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#$Date: 2025-08-18 18:14:33 +0300 (Mon, 18 Aug 2025) $
#$Revision: 301778 $
#$URL: file:///home/coder/svn-repositories/cod/cif/1/53/45/1534588.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_1534588
loop_
_publ_author_name
'Liminga, R.'
'Svensson, C.'
'Albertsson, J.'
'Abrahams, S.C.'
_publ_section_title
;
 gamma-lithium iodate at 515 K and the alpha-Li I O3 to gamma-Li I O3,
 gamma-Li I O3 to beta-Li I O3 phase transitions
;
_journal_name_full               'Journal of Chemical Physics'
_journal_page_first              4222
_journal_page_last               4226
_journal_volume                  77
_journal_year                    1982
_chemical_formula_sum            'I Li O3'
_chemical_name_systematic        'Li (I O3)'
_space_group_IT_number           33
_symmetry_space_group_name_Hall  'P 2c -2n'
_symmetry_space_group_name_H-M   'P n a 21'
_cell_angle_alpha                90
_cell_angle_beta                 90
_cell_angle_gamma                90
_cell_formula_units_Z            4
_cell_length_a                   9.422
_cell_length_b                   5.861
_cell_length_c                   5.301
_cell_volume                     292.734
_citation_journal_id_ASTM        JCPSA6
_cod_data_source_file            Liminga_JCPSA6_1982_305.cif
_cod_data_source_block           I1Li1O3
_cod_original_cell_volume        292.7336
_cod_original_formula_sum        'I1 Li1 O3'
_cod_database_code               1534588
loop_
_symmetry_equiv_pos_as_xyz
x,y,z
-x,-y,z+1/2
-x+1/2,y+1/2,z+1/2
x+1/2,-y+1/2,z
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
O3 O-2 0.3663 0.3439 -0.1853 1 0.0
Li1 Li+1 0 0 0.0706 1 0.0
O2 O-2 0.4117 -0.119 -0.1618 1 0.0
I1 I+5 0.3179 0.0751 0 1 0.0
O1 O-2 0.1298 0.056 -0.1813 1 0.0
loop_
_cod_related_entry_id
_cod_related_entry_database
_cod_related_entry_code
1 PubChem 23687747
