#------------------------------------------------------------------------------
#$Date: 2018-09-27 07:13:35 +0300 (Thu, 27 Sep 2018) $
#$Revision: 211196 $
#$URL: file:///home/coder/svn-repositories/cod/cif/1/53/23/1532327.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_1532327
loop_
_publ_author_name
'Speakman, S.A.'
'Richardson, J.W.jr.'
'Mitchell, B.J.'
'Misture, S.T.'
_publ_section_title
;
 In-situ diffraction study of Ba2 In2 O5
;
_journal_name_full               'Solid State Ionics'
_journal_page_first              247
_journal_page_last               259
_journal_volume                  149
_journal_year                    2002
_chemical_formula_sum            'Ba1.98 In2.14 O5.01'
_space_group_IT_number           108
_symmetry_space_group_name_Hall  'I 4 -2c'
_symmetry_space_group_name_H-M   'I 4 c m'
_cell_angle_alpha                90
_cell_angle_beta                 90
_cell_angle_gamma                90
_cell_formula_units_Z            4
_cell_length_a                   6.0348
_cell_length_b                   6.0348
_cell_length_c                   17.0688
_cell_volume                     621.625
_citation_journal_id_ASTM        SSIOD3
_cod_data_source_file            Speakman_SSIOD3_2002_849.cif
_cod_data_source_block           Ba1.98In2.14O5.01
_cod_original_cell_volume        621.6254
_cod_database_code               1532327
loop_
_symmetry_equiv_pos_as_xyz
x,y,z
-y,x,z
-x,-y,z
y,-x,z
-x,y,z+1/2
-y,-x,z+1/2
x,-y,z+1/2
y,x,z+1/2
x+1/2,y+1/2,z+1/2
-y+1/2,x+1/2,z+1/2
-x+1/2,-y+1/2,z+1/2
y+1/2,-x+1/2,z+1/2
-x+1/2,y+1/2,z+1
-y+1/2,-x+1/2,z+1
x+1/2,-y+1/2,z+1
y+1/2,x+1/2,z+1
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
In1 In+2 0 0 -0.006 1.139 0.0
O4 O-2 0.2349 0.7349 0.2512 0.607 0.0
O1 O-2 0.2484 0.7484 0.0129 0.974 0.0
O3 O-2 0 0 0.3662 0.916 0.0
Ba1 Ba+2 0 0.5 0.1095 1.017 0.0
O2 O-2 0 0 0.122 0.928 0.0
In2 In+2 0 0 0.2444 1.001 0.0
Ba2 Ba+2 0 0.5 0.3827 0.967 0.0
