[cclib-svn] SF.net SVN: cclib: [600] trunk

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Revision: 600
          http://svn.sourceforge.net/cclib/?rev=600&view=rev
Author:   langner
Date:     2007-03-27 09:45:50 -0700 (Tue, 27 Mar 2007)

Log Message:
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Changed Gaussian coefficients in etsecs to unnormalized values (instead of squared and doubled). GAMESS parser now parses symmetries and creates etsyms in some fashion (at least for CIS). Jaguar parser also parses etsecs for CIS and created etsyms ('Sinlget-A' everywhere). Fixed units of etenergies in GAMESS/jaguar parsers. Added generic etenergies/etsecs/etsyms tests, and test for values of etenergies and coefficients in etsecs for water (RHF/CIS in STO-3G).

Modified Paths:
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    trunk/src/cclib/parser/gamessparser.py
    trunk/src/cclib/parser/gaussianparser.py
    trunk/src/cclib/parser/jaguarparser.py
    trunk/test/testCI.py

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