LICENSE
README.md
pyproject.toml
src/irs/QM_combiner.py
src/irs/__init__.py
src/irs/ir_Structure.py
src/irspectrum_sim.egg-info/PKG-INFO
src/irspectrum_sim.egg-info/SOURCES.txt
src/irspectrum_sim.egg-info/dependency_links.txt
src/irspectrum_sim.egg-info/requires.txt
src/irspectrum_sim.egg-info/top_level.txt
tests/test_QM_combiner.py
tests/test_Structure.py
tests/test_ir_ORCA.py
tests/test_ir_structure_combine.py