#------------------------------------------------------------------------------
#$Date: 2016-02-18 16:37:37 +0100 (Thu 18 de Feb de 2016) $
#$Revision: 176729 $
#$URL: svn://www.crystallography.net/cod/cif/1/51/03/1510382.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_1510382
loop_
_publ_author_name
'Ahsbahs, H.'
'Matsushita, N.'
'Kojima, N.'
'Hafner, S.S.'
_publ_section_title
;
 Crystal structure of mixed valence gold compound, Cs2 Au(I) Au(III) Cl6
 up to 18 GPa
;
_journal_name_full               'Rev. High Pressure Sci. Technol.'
_journal_page_first              329
_journal_page_last               331
_journal_paper_doi               10.4131/jshpreview.7.329
_journal_volume                  7
_journal_year                    1998
_chemical_formula_sum            'Au2 Cl6 Cs2'
_chemical_name_systematic        'Cs2 Au2 Cl6'
_space_group_IT_number           139
_symmetry_space_group_name_Hall  '-I 4 2'
_symmetry_space_group_name_H-M   'I 4/m m m'
_cell_angle_alpha                90
_cell_angle_beta                 90
_cell_angle_gamma                90
_cell_formula_units_Z            2
_cell_length_a                   6.9359
_cell_length_b                   6.9359
_cell_length_c                   10.0877
_cell_volume                     485.286
_citation_journal_id_ASTM        KKGIE2
_cod_data_source_file            gold_466.cif
_cod_data_source_block           Au2Cl6Cs2
_cod_original_cell_volume        485.2861
_cod_database_code               1510382
loop_
_symmetry_equiv_pos_as_xyz
x,y,z
-y,x,z
-x,-y,z
y,-x,z
x,-y,-z
y,x,-z
-x,y,-z
-y,-x,-z
-x,-y,-z
y,-x,-z
x,y,-z
-y,x,-z
-x,y,z
-y,-x,z
x,-y,z
y,x,z
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+1/2
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+1/2
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+1/2
-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
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
Au2 Au+1 0.5 0.5 0 1 0.0
Au1 Au+3 0 0 0 1 0.0
Cs1 Cs+1 0 0.5 0.25 1 0.0
Cl1 Cl-1 0.2351 0.2351 0 1 0.0
Cl2 Cl-1 0.5 0.5 0.2282 1 0.0
