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#$Date: 2018-09-27 07:13:35 +0300 (Thu, 27 Sep 2018) $
#$Revision: 211196 $
#$URL: file:///home/coder/svn-repositories/cod/cif/1/52/89/1528927.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_1528927
loop_
_publ_author_name
'Ting, V.'
'Liu, Y.'
'James, M.'
'Noren, L.'
'Withers, R.L.'
'Fitz Gerald, J.D.'
_publ_section_title
;
 A structure and phase analysis investigation of the 1:1 ordered A2 In Nb
 O6 perovskites (A = Ca(2+), Sr(2+), Ba(2+))
;
_journal_name_full               'Journal of Solid State Chemistry'
_journal_page_first              551
_journal_page_last               562
_journal_volume                  179
_journal_year                    2006
_chemical_formula_sum            'Ba2 In Nb O6'
_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            4
_cell_length_a                   8.2819
_cell_length_b                   8.2819
_cell_length_c                   8.2819
_cell_volume                     568.054
_citation_journal_id_ASTM        JSSCBI
_cod_data_source_file            Ting_JSSCBI_2006_927.cif
_cod_data_source_block           Ba2In1Nb1O6
_cod_original_cell_volume        568.0545
_cod_original_formula_sum        'Ba2 In1 Nb1 O6'
_cod_database_code               1528927
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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
O1 O-2 0.2563 0 0 1 0.0
In1 In+3 0 0 0 0.75 0.0
Ba1 Ba+2 0.25 0.25 0.25 1 0.0
Nb1 Nb+5 0.5 0 0 0.75 0.0
Nb2 Nb+5 0 0 0 0.25 0.0
In2 In+3 0.5 0 0 0.25 0.0
