PUBCHEM-ZINC06494172 MOE2007 3D CORINA 3.40 0006 02.08.2006 31 32 0 0 1 0 0 0 0 0999 V2000 -0.7030 1.0250 -0.5600 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0900 -0.3560 -0.3680 C 0 0 3 0 0 0 0 0 0 0 0 0 -0.8940 -1.1010 -0.4120 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6710 -0.5020 0.9690 C 0 0 3 0 0 0 0 0 0 0 0 0 -0.0180 -0.3370 1.8050 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1860 -1.9650 1.0030 C 0 0 0 0 0 0 0 0 0 0 0 0 1.7020 -2.3490 -0.0990 O 0 0 0 0 0 0 0 0 0 0 0 0 1.7920 0.4420 1.0660 N 0 0 0 0 0 0 0 0 0 0 0 0 1.7870 1.5400 1.8990 C 0 0 0 0 0 0 0 0 0 0 0 0 0.8010 1.9130 2.5240 O 0 0 0 0 0 0 0 0 0 0 0 0 3.0470 2.1130 1.9640 N 0 0 0 0 0 0 0 0 0 0 0 0 3.4120 3.2730 2.6070 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5910 4.0890 3.1870 N 0 0 0 0 0 0 0 0 0 0 0 0 3.1090 5.2330 3.7570 C 0 0 0 0 0 0 0 0 0 0 0 0 4.2870 5.7340 3.5200 N 0 0 0 0 0 0 0 0 0 0 0 0 5.0160 5.0070 2.6380 C 0 0 0 0 0 0 0 0 0 0 0 0 5.7800 5.4590 1.7080 N 0 0 0 0 0 0 0 0 0 0 0 0 6.0670 4.3330 0.9700 C 0 0 0 0 0 0 0 0 0 0 0 0 5.5530 3.1950 1.3490 N 0 0 0 0 0 0 0 0 0 0 0 0 4.8800 3.5400 2.6160 C 0 0 3 0 0 0 0 0 0 0 0 0 5.3650 3.0730 3.4770 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7770 -0.6170 -1.4860 O 0 0 0 0 0 0 0 0 0 0 0 0 1.2930 -1.4320 -1.1990 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0680 1.7970 -0.6540 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2820 1.0550 -1.4890 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.3670 1.2850 0.2700 H 0 0 0 0 0 0 0 0 0 0 0 0 2.5830 0.2380 0.4690 H 0 0 0 0 0 0 0 0 0 0 0 0 3.7930 1.6290 1.4800 H 0 0 0 0 0 0 0 0 0 0 0 0 2.4470 5.7670 4.4600 H 0 0 0 0 0 0 0 0 0 0 0 0 6.6840 4.4150 0.0620 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0540 -2.5790 2.0950 O 0 5 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 24 1 0 0 0 0 1 25 1 0 0 0 0 1 26 1 0 0 0 0 2 3 1 0 0 0 0 2 4 1 0 0 0 0 2 22 1 0 0 0 0 4 5 1 0 0 0 0 4 6 1 0 0 0 0 4 8 1 0 0 0 0 6 7 2 0 0 0 0 6 31 1 0 0 0 0 8 9 1 0 0 0 0 8 27 1 0 0 0 0 9 10 2 0 0 0 0 9 11 1 0 0 0 0 11 12 1 0 0 0 0 11 28 1 0 0 0 0 12 13 2 0 0 0 0 12 20 1 0 0 0 0 13 14 1 0 0 0 0 14 15 2 0 0 0 0 14 29 1 0 0 0 0 15 16 1 0 0 0 0 16 17 2 0 0 0 0 16 20 1 0 0 0 0 17 18 1 0 0 0 0 18 19 2 0 0 0 0 18 30 1 0 0 0 0 19 20 1 0 0 0 0 20 21 1 0 0 0 0 22 23 1 0 0 0 0 M CHG 1 31 -1 M END