CHEMBRIDGE-ZINC04095156 MOE2007 3D CORINA 3.40 0006 02.08.2006 35 38 0 0 0 0 0 0 0 0999 V2000 -0.1180 1.1920 0.0740 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2250 -0.2750 0.0900 C 0 0 0 0 0 0 0 0 0 0 0 0 0.4920 -1.0950 1.2720 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7610 -2.3870 0.7780 N 0 0 0 0 0 0 0 0 0 0 0 0 1.0810 -3.6230 1.2820 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2540 -4.6100 0.4070 C 0 0 0 0 0 0 0 0 0 0 0 0 0.9800 -3.8780 -1.1820 S 0 0 0 0 0 0 0 0 0 0 0 0 0.6540 -2.3040 -0.5630 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3350 -1.0620 -0.9490 N 0 0 0 0 0 0 0 0 0 0 0 0 0.4840 -0.6840 2.6070 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2390 -1.5820 3.7260 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3200 -0.6690 5.1700 S 0 0 0 0 0 0 0 0 0 0 0 0 0.6600 0.7980 4.2660 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7040 0.5650 2.9910 N 0 0 0 0 0 0 0 0 0 0 0 0 0.8580 2.0270 4.8330 N 0 0 0 0 0 0 0 0 0 0 0 0 0.6600 2.2020 6.2030 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4920 3.0510 6.9250 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2930 3.2220 8.2800 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2670 2.5510 8.9200 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.5630 1.7060 8.2060 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.3740 1.5340 6.8490 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0570 2.7370 10.3730 N 0 3 0 0 0 0 0 0 0 0 0 0 0.8460 3.5410 11.0550 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.9200 2.0990 10.9850 O 0 5 0 0 0 0 0 0 0 0 0 0 0.7980 1.7790 0.0050 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7520 1.4080 -0.7860 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6480 1.4520 0.9900 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1890 -3.7870 2.3440 H 0 0 0 0 0 0 0 0 0 0 0 0 1.5080 -5.6380 0.6200 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0400 -2.6410 3.6560 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1370 2.7760 4.2840 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2940 3.5740 6.4260 H 0 0 0 0 0 0 0 0 0 0 0 0 1.9390 3.8810 8.8410 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.3630 1.1840 8.7090 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0240 0.8770 6.2910 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 25 1 0 0 0 0 1 26 1 0 0 0 0 1 27 1 0 0 0 0 2 3 2 0 0 0 0 2 9 1 0 0 0 0 3 4 1 0 0 0 0 3 10 1 0 0 0 0 4 5 1 0 0 0 0 4 8 1 0 0 0 0 5 6 2 0 0 0 0 5 28 1 0 0 0 0 6 7 1 0 0 0 0 6 29 1 0 0 0 0 7 8 1 0 0 0 0 8 9 2 0 0 0 0 10 11 2 0 0 0 0 10 14 1 0 0 0 0 11 12 1 0 0 0 0 11 30 1 0 0 0 0 12 13 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 31 1 0 0 0 0 16 17 1 0 0 0 0 16 21 2 0 0 0 0 17 18 2 0 0 0 0 17 32 1 0 0 0 0 18 19 1 0 0 0 0 18 33 1 0 0 0 0 19 20 2 0 0 0 0 19 22 1 0 0 0 0 20 21 1 0 0 0 0 20 34 1 0 0 0 0 21 35 1 0 0 0 0 22 23 2 0 0 0 0 22 24 1 0 0 0 0 M CHG 1 22 1 M CHG 1 24 -1 M END