Thank you very much for you answers Is there a difference between trace of magnetic susceptibility in the file case.xim and :NMRXIM in the file case.outputnmr_integ because they have two different values?
_______________________________________________ Wien mailing list Wien@zeus.theochem.tuwien.ac.at http://zeus.theochem.tuwien.ac.at/mailman/listinfo/wien SEARCH the MAILING-LIST at: http://www.mail-archive.com/wien@zeus.theochem.tuwien.ac.at/index.html
