updated test case

This commit is contained in:
Niri Govind 2010-09-17 18:32:32 +00:00
parent 2007311f71
commit 49058fe434
2 changed files with 832 additions and 1151 deletions

View file

@ -10,7 +10,7 @@ h -0.514 -0.890 -0.350
end
basis
* library 6-311++G**
* library 6-311G
end
charge 0

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