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#$Date: 2016-02-13 21:28:24 +0200 (Sat, 13 Feb 2016) $
#$Revision: 176429 $
#$URL: svn://www.crystallography.net/cod/cif/1/52/10/1521090.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_1521090
loop_
_publ_author_name
'Guethoff, F.'
'Ohl, M.'
'Reehuis, M.'
'Loidl, A.'
_publ_section_title
;
 Phase transitions and relaxation dynamics in (N H4 I)x (K I)1-x mixed
 crystals
;
_journal_name_full               'Physik (Berlin)'
_journal_page_first              310
_journal_page_last               320
_journal_volume                  266
_journal_year                    1999
_chemical_formula_sum            'H2.2 I K0.45 N0.55'
_chemical_name_systematic        '((N H4) I)0.55 (K I)0.45'
_space_group_IT_number           225
_symmetry_space_group_name_Hall  '-F 4 2 3'
_symmetry_space_group_name_H-M   'F m -3 m'
_cell_angle_alpha                90
_cell_angle_beta                 90
_cell_angle_gamma                90
_cell_formula_units_Z            4
_cell_length_a                   7.108
_cell_length_b                   7.108
_cell_length_c                   7.108
_cell_volume                     359.122
_citation_journal_id_ASTM        PHYBE3
_cod_data_source_file            Guethoff_PHYBE3_1999_579.cif
_cod_data_source_block           H2.2I1K0.45N0.55
_cod_original_cell_volume        359.1222
_cod_original_formula_sum        'H2.2 I1 K0.45 N0.55'
_cod_database_code               1521090
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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
K1 K+1 0.5 0.5 0.5 0.45 0.0
H1 H+1 0.575 0.575 0.575 0.0687 0.0
I1 I-1 0 0 0 1 0.0
H2 H+1 0.5242 0.5242 0.3553 0.0687 0.0
N1 N-3 0.5 0.5 0.5 0.55 0.0
