#------------------------------------------------------------------------------
#$Date: 2015-07-14 02:56:45 +0300 (Tue, 14 Jul 2015) $
#$Revision: 151843 $
#$URL: svn://www.crystallography.net/cod/cif/1/52/89/1528961.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_1528961
loop_
_publ_author_name
'Vincent, H.'
'Bochu, B.'
'Aubert, J.J.'
'Joubert, J.C.'
'Marezio, M.'
_publ_section_title
;
 Structure cristalline de Cu Ta2 O6
;
_journal_name_full               'Journal of Solid State Chemistry'
_journal_page_first              245
_journal_page_last               253
_journal_volume                  24
_journal_year                    1978
_chemical_formula_sum            'Cu1.03 O6 Ta2'
_chemical_name_systematic        'Cu1.03 Ta2 O6'
_space_group_IT_number           47
_symmetry_space_group_name_Hall  '-P 2 2'
_symmetry_space_group_name_H-M   'P m m m'
_cell_angle_alpha                90
_cell_angle_beta                 90
_cell_angle_gamma                90
_cell_formula_units_Z            4
_cell_length_a                   7.5228
_cell_length_b                   7.5248
_cell_length_c                   7.5199
_cell_volume                     425.683
_citation_journal_id_ASTM        JSSCBI
_cod_data_source_file            Vincent_JSSCBI_1978_143.cif
_cod_data_source_block           Cu1.03O6Ta2
_cod_original_cell_volume        425.6832
_cod_database_code               1528961
loop_
_symmetry_equiv_pos_as_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
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
Cu3 Cu+2 0 0 0.5 1 0.0
O2 O-2 0.186 0 0.305 1 0.0
Cu6 Cu+2 0 0.5 0.5 0.37 0.0
O4 O-2 0.5 0.191 0.312 1 0.0
Cu4 Cu+2 0.5 0.5 0 0.36 0.0
Ta1 Ta+5 0.25232 0.25222 0.25158 1 0.0
O1 O-2 0 0.304 0.187 1 0.0
O3 O-2 0.305 0.188 0 1 0.0
Cu5 Cu+2 0.5 0 0.5 0.39 0.0
Cu2 Cu+2 0 0.5 0 1 0.0
O6 O-2 0.191 0.31 0.5 1 0.0
O5 O-2 0.312 0.5 0.192 1 0.0
Cu1 Cu+2 0.5 0 0 1 0.0
