NCID-ZINC05104197 MOE2007 3D CORINA 3.40 0006 02.08.2006 22 22 0 0 1 0 0 0 0 0999 V2000 -0.0190 1.5270 0.0100 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0020 -0.0040 0.0020 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7930 -0.5050 1.2120 C 0 0 3 0 0 0 0 0 0 0 0 0 0.3110 -0.1640 2.1280 H 0 0 0 0 0 0 0 0 0 0 0 0 2.1710 1.4880 1.2100 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4210 2.0490 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 1.9170 1.7290 -0.9170 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8330 -2.0120 1.1970 C 0 0 0 0 0 0 0 0 0 0 0 0 1.8150 -2.5860 0.7890 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.5440 1.8890 -0.8730 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5270 1.8790 0.9080 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0190 -0.3820 0.0530 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4760 -0.3560 -0.9140 H 0 0 0 0 0 0 0 0 0 0 0 0 3.2000 1.8470 1.1970 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6820 1.8200 2.1260 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3500 3.8850 0.0600 H 0 0 0 0 0 0 0 0 0 0 0 0 2.1630 0.0210 1.1550 N 0 0 0 0 0 0 0 0 0 0 0 0 2.7320 -0.3710 1.8900 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4100 3.5170 0.0660 N 0 0 0 0 0 0 0 0 0 0 0 0 0.8630 3.9090 -0.6860 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2210 -2.7160 1.6370 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.1490 -3.6790 1.6080 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 6 1 0 0 0 0 1 10 1 0 0 0 0 1 11 1 0 0 0 0 2 3 1 0 0 0 0 2 12 1 0 0 0 0 2 13 1 0 0 0 0 3 4 1 0 0 0 0 3 8 1 0 0 0 0 3 17 1 0 0 0 0 5 6 1 0 0 0 0 5 14 1 0 0 0 0 5 15 1 0 0 0 0 5 17 1 0 0 0 0 6 7 1 0 0 0 0 6 19 1 0 0 0 0 8 9 2 0 0 0 0 8 21 1 0 0 0 0 16 19 1 0 0 0 0 17 18 1 0 0 0 0 19 20 1 0 0 0 0 21 22 1 0 0 0 0 M END