NIH-ZINC00615910 MOE2007 3D CORINA 3.40 0006 02.08.2006 44 46 0 0 1 0 0 0 0 0999 V2000 -0.0600 1.4480 -1.1240 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0270 0.0590 -1.1990 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1900 -0.6110 -0.8080 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2590 0.1650 -0.3410 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2050 1.5580 -0.2560 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0180 2.2080 -0.6550 C 0 0 0 0 0 0 0 0 0 0 0 0 3.4680 2.0050 0.2530 C 0 0 0 0 0 0 0 0 0 0 0 0 4.2380 0.8760 0.4580 C 0 0 0 0 0 0 0 0 0 0 0 0 3.5020 -0.2200 0.1020 N 0 0 0 0 0 0 0 0 0 0 0 0 3.8230 -1.1760 0.1550 H 0 0 0 0 0 0 0 0 0 0 0 0 3.8980 3.4150 0.5160 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7410 3.8100 1.9850 C 0 0 0 0 0 0 0 0 0 0 0 0 4.2680 5.1310 2.2540 N 0 0 0 0 0 0 0 0 0 0 0 0 5.6090 5.3940 2.4040 C 0 0 0 0 0 0 0 0 0 0 0 0 6.4620 4.5110 2.3260 O 0 0 0 0 0 0 0 0 0 0 0 0 5.9560 6.8890 2.5850 C 0 0 3 0 0 0 0 0 0 0 0 0 5.6070 7.3780 1.6640 H 0 0 0 0 0 0 0 0 0 0 0 0 7.4850 7.0780 2.6560 C 0 0 0 0 0 0 0 0 0 0 0 0 8.0830 6.6170 3.9880 C 0 0 0 0 0 0 0 0 0 0 0 0 7.3690 7.2280 5.1890 C 0 0 0 0 0 0 0 0 0 0 0 0 5.8530 7.0550 5.1140 C 0 0 0 0 0 0 0 0 0 0 0 0 5.3030 7.6020 3.7910 C 0 0 3 0 0 0 0 0 0 0 0 0 5.6150 8.6570 3.7260 H 0 0 0 0 0 0 0 0 0 0 0 0 3.7660 7.7110 3.8350 C 0 0 0 0 0 0 0 0 0 0 0 0 3.1600 7.1570 2.8680 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.9750 1.9470 -1.4350 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8220 -0.5130 -1.5670 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2560 -1.6920 -0.8670 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9370 3.2890 -0.6010 H 0 0 0 0 0 0 0 0 0 0 0 0 5.2480 0.7690 0.8320 H 0 0 0 0 0 0 0 0 0 0 0 0 4.9450 3.5260 0.2060 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3270 4.1080 -0.1140 H 0 0 0 0 0 0 0 0 0 0 0 0 2.6830 3.8160 2.2720 H 0 0 0 0 0 0 0 0 0 0 0 0 4.2590 3.0960 2.6370 H 0 0 0 0 0 0 0 0 0 0 0 0 3.6110 5.9460 2.3680 H 0 0 0 0 0 0 0 0 0 0 0 0 7.9800 6.5480 1.8330 H 0 0 0 0 0 0 0 0 0 0 0 0 7.7160 8.1430 2.5180 H 0 0 0 0 0 0 0 0 0 0 0 0 8.0360 5.5250 4.0620 H 0 0 0 0 0 0 0 0 0 0 0 0 9.1460 6.8820 4.0210 H 0 0 0 0 0 0 0 0 0 0 0 0 7.7470 6.7740 6.1120 H 0 0 0 0 0 0 0 0 0 0 0 0 7.6070 8.2970 5.2430 H 0 0 0 0 0 0 0 0 0 0 0 0 5.5930 5.9940 5.2190 H 0 0 0 0 0 0 0 0 0 0 0 0 5.4020 7.5670 5.9720 H 0 0 0 0 0 0 0 0 0 0 0 0 3.2880 8.3520 4.8110 O 0 5 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 26 1 0 0 0 0 2 3 2 0 0 0 0 2 27 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 9 1 0 0 0 0 5 6 1 0 0 0 0 5 7 1 0 0 0 0 6 29 1 0 0 0 0 7 8 2 0 0 0 0 7 11 1 0 0 0 0 8 9 1 0 0 0 0 8 30 1 0 0 0 0 9 10 1 0 0 0 0 11 12 1 0 0 0 0 11 31 1 0 0 0 0 11 32 1 0 0 0 0 12 13 1 0 0 0 0 12 33 1 0 0 0 0 12 34 1 0 0 0 0 13 14 1 0 0 0 0 13 35 1 0 0 0 0 14 15 2 0 0 0 0 14 16 1 0 0 0 0 16 17 1 0 0 0 0 16 18 1 0 0 0 0 16 22 1 0 0 0 0 18 19 1 0 0 0 0 18 36 1 0 0 0 0 18 37 1 0 0 0 0 19 20 1 0 0 0 0 19 38 1 0 0 0 0 19 39 1 0 0 0 0 20 21 1 0 0 0 0 20 40 1 0 0 0 0 20 41 1 0 0 0 0 21 22 1 0 0 0 0 21 42 1 0 0 0 0 21 43 1 0 0 0 0 22 23 1 0 0 0 0 22 24 1 0 0 0 0 24 25 2 0 0 0 0 24 44 1 0 0 0 0 M CHG 1 44 -1 M END