l202 ​
Implementation level ​
Type | Status |
---|---|
CML extraction template | |
HTML5 representation |
Template attributes ​
Attribute | Value |
---|---|
source | Gaussian log |
id | l202 |
name | Reorients coordinates, calculates symmetry, and checks variables |
repeat | * |
pattern | \s*\(Enter.*l202\..* |
pattern2 | \s*(Input|Standard)\s*orientation:\s*$\s*\-+\s* |
endPattern | \s*Leave\sLink\s+202\s.* |
endPattern2 | \s*Rotational\sconstants\s*\(GHZ\).* |
endOffset | 1 |
keep | firstandlast |
xml:base | l202.xml |
Template definition ​
xml
<templateList> <xi:include href="l202/l202.orient.xml" /> <xi:include href="l202/l202.distmat.xml" /> <xi:include href="l202/l202.stoich.xml" /> <xi:include href="l202/l202.rotconst.xml" />
</templateList>