From: Yaron P. <yar...@li...> - 2013-02-19 19:04:23
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Dear cclib community, I'm trying to get the z-matrix (internal coordinates) from a Gaussian output file using cclib. I know that Gaussian do converts any internal or XYZ coordinates in the input to it's format so one can get internal coordinates from it, even if the input file was in cartesian coordinates. Can cclib output the internal coordinates? Thanks very much, Yaron |