PUBCHEM-ZINC04095540 MOE2007 3D CORINA 3.40 0006 02.08.2006 26 26 0 0 1 0 0 0 0 0999 V2000 -0.1660 1.3830 -0.1730 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0600 -0.1360 -0.0940 C 0 0 3 0 0 0 0 0 0 0 0 0 0.4080 -0.4890 -1.0200 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7500 -0.6050 1.1230 C 0 0 3 0 0 0 0 0 0 0 0 0 1.7900 -0.2660 1.0660 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6950 -2.1310 1.2650 C 0 0 3 0 0 0 0 0 0 0 0 0 1.3090 -2.6190 0.4990 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7520 -2.6390 1.1970 C 0 0 3 0 0 0 0 0 0 0 0 0 -1.3010 -2.2730 2.0740 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.4220 -2.0990 -0.0790 C 0 0 3 0 0 0 0 0 0 0 0 0 -2.4680 -2.4210 -0.0950 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.3940 -0.6570 0.0150 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.7350 -2.5980 -1.2110 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.5150 -2.6030 -2.6510 P 0 0 0 0 0 0 0 0 0 0 0 0 -1.6460 -1.1300 -3.0140 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.7620 -4.0660 1.2980 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.0420 -4.2870 1.9180 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2400 -2.5060 2.5420 O 0 0 0 0 0 0 0 0 0 0 0 0 1.0320 -1.7470 3.1280 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2110 -0.0590 2.3460 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.7450 0.0750 2.1900 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8230 1.8480 -0.2120 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7220 1.6740 -1.0710 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7190 1.7970 0.6770 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5670 -3.3800 -3.5560 O 0 5 0 0 0 0 0 0 0 0 0 0 -2.8340 -3.3090 -2.3670 O 0 5 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 12 1 0 0 0 0 4 5 1 0 0 0 0 4 6 1 0 0 0 0 4 20 1 0 0 0 0 6 7 1 0 0 0 0 6 8 1 0 0 0 0 6 18 1 0 0 0 0 8 9 1 0 0 0 0 8 10 1 0 0 0 0 8 16 1 0 0 0 0 10 11 1 0 0 0 0 10 12 1 0 0 0 0 10 13 1 0 0 0 0 13 14 1 0 0 0 0 14 15 2 0 0 0 0 14 25 1 0 0 0 0 14 26 1 0 0 0 0 16 17 1 0 0 0 0 18 19 1 0 0 0 0 20 21 1 0 0 0 0 M CHG 1 25 -1 M CHG 1 26 -1 M END