PUBCHEM-ZINC05850992 MOE2007 3D CORINA 3.40 0006 02.08.2006 28 28 0 0 1 0 0 0 0 0999 V2000 0.0640 1.6090 -0.0200 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0660 0.0730 0.0680 C 0 0 3 0 0 0 0 0 0 0 0 0 0.3980 -0.3600 -0.8290 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6630 -0.4640 1.3110 C 0 0 3 0 0 0 0 0 0 0 0 0 0.1840 -0.1230 2.2370 H 0 0 0 0 0 0 0 0 0 0 0 0 2.1340 -0.0370 1.2950 C 0 0 3 0 0 0 0 0 0 0 0 0 2.6640 -0.5210 0.4650 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2980 1.4800 1.2220 C 0 0 3 0 0 0 0 0 0 0 0 0 2.0260 1.9430 2.1780 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4980 2.1150 0.0820 C 0 0 3 0 0 0 0 0 0 0 0 0 1.5160 3.2060 0.1850 H 0 0 0 0 0 0 0 0 0 0 0 0 3.6870 1.7760 0.9770 O 0 0 0 0 0 0 0 0 0 0 0 0 4.1740 1.3190 1.6960 H 0 0 0 0 0 0 0 0 0 0 0 0 2.7840 -0.4970 2.4840 O 0 0 0 0 0 0 0 0 0 0 0 0 2.5320 -1.4390 2.5670 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6600 -1.8920 1.3280 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.2050 -2.1970 1.6570 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.5400 -0.3500 0.0450 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.1440 0.1370 -1.1460 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.0680 -0.1710 -1.1490 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3860 1.9770 -0.9500 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5130 2.0550 0.8010 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.6380 -1.4400 0.0510 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.0830 0.0570 0.9040 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2480 1.8510 -1.1840 N 0 3 0 0 0 0 0 0 0 0 0 0 2.0280 2.5310 -1.9220 H 0 0 0 0 0 0 0 0 0 0 0 0 2.1300 0.9050 -1.5640 H 0 0 0 0 0 0 0 0 0 0 0 0 3.2520 1.9580 -0.9340 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 10 1 0 0 0 0 1 21 1 0 0 0 0 1 22 1 0 0 0 0 2 3 1 0 0 0 0 2 4 1 0 0 0 0 2 18 1 0 0 0 0 4 5 1 0 0 0 0 4 6 1 0 0 0 0 4 16 1 0 0 0 0 6 7 1 0 0 0 0 6 8 1 0 0 0 0 6 14 1 0 0 0 0 8 9 1 0 0 0 0 8 10 1 0 0 0 0 8 12 1 0 0 0 0 10 11 1 0 0 0 0 10 25 1 0 0 0 0 12 13 1 0 0 0 0 14 15 1 0 0 0 0 16 17 1 0 0 0 0 18 19 1 0 0 0 0 18 23 1 0 0 0 0 18 24 1 0 0 0 0 19 20 1 0 0 0 0 25 26 1 0 0 0 0 25 27 1 0 0 0 0 25 28 1 0 0 0 0 M CHG 1 25 1 M END