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#$Date: 2016-02-20 02:53:41 +0200 (Sat, 20 Feb 2016) $
#$Revision: 176768 $
#$URL: svn://www.crystallography.net/cod/cif/2/10/16/2101605.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_2101605
loop_
_publ_author_name
'Baldinozzi, G.'
'Goutenoire, F.'
'Hervieu, M.'
'Suard, E.'
'Grebille, D.'
_publ_section_title
;
 Incommensurate modulated disorder in Ba~0.85~Ca~2.15~In₆O₁₂
;
_journal_issue                   5
_journal_name_full               'Acta Crystallographica Section B'
_journal_page_first              780
_journal_page_last               789
_journal_paper_doi               10.1107/S0108768196006519
_journal_volume                  52
_journal_year                    1996
_chemical_formula_sum            'Ba0.85 Ca2.15 In6 O12'
_chemical_formula_weight         1083.82
_symmetry_cell_setting           hexagonal
_symmetry_space_group_name_Hall  '-P 6c'
_symmetry_space_group_name_H-M   'P 63/m'
_cell_angle_alpha                90.0
_cell_angle_beta                 90.0
_cell_angle_gamma                120.0
_cell_formula_units_Z            1
_cell_length_a                   9.88800(10)
_cell_length_b                   9.88800(10)
_cell_length_c                   3.21700(10)
_cell_volume                     272.395(9)
_diffrn_radiation_type           Cu
_diffrn_radiation_wavelength     1.54184
_exptl_crystal_density_diffrn    5.44
_cod_data_source_file            du0409.cif
_cod_data_source_block           du0409a
_cod_original_cell_volume        272.4
_cod_database_code               2101605
loop_
_atom_site_label
_atom_site_fract_x
_atom_site_fract_y
_atom_site_fract_z
Ba .0 .0 .160(12)
Ca .333 .6667 .25
In .34720(10) -.0044(2) .25
O1 .1935(3) .3048(3) .25
O2 .5316(3) .3985(2) .25
