CHEMBRIDGE-ZINC01066490 MOE2007 3D CORINA 3.40 0006 02.08.2006 47 50 0 0 0 0 0 0 0 0999 V2000 -0.0600 1.3900 -0.1100 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0300 -0.1380 -0.0290 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6970 -0.5480 1.1750 N 0 0 0 0 0 0 0 0 0 0 0 0 0.1880 -0.6910 2.4450 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1790 -1.0740 3.2170 N 0 0 0 0 0 0 0 0 0 0 0 0 2.2580 -1.1790 2.5260 N 0 0 0 0 0 0 0 0 0 0 0 0 2.0210 -0.8760 1.2700 C 0 0 0 0 0 0 0 0 0 0 0 0 3.1930 -0.8850 -0.0450 S 0 0 0 0 0 0 0 0 0 0 0 0 4.6730 -1.4100 0.8550 C 0 0 0 0 0 0 0 0 0 0 0 0 5.8380 -1.4900 -0.0970 C 0 0 0 0 0 0 0 0 0 0 0 0 5.6840 -1.2190 -1.2690 O 0 0 0 0 0 0 0 0 0 0 0 0 7.0520 -1.8640 0.3540 N 0 0 0 0 0 0 0 0 0 0 0 0 8.2050 -1.9490 -0.5570 C 0 0 0 0 0 0 0 0 0 0 0 0 9.3700 -1.1700 0.0630 C 0 0 0 0 0 0 0 0 0 0 0 0 9.5830 -1.6260 1.4010 O 0 0 0 0 0 0 0 0 0 0 0 0 8.4760 -1.4050 2.2780 C 0 0 0 0 0 0 0 0 0 0 0 0 7.2660 -2.1910 1.7720 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.2090 -0.4560 2.8630 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.3290 -0.9030 2.2370 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.4350 -0.4860 2.9200 N 0 0 0 0 0 0 0 0 0 0 0 0 -4.3500 -0.6810 2.6650 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.0640 0.2530 4.0220 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.6600 0.3020 4.0430 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.0000 0.9860 5.0620 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.7310 1.6100 6.0490 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.1180 1.5590 6.0310 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.7840 0.8940 5.0260 C 0 0 0 0 0 0 0 0 0 0 0 0 0.9590 1.7720 -0.1530 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6010 1.6950 -1.0060 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5620 1.7900 0.7700 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0500 -0.5200 0.0140 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4720 -0.5390 -0.9100 H 0 0 0 0 0 0 0 0 0 0 0 0 4.8950 -0.6880 1.6410 H 0 0 0 0 0 0 0 0 0 0 0 0 4.4990 -2.3900 1.3000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.4910 -2.9930 -0.6900 H 0 0 0 0 0 0 0 0 0 0 0 0 7.9440 -1.5140 -1.5210 H 0 0 0 0 0 0 0 0 0 0 0 0 10.2730 -1.3340 -0.5250 H 0 0 0 0 0 0 0 0 0 0 0 0 9.1310 -0.1060 0.0750 H 0 0 0 0 0 0 0 0 0 0 0 0 8.7340 -1.7390 3.2830 H 0 0 0 0 0 0 0 0 0 0 0 0 8.2330 -0.3420 2.2980 H 0 0 0 0 0 0 0 0 0 0 0 0 6.3830 -1.9160 2.3500 H 0 0 0 0 0 0 0 0 0 0 0 0 7.4560 -3.2600 1.8780 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.3420 -1.4980 1.3360 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0790 1.0270 5.0780 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2220 2.1400 6.8400 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.6800 2.0520 6.8110 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.8630 0.8590 5.0230 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 28 1 0 0 0 0 1 29 1 0 0 0 0 1 30 1 0 0 0 0 2 3 1 0 0 0 0 2 31 1 0 0 0 0 2 32 1 0 0 0 0 3 4 1 0 0 0 0 3 7 1 0 0 0 0 4 5 2 0 0 0 0 4 18 1 0 0 0 0 5 6 1 0 0 0 0 6 7 2 0 0 0 0 7 8 1 0 0 0 0 8 9 1 0 0 0 0 9 10 1 0 0 0 0 9 33 1 0 0 0 0 9 34 1 0 0 0 0 10 11 2 0 0 0 0 10 12 1 0 0 0 0 12 13 1 0 0 0 0 12 17 1 0 0 0 0 13 14 1 0 0 0 0 13 35 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 16 1 0 0 0 0 16 17 1 0 0 0 0 16 39 1 0 0 0 0 16 40 1 0 0 0 0 17 41 1 0 0 0 0 17 42 1 0 0 0 0 18 19 2 0 0 0 0 18 23 1 0 0 0 0 19 20 1 0 0 0 0 19 43 1 0 0 0 0 20 21 1 0 0 0 0 20 22 1 0 0 0 0 22 23 1 0 0 0 0 22 27 2 0 0 0 0 23 24 2 0 0 0 0 24 25 1 0 0 0 0 24 44 1 0 0 0 0 25 26 2 0 0 0 0 25 45 1 0 0 0 0 26 27 1 0 0 0 0 26 46 1 0 0 0 0 27 47 1 0 0 0 0 M END