 14.8120 C 0 0 0 0 0 0 0 0 0 0 0 0 3.2740 -11.6450 15.0760 O 0 0 0 0 0 0 0 0 0 0 0 0 2.3110 -10.8590 15.7820 C 0 0 0 0 0 0 0 0 0 0 0 0 1.9270 -9.6480 14.9320 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0050 1.8020 0.0020 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5440 1.7860 -0.8730 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5280 1.7760 0.9070 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1650 1.2150 2.0060 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2940 0.1000 3.8880 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3660 -3.7080 2.2070 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2850 -4.4890 1.1720 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3000 -4.6480 -0.6000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2460 -4.4700 0.2650 H 0 0 0 0 0 0 0 0 0 0 0 0 3.0060 -3.4980 3.9810 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3940 -1.9090 4.6820 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1680 -1.8470 5.7720 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7800 -3.4370 5.0710 H 0 0 0 0 0 0 0 0 0 0 0 0 3.2030 -3.6630 6.5050 H 0 0 0 0 0 0 0 0 0 0 0 0 2.6710 -5.4050 8.4900 H 0 0 0 0 0 0 0 0 0 0 0 0 3.0580 -3.8160 9.1910 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1190 -5.2710 11.9880 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7300 -6.3730 14.0190 H 0 0 0 0 0 0 0 0 0 0 0 0 4.6270 -6.5630 12.2970 H 0 0 0 0 0 0 0 0 0 0 0 0 3.7840 -5.4710 10.2580 H 0 0 0 0 0 0 0 0 0 0 0 0 3.9170 -10.1030 12.9220 H 0 0 0 0 0 0 0 0 0 0 0 0 5.1340 -9.1560 13.8170 H 0 0 0 0 0 0 0 0 0 0 0 0 5.1950 -11.6450 14.3140 H 0 0 0 0 0 0 0 0 0 0 0 0 4.9410 -10.6260 15.7510 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4250 -11.4620 15.9810 H 0 0 0 0 0 0 0 0 0 0 0 0 2.7400 -10.5180 16.7250 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3060 -8.9710 15.5190 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3780 -9.9800 14.0520 H 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 3 4 1 0 0 0 0 3 8 2 0 0 0 0 4 5 2 0 0 0 0 4 36 1 0 0 0 0 5 6 1 0 0 0 0 5 37 1 0 0 0 0 6 7 2 0 0 0 0 6 11 1 0 0 0 0 7 8 1 0 0 0 0 7 38 1 0 0 0 0 8 9 1 0 0 0 0 9 10 1 0 0 0 0 10 39 1 0 0 0 0 10 40 1 0 0 0 0 10 41 1 0 0 0 0 11 12 1 0 0 0 0 11 42 1 0 0 0 0 11 43 1 0 0 0 0 12 13 1 0 0 0 0 12 44 1 0 0 0 0 12 45 1 0 0 0 0 13 14 1 0 0 0 0 13 46 1 0 0 0 0 14 15 2 0 0 0 0 14 16 1 0 0 0 0 16 17 1 0 0 0 0 16 47 1 0 0 0 0 16 48 1 0 0 0 0 17 18 1 0 0 0 0 18 19 1 0 0 0 0 18 23 2 0 0 0 0 19 20 2 0 0 0 0 19 49 1 0 0 0 0 20 21 1 0 0 0 0 20 50 1 0 0 0 0 21 22 2 0 0 0 0 21 24 1 0 0 0 0 22 23 1 0 0 0 0 22 51 1 0 0 0 0 23 52 1 0 0 0 0 24 25 2 0 0 0 0 24 26 2 0 0 0 0 24 27 1 0 0 0 0 27 28 1 0 0 0 0 27 32 1 0 0 0 0 28 29 1 0 0 0 0 28 53 1 0 0 0 0 28 54 1 0 0 0 0 29 30 1 0 0 0 0 29 55 1 0 0 0 0 29 56 1 0 0 0 0 30 31 1 0 0 0 0 31 32 1 0 0 0 0 31 57 1 0 0 0 0 31 58 1 0 0 0 0 32 59 1 0 0 0 0 32 60 1 0 0 0 0 M END