PUBCHEM-ZINC05131818 MOE2007 3D CORINA 3.40 0006 02.08.2006 23 22 0 0 1 0 0 0 0 0999 V2000 -0.0410 1.5750 0.0530 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0860 0.0470 -0.0250 C 0 0 3 0 0 0 0 0 0 0 0 0 0.6060 -0.3880 0.7070 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.5020 -0.5250 0.2280 C 0 0 3 0 0 0 0 0 0 0 0 0 -2.1800 -0.1230 -0.5360 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.4820 -2.0560 0.1340 C 0 0 3 0 0 0 0 0 0 0 0 0 -0.8710 -2.5020 0.9270 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.9220 -2.5880 0.2790 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.1850 -3.5190 -0.5430 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.9630 -2.4930 -1.1430 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.9980 -0.1340 1.5130 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.8130 -0.7010 1.6440 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3600 -0.3460 -1.3340 O 0 0 0 0 0 0 0 0 0 0 0 0 0.0390 -1.2750 -1.4640 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3820 2.0780 0.1710 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2790 1.4900 0.7740 O 0 0 0 0 0 0 0 0 0 0 0 0 1.7430 3.4390 -0.4090 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7740 4.2490 -0.5550 O 0 5 0 0 0 0 0 0 0 0 0 0 -0.4910 2.0010 -0.8510 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5820 1.9510 0.9270 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.6300 -3.1850 -1.4020 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.6210 -2.0250 1.1730 O 0 5 0 0 0 0 0 0 0 0 0 0 2.9640 3.6540 -0.6920 O 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 19 1 0 0 0 0 1 20 1 0 0 0 0 2 3 1 0 0 0 0 2 4 1 0 0 0 0 2 13 1 0 0 0 0 4 5 1 0 0 0 0 4 6 1 0 0 0 0 4 11 1 0 0 0 0 6 7 1 0 0 0 0 6 8 1 0 0 0 0 6 10 1 0 0 0 0 8 9 2 0 0 0 0 8 22 1 0 0 0 0 10 21 1 0 0 0 0 11 12 1 0 0 0 0 13 14 1 0 0 0 0 15 16 2 0 0 0 0 15 17 1 0 0 0 0 17 18 1 0 0 0 0 17 23 2 0 0 0 0 M CHG 1 18 -1 M CHG 1 22 -1 M END