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qcdata


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Author: None
License: The MIT License (MIT) Copyright (c) 2021 Colton Hicks Permission is hereby granted, free of charge, to any person obtaining a copy of this software and associ...
Summary: Beautiful and user friendly data structures for quantum chemistry.
Latest version: 0.17.1
Required dependencies: eval-type-backport | numpy | pydantic | pyyaml | qcconst | toml | typing-extensions
Optional dependencies: ipython | matplotlib | py3dmol | qcinf | rdkit

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