#------------------------------------------------------------------------------
#$Date: 2024-05-06 10:39:41 +0300 (Mon, 06 May 2024) $
#$Revision: 291735 $
#$URL: file:///home/coder/svn-repositories/cod/cif/9/00/97/9009734.cif $
#------------------------------------------------------------------------------
#
# This file is available in the Crystallography Open Database (COD),
# http://www.crystallography.net/. The original data for this entry
# were provided the American Mineralogist Crystal Structure Database,
# http://rruff.geo.arizona.edu/AMS/amcsd.php
#
# The file may be used within the scientific community so long as
# proper attribution is given to the journal article from which the
# data were obtained.
#
data_9009734
loop_
_publ_author_name
'Ahtee, M.'
_publ_section_title
;
 Lattice constants of some binary alkali halide solid solutions.
;
_journal_name_full
'Annales Academiae Scientiarum Fennicae Series A6: Physica'
_journal_page_first              1
_journal_page_last               11
_journal_paper_doi               10.1177/000271625731300103
_journal_volume                  313
_journal_year                    1969
_chemical_formula_structural     KBr
_chemical_formula_sum            'Br K'
_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_length_a                   6.5847
_cell_length_b                   6.5847
_cell_length_c                   6.5847
_cell_formula_units_Z            4
_cell_volume                     285.501
_database_code_amcsd             0011995
_exptl_crystal_density_diffrn    2.769
_cod_original_sg_symbol_H-M      'F m 3 m'
_cod_original_formula_sum        'K Br'
_cod_database_code               9009734
_amcsd_formula_title             KBr
loop_
_space_group_symop_operation_xyz
x,y,z
x,1/2+y,1/2+z
1/2+x,y,1/2+z
1/2+x,1/2+y,z
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z,1/2-x,1/2+y
1/2+z,-x,1/2+y
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1/2-y,z,1/2-x
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x,-y,z
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1/2+x,-y,1/2+z
1/2+x,1/2-y,z
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1/2-z,x,1/2-y
1/2-z,1/2+x,-y
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y,1/2-z,1/2+x
1/2+y,-z,1/2+x
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1/2-y,1/2-z,-x
loop_
_atom_site_label
_atom_site_fract_x
_atom_site_fract_y
_atom_site_fract_z
K 0.00000 0.00000 0.00000
Br 0.50000 0.50000 0.50000
loop_
_cod_related_entry_id
_cod_related_entry_database
_cod_related_entry_code
1 MPOD 1000147
2 AMCSD 0011995
