diff --git a/cif_core.dic b/cif_core.dic index 154d62c..10b7949 100644 --- a/cif_core.dic +++ b/cif_core.dic @@ -11,7 +11,7 @@ data_CIF_CORE _dictionary.title CIF_CORE _dictionary.class Instance _dictionary.version 3.4.0 - _dictionary.date 2026-07-10 + _dictionary.date 2026-07-19 _dictionary.uri https://raw.githubusercontent.com/COMCIFS/cif_core/main/cif_core.dic _dictionary.ddl_conformance 4.2.0 @@ -25661,7 +25661,7 @@ save_atom_type.radius_bond _definition.id '_atom_type.radius_bond' _alias.definition_id '_atom_type_radius_bond' - _definition.update 2026-04-20 + _definition.update 2026-07-19 _description.text ; The effective intra-molecular bonding radius of this atom type. @@ -25673,9 +25673,10 @@ save_atom_type.radius_bond _type.container Single _type.contents Real _enumeration.range 0.0:5.0 - _enumeration.def_index_ids ['_atom_type.symbol'] + _enumeration.def_index_ids ['_atom_type.element_symbol'] - _import.get [{'file':templ_enum.cif 'save':radius_bond}] + _import.get + [{'file':templ_enum.cif 'save':element_symbol_to_covalent_radius}] save_ @@ -29441,7 +29442,7 @@ save_ _atom_site.U_iso_or_equiv. [bm, after Nespolo, M. (2024). J. Appl. Cryst. 57, 1733-1746] ; - 3.4.0 2026-07-10 + 3.4.0 2026-07-19 ; # Append change information below and update the above date # until dictionary is ready for release. @@ -29468,4 +29469,6 @@ save_ Added _space_group.reference_setting, _space_group.transform_Pp_abc, and _space_group.transform_Qq_xyz from symCIF to SPACE_GROUP. + + Update enumeration for _atom_type.radius_bond. ;