equivalentAtoms.rb

This can find atoms on equivalent sites. This requires syminfo.yaml, so symmetry check by fropho has to be done in advance.
usage
	equivalentAtoms.rb [OPTIONS] [syminfo.yaml]

option
-p, --primitive
Use primitive symmetry information in symminfo.yaml

--syminfo
Set arbitral symminfo.yaml file

-s, --symprec
Symmetry check torrelance
default = 1e-2



togo 2009-02-12
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