PUBCHEM-ZINC05411391 MOE2007 3D CORINA 3.40 0006 02.08.2006 28 28 0 0 1 0 0 0 0 0999 V2000 -0.5610 2.3600 0.8590 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.2970 0.9400 0.3130 C 0 0 3 0 0 0 0 0 0 0 0 0 0.0680 1.0280 -0.7170 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.5860 0.0910 0.2820 C 0 0 3 0 0 0 0 0 0 0 0 0 -2.3590 0.5700 -0.3290 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2690 -1.3110 -0.2740 C 0 0 3 0 0 0 0 0 0 0 0 0 -0.9910 -1.2390 -1.3310 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1290 -1.9610 0.5200 C 0 0 3 0 0 0 0 0 0 0 0 0 0.1260 -2.9470 0.1180 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0940 -1.0290 0.5450 C 0 0 3 0 0 0 0 0 0 0 0 0 1.5250 -0.9250 -0.4580 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7470 0.2580 1.1170 N 0 0 0 0 0 0 0 0 0 0 0 0 2.0660 -1.6150 1.3950 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.5630 -2.1870 1.8860 O 0 0 0 0 0 0 0 0 0 0 0 0 0.2820 -2.2200 2.3850 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.4380 -2.1320 -0.1830 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.6680 -2.1040 0.7680 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.1360 -0.0510 1.6040 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.4450 -0.5370 2.1100 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5790 3.1930 1.0500 O 0 0 0 0 0 0 0 0 0 0 0 0 1.8880 3.0870 0.0700 P 0 0 0 0 0 0 0 0 0 0 0 0 1.3030 3.0750 -1.3350 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.2440 2.8880 0.1850 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0590 2.3020 1.8330 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6130 0.8940 0.9660 H 0 0 0 0 0 0 0 0 0 0 0 0 2.6140 -0.8400 1.6320 H 0 0 0 0 0 0 0 0 0 0 0 0 2.7110 4.3180 0.4160 O 0 5 0 0 0 0 0 0 0 0 0 0 2.5230 1.7600 0.5020 O 0 5 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 20 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 18 1 0 0 0 0 6 7 1 0 0 0 0 6 8 1 0 0 0 0 6 16 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 10 13 1 0 0 0 0 12 25 1 0 0 0 0 13 26 1 0 0 0 0 14 15 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 21 22 2 0 0 0 0 21 27 1 0 0 0 0 21 28 1 0 0 0 0 M CHG 1 27 -1 M CHG 1 28 -1 M END