NIH-ZINC04388873 MOE2007 3D CORINA 3.40 0006 02.08.2006 66 68 0 0 0 0 0 0 0 0999 V2000 -0.0590 3.0850 0.0540 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0840 1.6720 -0.1570 O 0 0 0 0 0 0 0 0 0 0 0 0 0.5240 0.8960 0.7810 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1280 1.4840 1.8770 C 0 0 0 0 0 0 0 0 0 0 0 0 1.7510 0.6870 2.8400 C 0 0 0 0 0 0 0 0 0 0 0 0 1.7630 -0.7020 2.6920 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1580 -1.2850 1.5950 C 0 0 0 0 0 0 0 0 0 0 0 0 0.5320 -0.4880 0.6390 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0670 -1.0640 -0.4360 O 0 0 0 0 0 0 0 0 0 0 0 0 0.7400 -1.2660 -1.5980 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1700 -2.6370 1.4500 O 0 0 0 0 0 0 0 0 0 0 0 0 1.8250 -3.3930 2.4710 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3970 1.3120 4.0110 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3870 2.5210 4.1380 O 0 0 0 0 0 0 0 0 0 0 0 0 2.9990 0.5420 4.9390 N 0 0 0 0 0 0 0 0 0 0 0 0 3.6400 1.1620 6.1010 C 0 0 0 0 0 0 0 0 0 0 0 0 3.6830 0.1590 7.2580 C 0 0 0 0 0 0 0 0 0 0 0 0 4.4080 0.7920 8.4480 C 0 0 0 0 0 0 0 0 0 0 0 0 5.7540 2.1640 6.9730 C 0 0 0 0 0 0 0 0 0 0 0 0 5.0700 1.5720 5.7390 C 0 0 0 0 0 0 0 0 0 0 0 0 6.5420 1.6490 9.2040 C 0 0 0 0 0 0 0 0 0 0 0 0 7.9910 1.7900 8.8160 C 0 0 0 0 0 0 0 0 0 0 0 0 8.3470 1.5140 7.6890 O 0 0 0 0 0 0 0 0 0 0 0 0 8.8920 2.2210 9.7200 N 0 0 0 0 0 0 0 0 0 0 0 0 10.2530 2.2470 9.3950 C 0 0 0 0 0 0 0 0 0 0 0 0 11.0750 3.2370 9.9210 C 0 0 0 0 0 0 0 0 0 0 0 0 12.4200 3.2670 9.6030 C 0 0 0 0 0 0 0 0 0 0 0 0 12.9560 2.3140 8.7610 C 0 0 0 0 0 0 0 0 0 0 0 0 12.1400 1.3150 8.2270 C 0 0 0 0 0 0 0 0 0 0 0 0 10.7830 1.2820 8.5530 C 0 0 0 0 0 0 0 0 0 0 0 0 12.7110 0.2940 7.3250 C 0 0 0 0 0 0 0 0 0 0 0 0 11.9980 -0.5740 6.8620 O 0 0 0 0 0 0 0 0 0 0 0 0 14.0220 0.3250 7.0170 O 0 0 0 0 0 0 0 0 0 0 0 0 14.5140 -0.7100 6.1250 C 0 0 0 0 0 0 0 0 0 0 0 0 0.9740 3.4290 0.0940 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5770 3.5840 -0.7650 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5570 3.3200 0.9960 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1180 2.5580 1.9880 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2450 -1.3200 3.4360 H 0 0 0 0 0 0 0 0 0 0 0 0 1.5800 -1.9150 -1.3480 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1410 -1.7320 -2.3800 