Initial work on CDA, tested against Frenking's CDA using (BH3)(CO); works although off by a factor of two; emailing Frenking
Initial work on CDA, tested against Frenking's CDA using (BH3)(CO); works although off by a factor of two; emailing Frenking


git-svn-id: d468cea6ffe92bc1eb1f3bde47ad7e70b065426a@463 5acbf244-8a03-4a8b-a19b-0d601add4d27

Clyde-fare/cclib_bak,Clyde-fare/cclib_bak