[molpro-user] Job termination during Pipek-Mezey Localisation

[Seth Olsen]

Hi Hans-Joachim,
Here are the input files in a zipped tar archive.  The job was run from restart; in order to run it as is for reproduction of the problem, uncomment the matrop section in the front (to read in the orbitals, included as ascii flle), the geometry, and the orbital rotations in the first mcscf deck.
Many Thanks,
seth
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