#------------------------------------------------------------------------------
#$Date: 2025-08-18 17:14:33 +0200 (Mon, 18 Aug 2025) $
#$Revision: 301778 $
#$URL: svn://saulius.grazulis.lt/cod-secondary/cif/1/53/69/1536985.cif $
#------------------------------------------------------------------------------
#
# This file is available in the Crystallography Open Database (COD),
# http://www.crystallography.net/
#
# All data on this site have been placed in the public domain by the
# contributors.
#
data_1536985
loop_
_publ_author_name
'Kraft, T.'
'Jansen, M.'
_publ_section_title
;
 Die Kristallstruktur von Lithiummetaperiodat, Li I O4
;
_journal_name_full
'Zeitschrift fuer Anorganische und Allgemeine Chemie'
_journal_page_first              484
_journal_page_last               487
_journal_volume                  621
_journal_year                    1995
_chemical_formula_sum            'I Li O4'
_chemical_name_systematic        'Li (I O4)'
_space_group_IT_number           14
_symmetry_space_group_name_Hall  '-P 2yn'
_symmetry_space_group_name_H-M   'P 1 21/n 1'
_cell_angle_alpha                90
_cell_angle_beta                 104.21
_cell_angle_gamma                90
_cell_formula_units_Z            4
_cell_length_a                   5.255
_cell_length_b                   8.511
_cell_length_c                   7.969
_cell_volume                     345.511
_citation_journal_id_ASTM        ZAACAB
_cod_data_source_file            Kraft_ZAACAB_1995_1633.cif
_cod_data_source_block           I1Li1O4
_cod_original_cell_volume        345.5105
_cod_original_sg_symbol_Hall     '-P 2ybc (x-z,y,z)'
_cod_original_formula_sum        'I1 Li1 O4'
_cod_database_code               1536985
loop_
_symmetry_equiv_pos_as_xyz
x,y,z
-x+1/2,y+1/2,-z+1/2
-x,-y,-z
x-1/2,-y-1/2,z-1/2
loop_
_atom_site_label
_atom_site_type_symbol
_atom_site_fract_x
_atom_site_fract_y
_atom_site_fract_z
_atom_site_occupancy
_atom_site_U_iso_or_equiv
O4 O-2 0.1379 0.0813 -0.1127 1 0.0
O3 O-2 -0.0678 0.2642 0.1302 1 0.0
I1 I+7 0.21753 0.20411 0.07041 1 0.0
Li1 Li+1 -0.2516 0.4638 0.1683 1 0.0
O1 O-2 0.3868 0.3709 0.0213 1 0.0
O2 O-2 0.4178 0.1008 0.2447 1 0.0
loop_
_cod_related_entry_id
_cod_related_entry_database
_cod_related_entry_code
1 PubChem 23711816
