PUBCHEM-ZINC05764923 MOE2007 3D CORINA 3.40 0006 02.08.2006 21 22 0 0 0 0 0 0 0 0999 V2000 -0.1580 1.5390 -0.0110 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0270 0.0860 -0.0280 N 0 3 0 0 0 0 0 0 0 0 0 0 0.0490 -0.6880 1.1220 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0420 -0.2630 2.4660 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1200 -1.2230 3.4820 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2060 -2.5780 3.1780 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2200 -3.0150 1.8510 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1440 -2.0500 0.8350 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1510 -2.2800 -0.8740 S 0 0 0 0 0 0 0 0 0 0 0 0 0.0610 -0.6060 -1.1510 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0500 0.0620 -2.7920 S 0 0 0 0 0 0 0 0 0 0 0 0 -1.3570 0.4260 -2.8980 O 0 0 0 0 0 0 0 0 0 0 0 0 0.9870 1.1660 -2.6170 O 0 0 0 0 0 0 0 0 0 0 0 0 0.8350 1.9920 -0.0820 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7980 1.8950 -0.8210 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6320 1.8750 0.9150 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0190 0.7850 2.7430 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1150 -0.9060 4.5240 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2660 -3.3090 3.9820 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2920 -4.0740 1.6170 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5080 -1.0510 -3.6110 O 0 5 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 14 1 0 0 0 0 1 15 1 0 0 0 0 1 16 1 0 0 0 0 2 3 1 0 0 0 0 2 10 2 0 0 0 0 3 4 1 0 0 0 0 3 8 2 0 0 0 0 4 5 2 0 0 0 0 4 17 1 0 0 0 0 5 6 1 0 0 0 0 5 18 1 0 0 0 0 6 7 2 0 0 0 0 6 19 1 0 0 0 0 7 8 1 0 0 0 0 7 20 1 0 0 0 0 8 9 1 0 0 0 0 9 10 1 0 0 0 0 10 11 1 0 0 0 0 11 12 2 0 0 0 0 11 13 2 0 0 0 0 11 21 1 0 0 0 0 M CHG 1 2 1 M CHG 1 21 -1 M END