PUBCHEM-ZINC02048031 MOE2007 3D CORINA 3.40 0006 02.08.2006 27 26 0 0 1 0 0 0 0 0999 V2000 -0.1360 1.6230 0.1950 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1290 0.0770 0.1250 C 0 0 3 0 0 0 0 0 0 0 0 0 0.2880 -0.1820 -0.8590 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8620 -0.4700 1.1810 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3590 -0.1830 0.9610 C 0 0 0 0 0 0 0 0 0 0 0 0 2.7090 0.2100 -0.1880 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.6040 -0.5070 0.1520 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.5500 -2.0690 0.3010 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.1930 -2.6210 1.2380 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.4220 0.0700 1.3640 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.8520 0.0920 2.4960 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.2150 -0.1320 -1.1980 N 0 0 0 0 0 0 0 0 0 0 0 0 -3.3930 -0.6380 -1.7060 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.0930 -1.5180 -1.2210 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.7490 -0.0050 -3.0260 C 0 0 0 0 0 0 0 0 0 0 0 0 0.8540 2.0330 -0.0300 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8300 2.0640 -0.5260 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4150 1.9810 1.1910 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6040 -0.0830 2.1740 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7900 -1.5610 1.2400 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.7120 0.5520 -1.7440 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.6390 1.0820 -2.9720 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.0940 -0.4000 -3.8080 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.7890 -0.2360 -3.2770 H 0 0 0 0 0 0 0 0 0 0 0 0 3.0890 -0.3780 1.9780 O 0 5 0 0 0 0 0 0 0 0 0 0 -0.8510 -2.6560 -0.5920 O 0 5 0 0 0 0 0 0 0 0 0 0 -3.5410 0.6060 1.0780 O 0 5 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 16 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 7 1 0 0 0 0 4 5 1 0 0 0 0 4 19 1 0 0 0 0 4 20 1 0 0 0 0 5 6 2 0 0 0 0 5 25 1 0 0 0 0 7 8 1 0 0 0 0 7 10 1 0 0 0 0 7 12 1 0 0 0 0 8 9 2 0 0 0 0 8 26 1 0 0 0 0 10 11 2 0 0 0 0 10 27 1 0 0 0 0 12 13 1 0 0 0 0 12 21 1 0 0 0 0 13 14 2 0 0 0 0 13 15 1 0 0 0 0 15 22 1 0 0 0 0 15 23 1 0 0 0 0 15 24 1 0 0 0 0 M CHG 1 25 -1 M CHG 1 26 -1 M CHG 1 27 -1 M END