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Alexander S

Welcome to convert2orcazmatrix.

'Why do i need it?'
Since I use GUI tools which only save the molecules to regular zmatrix format. I created a script that would convert the regular format to the special orca format.

'What does it do?'
usage: convert2orcazmatrix.py [-h] -i INPUTFILE [-o OUTPUTFILE]
It is written in python and converts a regular format zmatrix to the special zmatrix format orca uses.

'What is going to happen with this project?'
This is my first ever SourceForge project. I basiclly just wanted to share what I had made.
But depending on the Feedback I am willing to work on the script.