CCL: NBO default structure



 Sent to CCL by: Sergio Emanuel Galembeck [segalemb/a\usp.br]
 Dear Tamar,
      You can choose a different structure using the $choose block.
 I am not sure about the energetic meaning of the resonance structure
 choosen by NBO.
            Best regards,
                         Sérgio
 Citando "etamar|fh.huji.ac.il" <owner-chemistry\a/ccl.net>:
 
 Sent to CCL by: etamar###fh.huji.ac.il
 Dear All
 I wonder if the default structure of an NBO analysis is always
 the lowest one in energy.
 Is it possible to choose a different structure which will be lower in energy?
 and if so- what is the energetic meaning of the default structure?
 thank you
 Tamar
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