Multiple fixes #2
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multiple fixes.
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thermostatistical correction refined
checked for wrong functional in TM/control file
fixed wrong or missing PATH handling of external programs
fixed ORCA version-number read in
increased memory for TM rpacor (shielding constant) calculations
added error to be reprinted if high RMSD between DFT and GFN geometries for thermostatistical correction
reformatted parts of the code