#------------------------------------------------------------------------------
#$Date: 2016-11-02 08:01:08 +0200 (Wed, 02 Nov 2016) $
#$Revision: 187760 $
#$URL: file:///home/coder/svn-repositories/cod/cif/1/54/44/1544447.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_1544447
loop_
_publ_author_name
'Kato, S.'
'Abe, T.'
'Sugai, M.'
'Takizawa, H.'
'Endo, T.'
_publ_section_title
;
 Synthesis and lattice distortion of the perovskite-type oxides
 Sr2(Sr1-xMx)TaOz (M=Ca,Nd)
;
_journal_name_full               'Journal of the Ceramic Society of Japan'
_journal_page_first              633
_journal_page_last               638
_journal_volume                  107
_journal_year                    1999
_chemical_formula_sum            'Ca O5.5 Sr2 Ta'
_chemical_name_common            Sr2CaTaO5.5
_space_group_IT_number           225
_space_group_name_H-M_alt        'F m -3 m'
_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                   8.2408(2)
_cell_length_b                   8.2408(2)
_cell_length_c                   8.2408(2)
_cell_volume                     559.64(2)
_cod_data_source_file            Sr2CaTaO5.5.cif
_cod_data_source_block           Sr2CaTaO5.5
_cod_original_formula_sum        'Sr2 Ca Ta O5.5'
_cod_database_code               1544447
loop_
_space_group_symop_operation_xyz
'x, y, z'
'-x, -y, -z'
'-x, -y, z'
'x, y, -z'
'-x, y, -z'
'x, -y, z'
'x, -y, -z'
'-x, y, z'
'z, x, y'
'-z, -x, -y'
'z, -x, -y'
'-z, x, y'
'-z, -x, y'
'z, x, -y'
'-z, x, -y'
'z, -x, y'
'y, z, x'
'-y, -z, -x'
'-y, z, -x'
'y, -z, x'
'y, -z, -x'
'-y, z, x'
'-y, -z, x'
'y, z, -x'
'y, x, -z'
'-y, -x, z'
'-y, -x, -z'
'y, x, z'
'y, -x, z'
'-y, x, -z'
'-y, x, z'
'y, -x, -z'
'x, z, -y'
'-x, -z, y'
'-x, z, y'
'x, -z, -y'
'-x, -z, -y'
'x, z, y'
'x, -z, y'
'-x, z, -y'
'z, y, -x'
'-z, -y, x'
'z, -y, x'
'-z, y, -x'
'-z, y, x'
'z, -y, -x'
'-z, -y, -x'
'z, y, x'
'x, y+1/2, z+1/2'
'-x, -y+1/2, -z+1/2'
'-x, -y+1/2, z+1/2'
'x, y+1/2, -z+1/2'
'-x, y+1/2, -z+1/2'
'x, -y+1/2, z+1/2'
'x, -y+1/2, -z+1/2'
'-x, y+1/2, z+1/2'
'z, x+1/2, y+1/2'
'-z, -x+1/2, -y+1/2'
'z, -x+1/2, -y+1/2'
'-z, x+1/2, y+1/2'
'-z, -x+1/2, y+1/2'
'z, x+1/2, -y+1/2'
'-z, x+1/2, -y+1/2'
'z, -x+1/2, y+1/2'
'y, z+1/2, x+1/2'
'-y, -z+1/2, -x+1/2'
'-y, z+1/2, -x+1/2'
'y, -z+1/2, x+1/2'
'y, -z+1/2, -x+1/2'
'-y, z+1/2, x+1/2'
'-y, -z+1/2, x+1/2'
'y, z+1/2, -x+1/2'
'y, x+1/2, -z+1/2'
'-y, -x+1/2, z+1/2'
'-y, -x+1/2, -z+1/2'
'y, x+1/2, z+1/2'
'y, -x+1/2, z+1/2'
'-y, x+1/2, -z+1/2'
'-y, x+1/2, z+1/2'
'y, -x+1/2, -z+1/2'
'x, z+1/2, -y+1/2'
'-x, -z+1/2, y+1/2'
'-x, z+1/2, y+1/2'
'x, -z+1/2, -y+1/2'
'-x, -z+1/2, -y+1/2'
