calibration of semiempirical MO calculations



 CCL list
 I am looking for any references to the callibration of MO
 calculations using the known X-ray structure of  molecule.
 I will summarise the responces if more people are interested.
 Thanks for your time
 Gert Kruger
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 Dr HG Kruger, Dept Chemistry, University of Natal,
 PO Box 18091, Dalbridge 4014, Durban, South Afica
 Tel  +27-31-2602181   Fax  +27-31-2603091
 Email  kruger #*at*# che.und.ac.za
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