PUBCHEM-ZINC05134232 MOE2007 3D CORINA 3.40 0006 02.08.2006 22 22 0 0 1 0 0 0 0 0999 V2000 0.1830 2.0660 -0.1010 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0580 0.5900 0.1350 C 0 0 0 0 0 0 0 0 0 0 0 0 2.1610 0.0440 -0.9810 C 0 0 3 0 0 0 0 0 0 0 0 0 2.4540 -0.4340 -1.9260 H 0 0 0 0 0 0 0 0 0 0 0 0 2.4270 1.5360 -1.1170 C 0 0 0 0 0 0 0 0 0 0 0 0 1.6810 2.3860 -0.0870 C 0 0 3 0 0 0 0 0 0 0 0 0 2.0900 2.1680 0.9090 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7950 3.9040 -0.3170 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2430 4.2650 -1.4400 O 0 0 0 0 0 0 0 0 0 0 0 0 2.8950 -0.7970 0.0990 C 0 0 0 0 0 0 0 0 0 0 0 0 2.1660 -1.7810 0.4590 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.2590 2.3660 -1.0610 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3420 2.6380 0.6740 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3070 0.2730 1.1180 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1190 0.3360 0.0530 H 0 0 0 0 0 0 0 0 0 0 0 0 3.5030 1.7370 -1.0440 H 0 0 0 0 0 0 0 0 0 0 0 0 2.1300 1.8420 -2.1300 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6580 -0.2080 -0.8920 N 0 3 0 0 0 0 0 0 0 0 0 0 0.6610 -1.1970 -0.5500 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2130 -0.1680 -1.8140 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4060 4.6110 0.6570 O 0 5 0 0 0 0 0 0 0 0 0 0 4.0380 -0.4310 0.4570 O 0 5 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 12 1 0 0 0 0 1 13 1 0 0 0 0 2 14 1 0 0 0 0 2 15 1 0 0 0 0 2 18 1 0 0 0 0 3 4 1 0 0 0 0 3 5 1 0 0 0 0 3 10 1 0 0 0 0 3 18 1 0 0 0 0 5 6 1 0 0 0 0 5 16 1 0 0 0 0 5 17 1 0 0 0 0 6 7 1 0 0 0 0 6 8 1 0 0 0 0 8 9 2 0 0 0 0 8 21 1 0 0 0 0 10 11 2 0 0 0 0 10 22 1 0 0 0 0 18 19 1 0 0 0 0 18 20 1 0 0 0 0 M CHG 1 18 1 M CHG 1 21 -1 M CHG 1 22 -1 M END