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iodata
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A
docs\example_scripts\write_gaussian_com_lot.py
 1 -
A
docs\example_scripts\write_gaussian_com_template.py
 1 -
A
docs\gen_formats.py
15 1 -
A
docs\gen_formats_tab.py
36 1 1
B
iodata\formats\json_qcschema.py
200 1 5
A
iodata\inputs\__init__.py
 1 -
A
iodata\test\__init__.py
 1 -
A
iodata\test\data\__init__.py
 1 -
A
iodata\test\test_json_qcschema.py
 1 1
A
tools\test_harmonics.py
5 1 -