PUBCHEM-ZINC05838099 MOE2007 3D CORINA 3.40 0006 02.08.2006 24 25 0 0 1 0 0 0 0 0999 V2000 0.0490 1.2160 0.0810 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0650 -0.0870 0.0840 N 0 0 0 0 0 0 0 0 0 0 0 0 1.5040 -0.4100 0.0020 C 0 0 3 0 0 0 0 0 0 0 0 0 1.7590 -0.8780 -0.9540 H 0 0 0 0 0 0 0 0 0 0 0 0 2.1090 0.9280 0.1310 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2510 1.8850 0.1020 N 0 0 0 0 0 0 0 0 0 0 0 0 3.4410 1.0430 0.3510 N 0 0 0 0 0 0 0 0 0 0 0 0 3.9270 0.0860 1.0820 C 0 0 0 0 0 0 0 0 0 0 0 0 3.2120 -0.9620 1.6230 N 0 0 0 0 0 0 0 0 0 0 0 0 2.0230 -1.2270 1.1560 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2240 -2.2360 1.6270 N 0 0 0 0 0 0 0 0 0 0 0 0 1.5880 -3.1860 2.6740 C 0 0 3 0 0 0 0 0 0 0 0 0 2.2040 -2.7070 3.4430 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3230 -4.3900 2.0650 C 0 0 0 0 0 0 0 0 0 0 0 0 1.5210 -5.0770 1.0920 O 0 0 0 0 0 0 0 0 0 0 0 0 0.5970 -5.0690 1.4880 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3020 -3.7620 3.3140 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.3480 -4.5420 2.5390 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.8940 1.7830 0.0960 H 0 0 0 0 0 0 0 0 0 0 0 0 5.0040 0.1070 1.3170 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2980 -2.3620 1.2160 H 0 0 0 0 0 0 0 0 0 0 0 0 3.2430 -4.0730 1.5650 H 0 0 0 0 0 0 0 0 0 0 0 0 2.5910 -5.1140 2.8420 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0550 -3.4050 4.4970 O 0 5 0 0 0 0 0 0 0 0 0 0 1 2 2 0 0 0 0 1 6 1 0 0 0 0 1 19 1 0 0 0 0 2 3 1 0 0 0 0 3 4 1 0 0 0 0 3 5 1 0 0 0 0 3 10 1 0 0 0 0 5 6 2 0 0 0 0 5 7 1 0 0 0 0 7 8 2 0 0 0 0 8 9 1 0 0 0 0 8 20 1 0 0 0 0 9 10 2 0 0 0 0 10 11 1 0 0 0 0 11 12 1 0 0 0 0 11 21 1 0 0 0 0 12 13 1 0 0 0 0 12 14 1 0 0 0 0 12 17 1 0 0 0 0 14 15 1 0 0 0 0 14 22 1 0 0 0 0 14 23 1 0 0 0 0 15 16 1 0 0 0 0 17 18 2 0 0 0 0 17 24 1 0 0 0 0 M CHG 1 24 -1 M END