PUBCHEM-ZINC04115602 MOE2007 3D CORINA 3.40 0006 02.08.2006 23 23 0 0 0 0 0 0 0 0999 V2000 -2.1760 1.4820 -0.5480 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.1410 -0.0240 -0.5830 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.9920 -0.6370 -1.1930 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.1630 -0.6910 0.0620 N 0 0 0 0 0 0 0 0 0 0 0 0 -1.1900 -2.0890 0.1210 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0020 -2.8080 0.1200 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0280 -4.1880 0.1790 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.2350 -4.8580 0.2370 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.4270 -4.1440 0.2380 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.4040 -2.7570 0.1860 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.6470 -4.8220 0.2960 N 0 0 0 0 0 0 0 0 0 0 0 0 -1.2580 -6.3360 0.2990 N 0 3 0 0 0 0 0 0 0 0 0 0 -0.4180 -6.9320 0.9500 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.1170 -6.9580 -0.3020 O 0 5 0 0 0 0 0 0 0 0 0 0 -3.0320 1.8390 -1.1220 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.2660 1.8190 0.4850 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2580 1.8770 -0.9810 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4410 -0.2020 0.4860 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9440 -2.2880 0.0740 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8980 -4.7450 0.1780 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.3290 -2.2000 0.1910 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.6650 -5.7910 0.2800 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.4770 -4.3220 0.3530 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 15 1 0 0 0 0 1 16 1 0 0 0 0 1 17 1 0 0 0 0 2 3 2 0 0 0 0 2 4 1 0 0 0 0 4 5 1 0 0 0 0 4 18 1 0 0 0 0 5 6 1 0 0 0 0 5 10 2 0 0 0 0 6 7 2 0 0 0 0 6 19 1 0 0 0 0 7 8 1 0 0 0 0 7 20 1 0 0 0 0 8 9 2 0 0 0 0 8 12 1 0 0 0 0 9 10 1 0 0 0 0 9 11 1 0 0 0 0 10 21 1 0 0 0 0 11 22 1 0 0 0 0 11 23 1 0 0 0 0 12 13 2 0 0 0 0 12 14 1 0 0 0 0 M CHG 1 12 1 M CHG 1 14 -1 M END