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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/1/53/31/1533183.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_1533183
loop_
_publ_author_name
'Fuentes, A.F.'
'Garza-Garcia, M.'
'Escalante-Garcia, J.I.'
'Mendoza-Suarez, G.'
'Boulahya, K.'
'Amador, U.'
_publ_section_title
;
 Synthesis and structural characterization of Ba (Ln(III)2/3 B(VI)1/3) O3
 (Ln(III) = Dy, Gd and Sm; B(VI) = Mo or W) complex perovskites
;
_journal_name_full               'Journal of Solid State Chemistry'
_journal_page_first              299
_journal_page_last               305
_journal_volume                  175
_journal_year                    2003
_chemical_formula_sum            'Ba O3 Sm0.667 W0.333'
_chemical_name_systematic        'Ba (Sm0.667 W0.333) O3'
_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            8
_cell_length_a                   8.6226
_cell_length_b                   8.6226
_cell_length_c                   8.6226
_cell_volume                     641.084
_citation_journal_id_ASTM        JSSCBI
_cod_data_source_file            Fuentes_JSSCBI_2003_199.cif
_cod_data_source_block           Ba1O3Sm0.667W0.333
_cod_original_cell_volume        641.0836
_cod_original_formula_sum        'Ba1 O3 Sm0.667 W0.333'
_cod_database_code               1533183
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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
W1 W+6 0.5 0.5 0.5 0.667 0.0
Sm2 Sm+3 0.5 0.5 0.5 0.333 0.0
Sm1 Sm+3 0 0 0 1 0.0
O1 O-2 0.249 0 0 1 0.0
Ba1 Ba+2 0.25 0.25 0.25 1 0.0