'x, z+1/2, y+1/2'
'x, -z+1/2, y+1/2'
'-x, z+1/2, -y+1/2'
'z, y+1/2, -x+1/2'
'-z, -y+1/2, x+1/2'
'z, -y+1/2, x+1/2'
'-z, y+1/2, -x+1/2'
'-z, y+1/2, x+1/2'
'z, -y+1/2, -x+1/2'
'-z, -y+1/2, -x+1/2'
'z, y+1/2, x+1/2'
'x+1/2, y, z+1/2'
'-x+1/2, -y, -z+1/2'
'-x+1/2, -y, z+1/2'
'x+1/2, y, -z+1/2'
'-x+1/2, y, -z+1/2'
'x+1/2, -y, z+1/2'
'x+1/2, -y, -z+1/2'
'-x+1/2, y, z+1/2'
'z+1/2, x, y+1/2'
'-z+1/2, -x, -y+1/2'
'z+1/2, -x, -y+1/2'
'-z+1/2, x, y+1/2'
'-z+1/2, -x, y+1/2'
'z+1/2, x, -y+1/2'
'-z+1/2, x, -y+1/2'
'z+1/2, -x, y+1/2'
'y+1/2, z, x+1/2'
'-y+1/2, -z, -x+1/2'
'-y+1/2, z, -x+1/2'
'y+1/2, -z, x+1/2'
'y+1/2, -z, -x+1/2'
'-y+1/2, z, x+1/2'
'-y+1/2, -z, x+1/2'
'y+1/2, z, -x+1/2'
'y+1/2, x, -z+1/2'
'-y+1/2, -x, z+1/2'
'-y+1/2, -x, -z+1/2'
'y+1/2, x, z+1/2'
'y+1/2, -x, z+1/2'
'-y+1/2, x, -z+1/2'
'-y+1/2, x, z+1/2'
'y+1/2, -x, -z+1/2'
'x+1/2, z, -y+1/2'
'-x+1/2, -z, y+1/2'
'-x+1/2, z, y+1/2'
'x+1/2, -z, -y+1/2'
'-x+1/2, -z, -y+1/2'
'x+1/2, z, y+1/2'
'x+1/2, -z, y+1/2'
'-x+1/2, z, -y+1/2'
'z+1/2, y, -x+1/2'
'-z+1/2, -y, x+1/2'
'z+1/2, -y, x+1/2'
'-z+1/2, y, -x+1/2'
'-z+1/2, y, x+1/2'
'z+1/2, -y, -x+1/2'
'-z+1/2, -y, -x+1/2'
'z+1/2, y, x+1/2'
'x+1/2, y+1/2, z'
'-x+1/2, -y+1/2, -z'
'-x+1/2, -y+1/2, z'
'x+1/2, y+1/2, -z'
'-x+1/2, y+1/2, -z'
'x+1/2, -y+1/2, z'
'x+1/2, -y+1/2, -z'
'-x+1/2, y+1/2, z'
'z+1/2, x+1/2, y'
'-z+1/2, -x+1/2, -y'
'z+1/2, -x+1/2, -y'
'-z+1/2, x+1/2, y'
'-z+1/2, -x+1/2, y'
'z+1/2, x+1/2, -y'
'-z+1/2, x+1/2, -y'
'z+1/2, -x+1/2, y'
'y+1/2, z+1/2, x'
'-y+1/2, -z+1/2, -x'
'-y+1/2, z+1/2, -x'
'y+1/2, -z+1/2, x'
'y+1/2, -z+1/2, -x'
'-y+1/2, z+1/2, x'
'-y+1/2, -z+1/2, x'
'y+1/2, z+1/2, -x'
'y+1/2, x+1/2, -z'
'-y+1/2, -x+1/2, z'
'-y+1/2, -x+1/2, -z'
'y+1/2, x+1/2, z'
'y+1/2, -x+1/2, z'
'-y+1/2, x+1/2, -z'
'-y+1/2, x+1/2, z'
'y+1/2, -x+1/2, -z'
'x+1/2, z+1/2, -y'
'-x+1/2, -z+1/2, y'
'-x+1/2, z+1/2, y'
'x+1/2, -z+1/2, -y'
'-x+1/2, -z+1/2, -y'
'x+1/2, z+1/2, y'
'x+1/2, -z+1/2, y'
'-x+1/2, z+1/2, -y'
'z+1/2, y+1/2, -x'
'-z+1/2, -y+1/2, x'
'z+1/2, -y+1/2, x'
'-z+1/2, y+1/2, -x'
'-z+1/2, y+1/2, x'
'z+1/2, -y+1/2, -x'
'-z+1/2, -y+1/2, -x'
'z+1/2, y+1/2, x'
loop_
_atom_site_label
_atom_site_occupancy
_atom_site_fract_x
_atom_site_fract_y
_atom_site_fract_z
_atom_site_adp_type
_atom_site_B_iso_or_equiv
_atom_site_type_symbol
Sr1 1.0 0.250000 0.250000 0.250000 Biso 1.000000 Sr
CaTa1 0.8500 0.500000 0.500000 0.500000 Biso 1.000000 Ta
CaTa2 0.8500 0.000000 0.000000 0.000000 Biso 1.000000 Ca
O 0.9160 0.239(8) 0.000000 0.000000 Biso 1.000000 O
CaTa1 0.1500 0.500000 0.500000 0.500000 Biso 1.000000 Ca
CaTa2 0.1500 0.000000 0.000000 0.000000 Biso 1.000000 Ta
