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[Open Babel] about running open babel

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[Open Babel] about running open babel

勝田 貴之

Usage: babel [-i<input-type>] <name> [-o<output-type>] <name>

What does it mean ? If gamess out is input xyz type file is out, please teach me concrete command.

e.g. babel -i exam01.log -o exam01.xyz

Takayuki Katsuda

Kyoto University

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Re: [Open Babel] about running open babel

Mathias W.
勝田 貴之 wrote:
> Usage: babel [-i<input-type>] <name> [-o<output-type>] <name>
>
> What does it mean ? If gamess out is input xyz type file is out, please teach me concrete command.
>  
You should have used "babel -H" to find the answer!
> e.g. babel -i exam01.log -o exam01.xyz
>  
Here you are:

babel -igamout exam01.log -oxyz exam01.xyz


Mathias


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