diff --git a/doc/src/molecule.rst b/doc/src/molecule.rst index 5dcd30f508..c3c578f5ec 100644 --- a/doc/src/molecule.rst +++ b/doc/src/molecule.rst @@ -121,6 +121,11 @@ molecule (header keyword = inertia). ensure space is allocated for storing topology info for molecules that are added later. +---------- + +Format of a molecule file +""""""""""""""""""""" + The format of an individual molecule file is similar but (not identical) to the data file read by the :doc:`read_data ` commands, and is as follows.