PUBCHEM-ZINC05850852 MOE2007 3D CORINA 3.40 0006 02.08.2006 21 21 0 0 1 0 0 0 0 0999 V2000 -0.0190 1.5280 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 0.4660 -0.3570 -0.9190 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8090 -0.4990 1.2060 C 0 0 3 0 0 0 0 0 0 0 0 0 0.3180 -0.1880 2.1270 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2160 0.1010 1.1490 C 0 0 0 0 0 0 0 0 0 0 0 0 2.1240 1.5270 1.1280 O 0 0 0 0 0 0 0 0 0 0 0 0 1.4200 2.0500 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 1.9160 1.7310 -0.9170 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4090 3.5550 0.0670 C 0 0 0 0 0 0 0 0 0 0 0 0 1.8700 4.1200 1.0310 O 0 0 0 0 0 0 0 0 0 0 0 0 0.8960 -1.9250 1.1690 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.3350 -0.5010 0.0840 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.5440 1.8900 -0.8730 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5270 1.8800 0.9080 H 0 0 0 0 0 0 0 0 0 0 0 0 2.7820 -0.2140 2.0260 H 0 0 0 0 0 0 0 0 0 0 0 0 2.7220 -0.2440 0.2470 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3940 -2.3080 1.9040 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.3970 -1.4660 0.0840 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8880 4.2690 -0.9430 O 0 0 0 0 0 0 0 0 0 0 0 0 0.9030 5.2320 -0.8540 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 8 1 0 0 0 0 1 14 1 0 0 0 0 1 15 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 12 1 0 0 0 0 6 7 1 0 0 0 0 6 16 1 0 0 0 0 6 17 1 0 0 0 0 7 8 1 0 0 0 0 8 9 1 0 0 0 0 8 10 1 0 0 0 0 10 11 2 0 0 0 0 10 20 1 0 0 0 0 12 18 1 0 0 0 0 13 19 1 0 0 0 0 20 21 1 0 0 0 0 M END