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#$Date: 2016-02-13 20:28:24 +0100 (Sat 13 de Feb de 2016) $
#$Revision: 176429 $
#$URL: svn://www.crystallography.net/cod/cif/1/52/23/1522303.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_1522303
loop_
_publ_author_name
'Zakharov, N.D.'
'Werner, P.'
'Zibrov, I.P.'
'Filonenko, V.P.'
'Sundberg, M.R.'
_publ_section_title
;
 Intergrowth tungsten bronze structures of Prx W O3, formed at 50 kbar: an
 HRTEM study
;
_journal_name_full               'Journal of Solid State Chemistry'
_journal_page_first              536
_journal_page_last               544
_journal_volume                  147
_journal_year                    1999
_chemical_formula_sum            'O3 Pr0.2 W'
_chemical_name_systematic        'Pr0.2 W O3'
_space_group_IT_number           16
_symmetry_space_group_name_Hall  'P 2 2'
_symmetry_space_group_name_H-M   'P 2 2 2'
_cell_angle_alpha                90
_cell_angle_beta                 90
_cell_angle_gamma                90
_cell_formula_units_Z            5
_cell_length_a                   10.17
_cell_length_b                   7.418
_cell_length_c                   3.79
_cell_volume                     285.922
_citation_journal_id_ASTM        JSSCBI
_cod_data_source_file            Zakharov_JSSCBI_1999_355.cif
_cod_data_source_block           O3Pr0.2W1
_cod_original_cell_volume        285.9216
_cod_original_formula_sum        'O3 Pr0.2 W1'
_cod_database_code               1522303
loop_
_symmetry_equiv_pos_as_xyz
x,y,z
-x,-y,z
x,-y,-z
-x,y,-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
W2 W+5 0.19 0.26 0 1 0.0
Pr1 Pr+3 0.5 0.5 0.5 1 0.0
O6 O-2 0.19 0.26 0.5 1 0.0
W1 W+5 0.5 0 0 1 0.0
O1 O-2 0.15 0 0 1 0.0
O5 O-2 0.5 0 0.5 1 0.0
O2 O-2 0 0.3 0 1 0.0
O3 O-2 0.37 0.18 0 1 0.0
O4 O-2 0.21 0.5 0 1 0.0
