NCID-ZINC01729729 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 0.7700 -0.4920 -1.2280 C 0 0 3 0 0 0 0 0 0 0 0 0 0.2700 -0.1410 -2.1310 H 0 0 0 0 0 0 0 0 0 0 0 0 2.1480 1.5020 -1.2310 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 1.9340 1.7190 0.9020 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8100 -1.9990 -1.2300 C 0 0 0 0 0 0 0 0 0 0 0 0 1.7990 -2.5770 -0.8470 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 0.4930 -0.3660 0.9050 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0200 -0.3820 -0.0330 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6410 1.8430 -2.1340 H 0 0 0 0 0 0 0 0 0 0 0 0 3.1770 1.8600 -1.2340 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3490 3.8860 -0.0590 H 0 0 0 0 0 0 0 0 0 0 0 0 2.1410 0.0340 -1.1920 N 0 0 0 0 0 0 0 0 0 0 0 0 2.6380 -0.3090 -0.3840 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4090 3.5170 -0.0510 N 0 0 0 0 0 0 0 0 0 0 0 0 0.8840 3.8480 -0.8460 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2530 -2.6980 -1.6580 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.1800 -3.6620 -1.6400 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