NIH-ZINC06577399 MOE2007 3D CORINA 3.40 0006 02.08.2006 48 51 0 0 0 0 0 0 0 0999 V2000 -0.0170 1.3770 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 1.2150 -0.6790 -0.0130 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4050 0.0360 -0.0210 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3800 1.4160 -0.0130 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1700 2.0870 0.0020 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1410 3.8480 0.0110 S 0 0 0 0 0 0 0 0 0 0 0 0 2.3790 4.2730 -0.5420 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.1200 4.2320 -0.5190 O 0 0 0 0 0 0 0 0 0 0 0 0 1.1480 4.3300 1.5960 N 0 0 0 0 0 0 0 0 0 0 0 0 2.4150 4.5690 2.3000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4260 3.7410 3.5890 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1780 4.0690 4.4120 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0740 3.7000 3.6120 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1130 4.5330 2.3220 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2030 3.2810 5.6960 C 0 0 0 0 0 0 0 0 0 0 0 0 2.1270 2.5320 5.9310 O 0 0 0 0 0 0 0 0 0 0 0 0 0.1980 3.4100 6.5850 N 0 0 0 0 0 0 0 0 0 0 0 0 0.2200 2.6830 7.7700 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.6920 2.7330 8.6890 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.5100 1.9740 9.7530 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6100 1.2490 9.7330 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4530 1.5890 8.2240 S 0 0 0 0 0 0 0 0 0 0 0 0 3.7210 -0.6970 -0.0380 C 0 0 0 0 0 0 0 0 0 0 0 0 3.5930 -1.9950 0.7600 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3580 -2.7400 0.3320 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3680 -3.9530 0.3050 O 0 0 0 0 0 0 0 0 0 0 0 0 1.2410 -2.0770 -0.0220 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.9600 1.9040 0.0170 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9250 -0.5580 0.0080 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3050 1.9730 -0.0190 H 0 0 0 0 0 0 0 0 0 0 0 0 3.2480 4.2680 1.6650 H 0 0 0 0 0 0 0 0 0 0 0 0 2.5030 5.6280 2.5450 H 0 0 0 0 0 0 0 0 0 0 0 0 2.4290 2.6800 3.3400 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3180 3.9820 4.1680 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1630 5.1350 4.6400 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0470 2.6400 3.3630 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9610 3.9120 4.2080 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2270 5.5890 2.5680 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9480 4.2090 1.7010 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5420 4.0090 6.3980 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2110 1.9420 10.5740 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9390 0.5690 10.5040 H 0 0 0 0 0 0 0 0 0 0 0 0 3.9940 -0.9290 -1.0680 H 0 0 0 0 0 0 0 0 0 0 0 0 4.4920 -0.0700 0.4090 H 0 0 0 0 0 0 0 0 0 0 0 0 4.4700 -2.6170 0.5830 H 0 0 0 0 0 0 0 0 0 0 0 0 3.5250 -1.7620 1.8220 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4490 -2.5720 -0.2830 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 29 1 0 0 0 0 2 3 2 0 0 0 0 2 30 1 0 0 0 0 3 4 1 0 0 0 0 3 28 1 0 0 0 0 4 5 2 0 0 0 0 4 24 1 0 0 0 0 5 6 1 0 0 0 0 5 31 1 0 0 0 0 6 7 1 0 0 0 0 7 8 2 0 0 0 0 7 9 2 0 0 0 0 7 10 1 0 0 0 0 10 11 1 0 0 0 0 10 15 1 0 0 0 0 11 12 1 0 0 0 0 11 32 1 0 0 0 0 11 33 1 0 0 0 0 12 13 1 0 0 0 0 12 34 1 0 0 0 0 12 35 1 0 0 0 0 13 14 1 0 0 0 0 13 16 1 0 0 0 0 13 36 1 0 0 0 0 14 15 1 0 0 0 0 14 37 1 0 0 0 0 14 38 1 0 0 0 0 15 39 1 0 0 0 0 15 40 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 41 1 0 0 0 0 19 20 2 0 0 0 0 19 23 1 0 0 0 0 20 21 1 0 0 0 0 21 22 2 0 0 0 0 21 42 1 0 0 0 0 22 23 1 0 0 0 0 22 43 1 0 0 0 0 24 25 1 0 0 0 0 24 44 1 0 0 0 0 24 45 1 0 0 0 0 25 26 1 0 0 0 0 25 46 1 0 0 0 0 25 47 1 0 0 0 0 26 27 2 0 0 0 0 26 28 1 0 0 0 0 28 48 1 0 0 0 0 M END