#------------------------------------------------------------------------------
#$Date: 2024-05-23 12:45:01 +0300 (Thu, 23 May 2024) $
#$Revision: 292002 $
#$URL: file:///home/coder/svn-repositories/cod/cif/9/01/39/9013909.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_9013909
loop_
_publ_author_name
'Macavei, J.'
'Schulz, H.'
_publ_section_title
;
 The crystal structure of wolframite type tungstates at high pressure
 Note: P = 2.81 GPa
;
_journal_name_full               'Zeitschrift fur Kristallographie'
_journal_page_first              193
_journal_page_last               208
_journal_volume                  207
_journal_year                    1993
_chemical_compound_source        Synthetic
_chemical_formula_structural     Mn(WO4)
_chemical_formula_sum            'Mn O4 W'
_chemical_name_mineral           Huebnerite
_space_group_IT_number           13
_symmetry_space_group_name_Hall  '-P 2yc'
_symmetry_space_group_name_H-M   'P 1 2/c 1'
_cell_angle_alpha                90
_cell_angle_beta                 91.22
_cell_angle_gamma                90
_cell_length_a                   4.789
_cell_formula_units_Z            2
_cell_length_b                   5.7106
_cell_length_c                   4.9738
_cell_volume                     135.993
_database_code_amcsd             0011053
_diffrn_ambient_pressure         2.81e+06
_exptl_crystal_density_diffrn    7.394
_cod_original_formula_sum        'Mn W O4'
_cod_database_code               9013909
loop_
_space_group_symop_operation_xyz
x,y,z
x,-y,1/2+z
-x,y,1/2-z
-x,-y,-z
loop_
_atom_site_label
_atom_site_fract_x
_atom_site_fract_y
_atom_site_fract_z
_atom_site_U_iso_or_equiv
Mn 0.50000 0.68490 0.25000 0.01040
W 0.00000 0.18110 0.25000 0.00620
O1 0.21300 0.10200 0.94300 0.01100
O2 0.25000 0.37600 0.39400 0.01100
loop_
_cod_related_entry_id
_cod_related_entry_database
_cod_related_entry_code
1 AMCSD 0011053