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1160 -0.3060 -1.9510 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7610 -4.4550 2.2340 H 0 0 0 0 0 0 0 0 0 0 0 0 2.8720 -3.0950 2.5280 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3410 -3.2040 3.4300 H 0 0 0 0 0 0 0 0 0 0 0 0 3.0070 -0.4230 4.8380 H 0 0 0 0 0 0 0 0 0 0 0 0 3.0730 2.0420 6.4040 H 0 0 0 0 0 0 0 0 0 0 0 0 2.6660 -0.1040 7.5490 H 0 0 0 0 0 0 0 0 0 0 0 0 4.2160 -0.7380 6.9420 H 0 0 0 0 0 0 0 0 0 0 0 0 3.8670 1.6810 8.7720 H 0 0 0 0 0 0 0 0 0 0 0 0 4.4530 0.0750 9.2680 H 0 0 0 0 0 0 0 0 0 0 0 0 6.7780 2.4440 6.7220 H 0 0 0 0 0 0 0 0 0 0 0 0 5.2070 3.0460 7.3040 H 0 0 0 0 0 0 0 0 0 0 0 0 5.6240 0.6980 5.3990 H 0 0 0 0 0 0 0 0 0 0 0 0 5.0440 2.3190 4.9440 H 0 0 0 0 0 0 0 0 0 0 0 0 6.4530 0.9370 10.0240 H 0 0 0 0 0 0 0 0 0 0 0 0 6.1550 2.6180 9.5200 H 0 0 0 0 0 0 0 0 0 0 0 0 8.5980 2.5140 10.5970 H 0 0 0 0 0 0 0 0 0 0 0 0 10.6610 3.9850 10.5800 H 0 0 0 0 0 0 0 0 0 0 0 0 13.0530 4.0390 10.0150 H 0 0 0 0 0 0 0 0 0 0 0 0 14.0070 2.3410 8.5150 H 0 0 0 0 0 0 0 0 0 0 0 0 10.1470 0.5090 8.1470 H 0 0 0 0 0 0 0 0 0 0 0 0 15.5820 -0.5690 5.9590 H 0 0 0 0 0 0 0 0 0 0 0 0 14.3420 -1.6880 6.5740 H 0 0 0 0 0 0 0 0 0 0 0 0 13.9870 -0.6490 5.1730 H 0 0 0 0 0 0 0 0 0 0 0 0 5.7710 1.1660 8.0500 N 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 35 1 0 0 0 0 1 36 1 0 0 0 0 1 37 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 38 1 0 0 0 0 5 6 1 0 0 0 0 5 13 1 0 0 0 0 6 7 2 0 0 0 0 6 39 1 0 0 0 0 7 8 1 0 0 0 0 7 11 1 0 0 0 0 8 9 1 0 0 0 0 9 10 1 0 0 0 0 10 40 1 0 0 0 0 10 41 1 0 0 0 0 10 42 1 0 0 0 0 11 12 1 0 0 0 0 12 43 1 0 0 0 0 12 44 1 0 0 0 0 12 45 1 0 0 0 0 13 14 2 0 0 0 0 13 15 1 0 0 0 0 15 16 1 0 0 0 0 15 46 1 0 0 0 0 16 17 1 0 0 0 0 16 20 1 0 0 0 0 16 47 1 0 0 0 0 17 18 1 0 0 0 0 17 48 1 0 0 0 0 17 49 1 0 0 0 0 18 50 1 0 0 0 0 18 51 1 0 0 0 0 18 66 1 0 0 0 0 19 20 1 0 0 0 0 19 52 1 0 0 0 0 19 53 1 0 0 0 0 19 66 1 0 0 0 0 20 54 1 0 0 0 0 20 55 1 0 0 0 0 21 22 1 0 0 0 0 21 56 1 0 0 0 0 21 57 1 0 0 0 0 21 66 1 0 0 0 0 22 23 2 0 0 0 0 22 24 1 0 0 0 0 24 25 1 0 0 0 0 24 58 1 0 0 0 0 25 26 1 0 0 0 0 25 30 2 0 0 0 0 26 27 2 0 0 0 0 26 59 1 0 0 0 0 27 28 1 0 0 0 0 27 60 1 0 0 0 0 28 29 2 0 0 0 0 28 61 1 0 0 0 0 29 30 1 0 0 0 0 29 31 1 0 0 0 0 30 62 1 0 0 0 0 31 32 2 0 0 0 0 31 33 1 0 0 0 0 33 34 1 0 0 0 0 34 63 1 0 0 0 0 34 64 1 0 0 0 0 34 65 1 0 0 0 0 M END