Open Babel is a chemical toolbox designed to speak the many languages of chemical data. It’s an open, collaborative project allowing anyone to search, convert, analyze, or store data from molecular modeling, chemistry, solid-state materials, biochemistry, or related areas.

Open Babel web site:http://openbabel.org

How to run

For example:

module load OpenBabel/3.1.1-gcc-2022a-eb
obabel