#------------------------------------------------------------------------------
#$Date: 2024-05-02 13:48:35 +0300 (Thu, 02 May 2024) $
#$Revision: 291455 $
#$URL: file:///home/coder/svn-repositories/cod/cif/9/00/76/9007638.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_9007638
loop_
_publ_author_name
'Okada, K.'
'Ossaka, J.'
_publ_section_title
;
 Structures of potassium sodium sulphate and tripotassium sodium disulphate
;
_journal_name_full               'Acta Crystallographica, Section B'
_journal_page_first              919
_journal_page_last               921
_journal_paper_doi               10.1107/S0567740880004852
_journal_volume                  36
_journal_year                    1980
_chemical_formula_structural     KNaSO4
_chemical_formula_sum            'K Na O4 S'
_space_group_IT_number           156
_symmetry_space_group_name_Hall  'P 3 -2"'
_symmetry_space_group_name_H-M   'P 3 m 1'
_cell_angle_alpha                90
_cell_angle_beta                 90
_cell_angle_gamma                120
_cell_length_a                   5.6066
_cell_length_b                   5.6066
_cell_length_c                   7.177
_cell_formula_units_Z            2
_cell_volume                     195.377
_database_code_amcsd             0009707
_exptl_crystal_density_diffrn    2.688
_cod_original_formula_sum        'K Na S O4'
_cod_database_code               9007638
_amcsd_formula_title             KNaSO4
loop_
_space_group_symop_operation_xyz
x,y,z
-y,-x,z
-y,x-y,z
x,x-y,z
-x+y,-x,z
-x+y,y,z
loop_
_atom_site_label
_atom_site_fract_x
_atom_site_fract_y
_atom_site_fract_z
K1 0.00000 0.00000 0.00000
Na1 0.00000 0.00000 0.50400
Na2 0.66667 0.33333 0.68900
K2 0.33333 0.66667 0.30900
S1 0.66667 0.33333 0.23400
S2 0.33333 0.66667 0.76400
O1 0.66667 0.33333 0.02600
O2 0.33333 0.66667 0.95500
O3 0.18700 -0.18700 0.71000
O4 0.80300 -0.80300 0.31400
loop_
_cod_related_entry_id
_cod_related_entry_database
_cod_related_entry_code
1 AMCSD 0009707
