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#$Date: 2016-02-14 16:26:36 +0200 (Sun, 14 Feb 2016) $
#$Revision: 176435 $
#$URL: svn://www.crystallography.net/cod/cif/2/10/15/2101573.cif $
#------------------------------------------------------------------------------
#
# This file is available in the Crystallography Open Database (COD),
# http://www.crystallography.net/. The original data for this entry
# were provided by IUCr Journals, http://journals.iucr.org/.
#
# 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_2101573
loop_
_publ_author_name
'Abrahams, S. C.'
'Mirsky, K.'
'Nielson, R. M.'
_publ_section_title
;
 Prediction of ferroelectricity in recent Inorganic Crystal Structure
 Database entries under space group Pba2
;
_journal_issue                   5
_journal_name_full               'Acta Crystallographica Section B'
_journal_page_first              806
_journal_page_last               809
_journal_paper_doi               10.1107/S0108768196004582
_journal_volume                  52
_journal_year                    1996
_chemical_formula_sum            'Ba0.6 Bi K0.4 O2.3'
_symmetry_cell_setting           orthorhombic
_symmetry_space_group_name_Hall  'P 2 -2ab'
_symmetry_space_group_name_H-M   'P b a 2'
_cell_angle_alpha                90.0
_cell_angle_beta                 90.0
_cell_angle_gamma                90.0
_cell_length_a                   6.127
_cell_length_b                   12.016
_cell_length_c                   4.378
_cell_volume                     322.317
_diffrn_radiation_type           Mo
_diffrn_radiation_wavelength     0.71073
_cod_data_source_file            an0526.cif
_cod_data_source_block           an0526b
_cod_original_formula_sum        'Ba0.6 Bi1 K0.4 O2.3'
_cod_database_code               2101573
loop_
_atom_site_label
_atom_site_fract_x
_atom_site_fract_y
_atom_site_fract_z
Ba .8060(10) .1380(10) -.011(8)
Bi .2830(10) .1140(10) .511(7)
O1 .299(2) .1160(10) .004(9)
O2 .7100(10) .2460(10) .553(9)
O3 .0 .0 .544
O4 .0 .500 .544
