#------------------------------------------------------------------------------
#$Date: 2016-02-13 13:50:18 +0100 (Sat, 13 Feb 2016) $
#$Revision: 176428 $
#$URL: svn://saulius.grazulis.lt/cod-secondary/cif/1/52/86/1528674.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_1528674
loop_
_publ_author_name
'Larregola, S.A.'
'Alonso, J.A.'
'Pinacca, R.M.'
'Pedregosa, J.C.'
'Viola, M.C.'
_publ_section_title
;
 Order-disorder in In(3+) perovskites: the example of A (In2/3 B"(1/3)) O3
 (A = Ba, Sr; B" = W, U)
;
_journal_name_full               'Journal of Solid State Chemistry'
_journal_page_first              2808
_journal_page_last               2813
_journal_volume                  181
_journal_year                    2008
_chemical_formula_sum            'In1.333 O6 Sr2 U0.667'
_chemical_name_systematic        'Sr2 In (In0.333 U0.667) O6'
_space_group_IT_number           14
_symmetry_space_group_name_Hall  '-P 2yn'
_symmetry_space_group_name_H-M   'P 1 21/n 1'
_cell_angle_alpha                90
_cell_angle_beta                 90
_cell_angle_gamma                90
_cell_formula_units_Z            2
_cell_length_a                   5.861
_cell_length_b                   5.908
_cell_length_c                   8.315
_cell_volume                     287.922
_citation_journal_id_ASTM        JSSCBI
_cod_data_source_file            Larregola_JSSCBI_2008_1617.cif
_cod_data_source_block           In1.333O6Sr2U0.667
_cod_original_cell_volume        287.9217
_cod_original_sg_symbol_Hall     '-P 2ybc (x-z,y,z)'
_cod_database_code               1528674
loop_
_symmetry_equiv_pos_as_xyz
x,y,z
-x+1/2,y+1/2,-z+1/2
-x,-y,-z
x-1/2,-y-1/2,z-1/2
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 0.218 0.202 0.967 1 0.0
U2 U+6 0 0.5 0 0.65 0.0
In2 In+3 0 0.5 0 0.34 0.0
O3 O-2 0.426 0.988 0.261 1 0.0
U1 U+3 0.5 0 0 0.01 0.0
Sr1 Sr+2 0.511 0.532 0.25 1 0.0
O2 O-2 0.3 0.706 0.948 1 0.0
In1 In+3 0.5 0 0 0.99 0.0
