PUBCHEM-ZINC06425477 MOE2007 3D CORINA 3.40 0006 02.08.2006 27 26 0 0 1 0 0 0 0 0999 V2000 -0.0190 1.5260 0.0100 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0020 -0.0040 0.0020 C 0 0 3 0 0 0 0 0 0 0 0 0 -1.0200 -0.3810 0.0100 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7070 -0.4900 -1.2380 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0230 -1.1880 -2.1780 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6550 -1.6240 -3.2890 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.2910 -1.4480 -2.0030 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.9490 -2.1880 -3.0330 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.4200 -2.3830 -2.6610 C 0 0 3 0 0 0 0 0 0 0 0 0 -3.8760 -1.4130 -2.4630 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.1420 -3.0560 -3.8000 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.3620 -4.2430 -3.7590 O 0 0 0 0 0 0 0 0 0 0 0 0 2.0260 -0.2300 -1.4140 N 0 3 0 0 0 0 0 0 0 0 0 0 3.0310 -0.0310 -1.5480 N 0 0 0 0 0 0 0 0 0 0 0 0 0.6930 -0.4770 1.1600 O 0 0 0 0 0 0 0 0 0 0 0 0 1.0040 1.9030 0.0030 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5460 1.8870 -0.8730 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5290 1.8770 0.9070 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0860 -2.1120 -3.9000 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.8810 -1.6410 -3.9730 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.4700 -3.1620 -3.1440 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.0980 -4.1280 -1.6160 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2940 -0.2020 1.9960 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.5400 -2.3350 -4.8600 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.5140 -3.2220 -1.4590 N 0 0 0 0 0 0 0 0 0 0 0 0 -3.0940 -2.7640 -0.6640 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.9990 -2.8100 -5.5660 H 0 0 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 15 1 0 0 0 0 4 5 2 0 0 0 0 4 13 1 0 0 0 0 5 6 1 0 0 0 0 5 7 1 0 0 0 0 6 19 1 0 0 0 0 7 8 1 0 0 0 0 8 9 1 0 0 0 0 8 20 1 0 0 0 0 8 21 1 0 0 0 0 9 10 1 0 0 0 0 9 11 1 0 0 0 0 9 25 1 0 0 0 0 11 12 2 0 0 0 0 11 24 1 0 0 0 0 13 14 3 0 0 0 0 15 23 1 0 0 0 0 22 25 1 0 0 0 0 24 27 1 0 0 0 0 25 26 1 0 0 0 0 M CHG 1 13 1 M END