#------------------------------------------------------------------------------
#$Date: 2016-02-16 17:55:33 +0100 (mar 16 de feb de 2016) $
#$Revision: 176466 $
#$URL: svn://www.crystallography.net/cod/cif/8/10/34/8103426.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_8103426
loop_
_publ_author_name
'Klepp, K. O.'
'Weithaler, C.'
_publ_section_title
;
Crystal structure of kalium pentathioaurate(I), KAuS₅
;
_journal_issue                   1
_journal_name_full
'Zeitschrift für Kristallographie - New Crystal Structures'
_journal_page_first              18
_journal_page_last               18
_journal_volume                  213
_journal_year                    1998
_chemical_formula_sum            'Au K S5'
_chemical_name_systematic        'K (Au S5)'
_space_group_IT_number           72
_symmetry_space_group_name_Hall  '-I 2 2c'
_symmetry_space_group_name_H-M   'I b a m'
_cell_angle_alpha                90
_cell_angle_beta                 90
_cell_angle_gamma                90
_cell_formula_units_Z            8
_cell_length_a                   8.293
_cell_length_b                   10.746
_cell_length_c                   15.449
_cell_volume                     1376.762
_citation_journal_id_ASTM        ZKNSFT
_cod_data_source_file            gold_262.cif
_cod_data_source_block           Au1K1S5
_cod_original_formula_sum        'Au1 K1 S5'
_cod_database_code               8103426
loop_
_symmetry_equiv_pos_as_xyz
x,y,z
-x,-y,z
x,-y,-z+1/2
-x,y,-z+1/2
-x,-y,-z
x,y,-z
-x,y,z-1/2
x,-y,z-1/2
x+1/2,y+1/2,z+1/2
-x+1/2,-y+1/2,z+1/2
x+1/2,-y+1/2,-z+1
-x+1/2,y+1/2,-z+1
-x+1/2,-y+1/2,-z+1/2
x+1/2,y+1/2,-z+1/2
-x+1/2,y+1/2,z
x+1/2,-y+1/2,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
S3 S 0.2051 0.1763 0.393 1 0.0
K2 K+1 0 0.5 0.5 1 0.0
K1 K+1 0 0 0.25 1 0.0
Au1 Au+1 0 0.36212 0.25 1 0.0
S1 S 0.2021 0.36 0.3521 1 0.0
S2 S 0.0567 0.1629 0.5 1 0.0
