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#$Date: 2013-05-01 17:32:24 +0300 (Wed, 01 May 2013) $
#$Revision: 83840 $
#$URL: file:///home/coder/svn-repositories/cod/cif/1/51/06/1510609.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_1510609
loop_
_publ_author_name
'Janssen, E.M.W.'
'Wiegers, G.A.'
_publ_section_title
;
 Crystal growth and the crystal structures of two modifications of gold
 monobromide, I-AuBr and P-Au Br
;
_journal_name_full               'Journal of the Less-Common Metals'
_journal_page_first              47
_journal_page_last               57
_journal_volume                  57
_journal_year                    1978
_chemical_formula_sum            'Au Br'
_chemical_name_systematic        'Au Br'
_space_group_IT_number           141
_symmetry_space_group_name_Hall  '-I 4bd 2'
_symmetry_space_group_name_H-M   'I 41/a m d :2'
_cell_angle_alpha                90
_cell_angle_beta                 90
_cell_angle_gamma                90
_cell_formula_units_Z            8
_cell_length_a                   6.94
_cell_length_b                   6.94
_cell_length_c                   9.252
_cell_volume                     445.610
_citation_journal_id_ASTM        JCOMAH
_[local]_cod_data_source_file    gold_90.cif
_[local]_cod_data_source_block   Au1Br1
_[local]_cod_chemical_formula_sum_orig 'Au1 Br1'
_cod_original_cell_volume        445.6096
_cod_database_code               1510609
loop_
_symmetry_equiv_pos_as_xyz
x,y,z
-y+1/4,x+3/4,z+1/4
-x+1/2,-y,z+1/2
y+1/4,-x+1/4,z+3/4
x,-y,-z
y+1/4,x+3/4,-z+1/4
-x+1/2,y,-z+1/2
-y+1/4,-x+1/4,-z+3/4
-x,-y,-z
y-1/4,-x-3/4,-z-1/4
x-1/2,y,-z-1/2
-y-1/4,x-1/4,-z-3/4
-x,y,z
-y-1/4,-x-3/4,z-1/4
x-1/2,-y,z-1/2
y-1/4,x-1/4,z-3/4
x+1/2,y+1/2,z+1/2
-y+3/4,x+5/4,z+3/4
-x+1,-y+1/2,z+1
y+3/4,-x+3/4,z+5/4
x+1/2,-y+1/2,-z+1/2
y+3/4,x+5/4,-z+3/4
-x+1,y+1/2,-z+1
-y+3/4,-x+3/4,-z+5/4
-x+1/2,-y+1/2,-z+1/2
y+1/4,-x-1/4,-z+1/4
x,y+1/2,-z
-y+1/4,x+1/4,-z-1/4
-x+1/2,y+1/2,z+1/2
-y+1/4,-x-1/4,z+1/4
x,-y+1/2,z
y+1/4,x+1/4,z-1/4
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
Au1 Au+1 0 0 0 1 0.0
Br1 Br-1 0 0.25 0.18 1 0.0