CHEMBRIDGE-ZINC02677608 MOE2007 3D CORINA 3.40 0006 02.08.2006 38 38 0 0 0 0 0 0 0 0999 V2000 -0.8730 2.0570 0.5060 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.8370 0.5490 0.2490 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.4020 0.2880 -1.1950 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1160 -0.0800 1.1670 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.2760 -0.4320 2.4080 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4210 -0.2270 2.7650 O 0 0 0 0 0 0 0 0 0 0 0 0 0.6790 -1.0630 3.3300 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2860 -1.4160 4.5750 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1970 -2.1730 5.4470 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2430 -2.9190 4.8940 C 0 0 0 0 0 0 0 0 0 0 0 0 3.0930 -3.6240 5.7180 C 0 0 0 0 0 0 0 0 0 0 0 0 2.9140 -3.5970 7.0900 C 0 0 0 0 0 0 0 0 0 0 0 0 1.8810 -2.8620 7.6460 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0260 -2.1460 6.8350 C 0 0 0 0 0 0 0 0 0 0 0 0 1.6970 -2.8400 9.1140 N 0 3 0 0 0 0 0 0 0 0 0 0 2.4550 -3.4680 9.8320 O 0 0 0 0 0 0 0 0 0 0 0 0 0.7890 -2.1930 9.6050 O 0 5 0 0 0 0 0 0 0 0 0 0 1.9960 -1.2990 2.9190 N 0 0 0 0 0 0 0 0 0 0 0 0 2.2360 -2.0480 1.8240 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3180 -2.5900 1.2470 O 0 0 0 0 0 0 0 0 0 0 0 0 3.6460 -2.2120 1.3180 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1200 2.4770 0.3440 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.5820 2.5250 -0.1770 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1830 2.2420 1.5340 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.8290 0.1290 0.4110 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5910 0.7080 -1.3560 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3760 -0.7860 -1.3780 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1100 0.7560 -1.8780 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0280 -0.2440 0.8820 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6970 -1.1430 4.9280 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3840 -2.9420 3.8230 H 0 0 0 0 0 0 0 0 0 0 0 0 3.9010 -4.2010 5.2920 H 0 0 0 0 0 0 0 0 0 0 0 0 3.5830 -4.1520 7.7310 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2230 -1.5690 7.2700 H 0 0 0 0 0 0 0 0 0 0 0 0 2.7350 -0.9240 3.4220 H 0 0 0 0 0 0 0 0 0 0 0 0 4.2370 -2.7530 2.0580 H 0 0 0 0 0 0 0 0 0 0 0 0 3.6340 -2.7710 0.3830 H 0 0 0 0 0 0 0 0 0 0 0 0 4.0870 -1.2300 1.1480 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 22 1 0 0 0 0 1 23 1 0 0 0 0 1 24 1 0 0 0 0 2 3 1 0 0 0 0 2 4 1 0 0 0 0 2 25 1 0 0 0 0 3 26 1 0 0 0 0 3 27 1 0 0 0 0 3 28 1 0 0 0 0 4 5 1 0 0 0 0 4 29 1 0 0 0 0 5 6 2 0 0 0 0 5 7 1 0 0 0 0 7 8 2 0 0 0 0 7 18 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 9 14 2 0 0 0 0 10 11 2 0 0 0 0 10 31 1 0 0 0 0 11 12 1 0 0 0 0 11 32 1 0 0 0 0 12 13 2 0 0 0 0 12 33 1 0 0 0 0 13 14 1 0 0 0 0 13 15 1 0 0 0 0 14 34 1 0 0 0 0 15 16 2 0 0 0 0 15 17 1 0 0 0 0 18 19 1 0 0 0 0 18 35 1 0 0 0 0 19 20 2 0 0 0 0 19 21 1 0 0 0 0 21 36 1 0 0 0 0 21 37 1 0 0 0 0 21 38 1 0 0 0 0 M CHG 1 15 1 M CHG 1 17 -1 M END