PUBCHEM-ZINC03869830 MOE2007 3D CORINA 3.40 0006 02.08.2006 22 22 0 0 1 0 0 0 0 0999 V2000 0.6760 1.7410 -0.1260 C 0 0 0 0 0 0 0 0 0 0 0 0 0.4080 0.2600 -0.1790 C 0 0 3 0 0 0 0 0 0 0 0 0 0.5620 -0.1170 -1.1970 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4730 -0.2520 0.7700 C 0 0 3 0 0 0 0 0 0 0 0 0 1.1890 -0.1000 1.8190 H 0 0 0 0 0 0 0 0 0 0 0 0 2.6380 0.5530 0.5180 O 0 0 0 0 0 0 0 0 0 0 0 0 2.1980 1.8020 -0.0790 C 0 0 3 0 0 0 0 0 0 0 0 0 2.6230 1.8240 -1.0880 H 0 0 0 0 0 0 0 0 0 0 0 0 2.6300 2.8990 0.6890 O 0 0 0 0 0 0 0 0 0 0 0 0 2.8200 4.3130 -0.1240 P 0 0 0 0 0 0 0 0 0 0 0 0 3.9060 4.0050 -1.1460 O 0 0 0 0 0 0 0 0 0 0 0 0 1.8330 -1.7140 0.5510 C 0 0 0 0 0 0 0 0 0 0 0 0 2.9080 -2.0670 1.4240 O 0 0 0 0 0 0 0 0 0 0 0 0 3.5200 -1.3040 1.3890 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8980 -0.0780 0.2470 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.5150 0.5130 -0.2200 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2570 2.2660 -0.9900 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2240 2.1970 0.7640 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9860 -2.3750 0.7570 H 0 0 0 0 0 0 0 0 0 0 0 0 2.1810 -1.8890 -0.4720 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4480 4.5720 -0.7330 O 0 5 0 0 0 0 0 0 0 0 0 0 3.2270 5.3020 0.9580 O 0 5 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 7 1 0 0 0 0 1 17 1 0 0 0 0 1 18 1 0 0 0 0 2 3 1 0 0 0 0 2 4 1 0 0 0 0 2 15 1 0 0 0 0 4 5 1 0 0 0 0 4 6 1 0 0 0 0 4 12 1 0 0 0 0 6 7 1 0 0 0 0 7 8 1 0 0 0 0 7 9 1 0 0 0 0 9 10 1 0 0 0 0 10 11 2 0 0 0 0 10 21 1 0 0 0 0 10 22 1 0 0 0 0 12 13 1 0 0 0 0 12 19 1 0 0 0 0 12 20 1 0 0 0 0 13 14 1 0 0 0 0 15 16 1 0 0 0 0 M CHG 1 21 -1 M CHG 1 22 -1 M END