NIH-ZINC03957714 MOE2007 3D CORINA 3.40 0006 02.08.2006 50 53 0 0 0 0 0 0 0 0999 V2000 -0.0170 1.3790 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 1.2100 -0.6800 -0.0110 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3900 0.0280 -0.0180 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3810 1.4190 -0.0130 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1650 2.0920 0.0020 C 0 0 0 0 0 0 0 0 0 0 0 0 3.5810 2.1240 -0.0290 N 0 0 0 0 0 0 0 0 0 0 0 0 4.7840 1.6000 0.3120 C 0 0 0 0 0 0 0 0 0 0 0 0 5.0770 0.3510 0.3490 N 0 0 0 0 0 0 0 0 0 0 0 0 3.9470 -0.8020 -0.0290 S 0 0 0 0 0 0 0 0 0 0 0 0 3.9250 -1.7210 1.0540 O 0 0 0 0 0 0 0 0 0 0 0 0 4.1930 -1.1850 -1.3750 O 0 0 0 0 0 0 0 0 0 0 0 0 5.8760 2.5720 0.6780 C 0 0 0 0 0 0 0 0 0 0 0 0 7.1490 1.7990 1.0300 C 0 0 0 0 0 0 0 0 0 0 0 0 8.2580 2.7850 1.4020 C 0 0 0 0 0 0 0 0 0 0 0 0 9.5120 2.0240 1.7490 C 0 0 0 0 0 0 0 0 0 0 0 0 9.5180 0.8120 1.7030 O 0 0 0 0 0 0 0 0 0 0 0 0 10.6260 2.6910 2.1100 N 0 0 0 0 0 0 0 0 0 0 0 0 11.8560 1.9630 2.4510 C 0 0 0 0 0 0 0 0 0 0 0 0 13.0040 2.5050 1.5930 C 0 0 0 0 0 0 0 0 0 0 0 0 13.0970 4.0220 1.7720 C 0 0 0 0 0 0 0 0 0 0 0 0 11.7930 4.6810 1.3150 C 0 0 0 0 0 0 0 0 0 0 0 0 10.6360 4.1590 2.1650 C 0 0 0 0 0 0 0 0 0 0 0 0 13.3360 4.3310 3.1500 O 0 0 0 0 0 0 0 0 0 0 0 0 14.5820 5.0530 3.2170 C 0 0 0 0 0 0 0 0 0 0 0 0 14.7460 5.6040 1.7790 C 0 0 0 0 0 0 0 0 0 0 0 0 14.1880 4.5290 0.9860 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.9610 1.9030 0.0170 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9260 -0.5570 0.0070 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2260 -1.7600 -0.0160 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1450 3.1720 0.0080 H 0 0 0 0 0 0 0 0 0 0 0 0 3.5550 3.0540 -0.3030 H 0 0 0 0 0 0 0 0 0 0 0 0 6.0740 3.2320 -0.1660 H 0 0 0 0 0 0 0 0 0 0 0 0 5.5620 3.1640 1.5370 H 0 0 0 0 0 0 0 0 0 0 0 0 6.9520 1.1390 1.8740 H 0 0 0 0 0 0 0 0 0 0 0 0 7.4640 1.2060 0.1710 H 0 0 0 0 0 0 0 0 0 0 0 0 8.4560 3.4460 0.5580 H 0 0 0 0 0 0 0 0 0 0 0 0 7.9440 3.3780 2.2620 H 0 0 0 0 0 0 0 0 0 0 0 0 12.0880 2.1100 3.5060 H 0 0 0 0 0 0 0 0 0 0 0 0 11.7200 0.9000 2.2490 H 0 0 0 0 0 0 0 0 0 0 0 0 13.9410 2.0440 1.9060 H 0 0 0 0 0 0 0 0 0 0 0 0 12.8160 2.2730 0.5450 H 0 0 0 0 0 0 0 0 0 0 0 0 11.8720 5.7620 1.4310 H 0 0 0 0 0 0 0 0 0 0 0 0 11.6110 4.4390 0.2680 H 0 0 0 0 0 0 0 0 0 0 0 0 9.6950 4.5450 1.7750 H 0 0 0 0 0 0 0 0 0 0 0 0 10.7680 4.4850 3.1970 H 0 0 0 0 0 0 0 0 0 0 0 0 14.5170 5.8680 3.9370 H 0 0 0 0 0 0 0 0 0 0 0 0 15.4030 4.3810 3.4680 H 0 0 0 0 0 0 0 0 0 0 0 0 14.1750 6.5240 1.6460 H 0 0 0 0 0 0 0 0 0 0 0 0 15.7970 5.7620 1.5380 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 6 2 0 0 0 0 1 28 1 0 0 0 0 2 3 2 0 0 0 0 2 29 1 0 0 0 0 3 4 1 0 0 0 0 3 30 1 0 0 0 0 4 5 2 0 0 0 0 4 10 1 0 0 0 0 5 6 1 0 0 0 0 5 7 1 0 0 0 0 6 31 1 0 0 0 0 7 8 1 0 0 0 0 7 32 1 0 0 0 0 8 9 2 0 0 0 0 8 13 1 0 0 0 0 9 10 1 0 0 0 0 10 11 2 0 0 0 0 10 12 2 0 0 0 0 13 14 1 0 0 0 0 13 33 1 0 0 0 0 13 34 1 0 0 0 0 14 15 1 0 0 0 0 14 35 1 0 0 0 0 14 36 1 0 0 0 0 15 16 1 0 0 0 0 15 37 1 0 0 0 0 15 38 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 23 1 0 0 0 0 19 20 1 0 0 0 0 19 39 1 0 0 0 0 19 40 1 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 22 1 0 0 0 0 21 24 1 0 0 0 0 21 27 1 0 0 0 0 22 23 1 0 0 0 0 22 43 1 0 0 0 0 22 44 1 0 0 0 0 23 45 1 0 0 0 0 23 46 1 0 0 0 0 24 25 1 0 0 0 0 25 26 1 0 0 0 0 25 47 1 0 0 0 0 25 48 1 0 0 0 0 26 27 1 0 0 0 0 26 49 1 0 0 0 0 26 50 1 0 0 0 0 M END