PUBCHEM-ZINC05112679 MOE2007 3D CORINA 3.40 0006 02.08.2006 22 21 0 0 1 0 0 0 0 0999 V2000 -0.0050 1.3890 0.1630 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0710 -0.1460 -0.5140 S 0 0 0 0 0 0 0 0 0 0 0 0 1.2290 2.2830 0.0550 C 0 0 3 0 0 0 0 0 0 0 0 0 1.0800 2.9310 -0.8170 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3440 3.1460 1.3230 C 0 0 3 0 0 0 0 0 0 0 0 0 1.3260 2.4710 2.1910 H 0 0 0 0 0 0 0 0 0 0 0 0 2.6780 3.9500 1.3460 C 0 0 3 0 0 0 0 0 0 0 0 0 2.8490 4.3540 0.3380 H 0 0 0 0 0 0 0 0 0 0 0 0 2.6960 5.1930 2.3040 C 0 0 3 0 0 0 0 0 0 0 0 0 2.3720 6.0240 1.6560 H 0 0 0 0 0 0 0 0 0 0 0 0 4.1450 5.5780 2.6920 C 0 0 0 0 0 0 0 0 0 0 0 0 4.8980 5.7610 1.5730 F 0 0 0 0 0 0 0 0 0 0 0 0 4.1800 6.7670 3.3530 F 0 0 0 0 0 0 0 0 0 0 0 0 4.7880 4.6770 3.4670 F 0 0 0 0 0 0 0 0 0 0 0 0 1.9380 4.9550 3.3770 O 0 5 0 0 0 0 0 0 0 0 0 0 3.7580 3.0360 1.5690 O 0 0 0 0 0 0 0 0 0 0 0 0 3.5860 2.2850 0.9540 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2230 4.0250 1.4360 O 0 0 0 0 0 0 0 0 0 0 0 0 0.4660 4.5530 2.2460 H 0 0 0 0 0 0 0 0 0 0 0 0 2.4430 1.5500 -0.1170 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.8950 1.8420 0.6340 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2760 0.9050 -0.8310 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 2 0 0 0 0 1 3 1 0 0 0 0 1 21 1 0 0 0 0 3 4 1 0 0 0 0 3 5 1 0 0 0 0 3 20 1 0 0 0 0 5 6 1 0 0 0 0 5 7 1 0 0 0 0 5 18 1 0 0 0 0 7 8 1 0 0 0 0 7 9 1 0 0 0 0 7 16 1 0 0 0 0 9 10 1 0 0 0 0 9 11 1 0 0 0 0 9 15 1 0 0 0 0 11 12 1 0 0 0 0 11 13 1 0 0 0 0 11 14 1 0 0 0 0 16 17 1 0 0 0 0 18 19 1 0 0 0 0 20 22 1 0 0 0 0 M CHG 1 15 -1 M END