AUTHORS.rst
CONTRIBUTING.rst
HISTORY.rst
LICENSE
MANIFEST.in
README.rst
requirements.txt
requirements_dev.txt
setup.cfg
setup.py
versioneer.py
docs/Makefile
docs/authors.rst
docs/conf.py
docs/history.rst
docs/index.rst
docs/make.bat
docs/developer/contributing.rst
docs/developer/index.rst
docs/developer/installation.rst
docs/developer/readme.rst
docs/developer/usage.rst
docs/user/index.rst
docs/user/overview.rst
read_structure_step/__init__.py
read_structure_step/_version.py
read_structure_step/errors.py
read_structure_step/read.py
read_structure_step/read_structure.py
read_structure_step/read_structure_parameters.py
read_structure_step/read_structure_step.py
read_structure_step/tk_read_structure.py
read_structure_step/tk_write_structure.py
read_structure_step/utils.py
read_structure_step/write.py
read_structure_step/write_structure.py
read_structure_step/write_structure_parameters.py
read_structure_step/write_structure_step.py
read_structure_step.egg-info/PKG-INFO
read_structure_step.egg-info/SOURCES.txt
read_structure_step.egg-info/dependency_links.txt
read_structure_step.egg-info/entry_points.txt
read_structure_step.egg-info/requires.txt
read_structure_step.egg-info/top_level.txt
read_structure_step.egg-info/zip-safe
read_structure_step/data/references.bib
read_structure_step/formats/__init__.py
read_structure_step/formats/registries.py
read_structure_step/formats/which.py
read_structure_step/formats/cif/__init__.py
read_structure_step/formats/cif/cif.py
read_structure_step/formats/cif/mmcif.py
read_structure_step/formats/mol2/__init__.py
read_structure_step/formats/mol2/mol2.py
read_structure_step/formats/mop/__init__.py
read_structure_step/formats/mop/find_mopac.py
read_structure_step/formats/mop/obabel.py
read_structure_step/formats/openbabel_io/__init__.py
read_structure_step/formats/openbabel_io/checkers.py
read_structure_step/formats/openbabel_io/obabel.py
read_structure_step/formats/sdf/__init__.py
read_structure_step/formats/sdf/sdf.py
read_structure_step/formats/smi/__init__.py
read_structure_step/formats/smi/smi.py
tests/__init__.py
tests/build_filenames.py
tests/methylidyne.mop
tests/mopac_exists.py
tests/test_formats.py
tests/test_read_structure_step.py
tests/test_utils.py
tests/data/3TR_model.json
tests/data/3TR_model.mol2
tests/data/3TR_model.pdb
tests/data/3TR_model.sdf
tests/data/3TR_model.xyz
tests/data/Cr_ACETCR.mop
tests/data/Cu(II)4Br10(2-) (CIVNAW10).mop
tests/data/RM1 63 Europium, CCDC entry LAPJAN.mop
tests/data/acetonitrile.mop
tests/data/lithium fluoride, trimer.mop
tests/data/methylidyne.mop
tests/data/potassium fluoride, dimer.mop
tests/data/spc
tests/data/spc.xyz