PUBCHEM-ZINC04097165 MOE2007 3D CORINA 3.40 0006 02.08.2006 22 22 0 0 1 0 0 0 0 0999 V2000 0.1720 1.0210 0.1580 C 0 0 3 0 0 0 0 0 0 0 0 0 0.2720 -0.0600 0.3150 H 0 0 0 0 0 0 0 0 0 0 0 0 1.5470 1.6850 0.0780 C 0 0 3 0 0 0 0 0 0 0 0 0 2.0700 1.3640 -0.8310 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4130 3.2230 0.0800 C 0 0 3 0 0 0 0 0 0 0 0 0 0.9180 3.5660 -0.8380 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6460 3.6770 1.2160 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.6690 3.1520 1.1960 C 0 0 3 0 0 0 0 0 0 0 0 0 -1.2080 3.4990 0.3060 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6600 1.6220 1.2910 C 0 0 3 0 0 0 0 0 0 0 0 0 -0.2560 1.3070 2.2610 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.0040 1.1200 1.1910 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.5040 1.6190 1.8680 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.3760 3.6520 2.3270 O 0 0 0 0 0 0 0 0 0 0 0 0 2.8250 3.8520 0.1540 C 0 0 0 0 0 0 0 0 0 0 0 0 3.6750 3.1560 0.8010 O 0 0 0 0 0 0 0 0 0 0 0 0 2.3190 1.2370 1.2040 O 0 0 0 0 0 0 0 0 0 0 0 0 3.0880 1.8900 1.2360 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5420 1.1960 -1.0730 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.4610 0.9330 -0.8570 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1750 4.6040 2.3130 H 0 0 0 0 0 0 0 0 0 0 0 0 2.9690 4.9540 -0.4440 O 0 5 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 3 1 0 0 0 0 1 10 1 0 0 0 0 1 19 1 0 0 0 0 3 4 1 0 0 0 0 3 5 1 0 0 0 0 3 17 1 0 0 0 0 5 6 1 0 0 0 0 5 7 1 0 0 0 0 5 15 1 0 0 0 0 7 8 1 0 0 0 0 8 9 1 0 0 0 0 8 10 1 0 0 0 0 8 14 1 0 0 0 0 10 11 1 0 0 0 0 10 12 1 0 0 0 0 12 13 1 0 0 0 0 14 21 1 0 0 0 0 15 16 2 0 0 0 0 15 22 1 0 0 0 0 17 18 1 0 0 0 0 19 20 1 0 0 0 0 M CHG 1 22 -1 M END