Bugs item #2831800, was opened at 2009-08-04 03:47
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Category: None
Group: None
Status: Open
Resolution: None
Priority: 5
Private: No
Submitted By: Nobody/Anonymous (nobody)
Assigned to: Nobody/Anonymous (nobody)
Summary: Wrong geometries
Initial Comment:
When opening output files like *.log from GAMESS or *.out from Gaussian, Avogadro imports the geometries, but wastes them. In particular, the angels are wrong, bonds are missing and the carbon atoms mostly are “flat”.
I don’t know, when the problem occurred the first time, but I remember it working. Probably since 0.9.4 or so…
Operating System: Gentoo / 2.6.30 / KDE 4.2.4
Avogadro Version: 0.9.7 (Portage Tree)
OpenBabel Version: 2.2.0
Language: German
You can respond by visiting:
https://sourceforge.net/tracker/?func=detail&atid=835077&aid=2831800&group_id=165310