PUBCHEM-ZINC04085842 MOE2007 3D CORINA 3.40 0006 02.08.2006 25 25 0 0 0 0 0 0 0 0999 V2000 -0.0140 1.5230 0.0780 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0050 -0.0060 0.0570 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.3700 -0.5120 0.0420 N 0 0 0 0 0 0 0 0 0 0 0 0 -1.6030 -1.8630 0.0220 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.8790 -2.3440 0.1200 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.0890 -3.7320 0.0960 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.2180 -4.1830 0.1820 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.0340 -4.5620 -0.0220 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.7850 -4.0720 -0.1170 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1530 -4.8390 -0.2230 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.5580 -2.7460 -0.1020 N 0 0 0 0 0 0 0 0 0 0 0 0 0.3500 -2.4110 -0.1760 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.2490 -6.0110 -0.0460 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.0240 -1.4140 0.2490 N 0 3 0 0 0 0 0 0 0 0 0 0 -3.8450 -0.2120 0.1650 O 0 0 0 0 0 0 0 0 0 0 0 0 -5.1450 -1.8510 0.4400 O 0 5 0 0 0 0 0 0 0 0 0 0 1.0090 1.8990 0.0890 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5270 1.8920 -0.8100 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5380 1.8680 0.9700 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5290 -0.3510 -0.8340 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5180 -0.3760 0.9450 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.1150 0.1090 0.0460 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.3930 -6.3400 -1.0760 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.3810 -6.5140 0.3780 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.1340 -6.2560 0.5410 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 17 1 0 0 0 0 1 18 1 0 0 0 0 1 19 1 0 0 0 0 2 3 1 0 0 0 0 2 20 1 0 0 0 0 2 21 1 0 0 0 0 3 4 1 0 0 0 0 3 22 1 0 0 0 0 4 5 2 0 0 0 0 4 11 1 0 0 0 0 5 6 1 0 0 0 0 5 14 1 0 0 0 0 6 7 2 0 0 0 0 6 8 1 0 0 0 0 8 9 1 0 0 0 0 8 13 1 0 0 0 0 9 10 2 0 0 0 0 9 11 1 0 0 0 0 11 12 1 0 0 0 0 13 23 1 0 0 0 0 13 24 1 0 0 0 0 13 25 1 0 0 0 0 14 15 2 0 0 0 0 14 16 1 0 0 0 0 M CHG 1 14 1 M CHG 1 16 -1 M END