#------------------------------------------------------------------------------
#$Date: 2015-07-13 04:28:31 +0200 (lun 13 de jul de 2015) $
#$Revision: 149434 $
#$URL: svn://www.crystallography.net/cod/cif/2/10/63/2106376.cif $
#------------------------------------------------------------------------------
#
# This file is available in the Crystallography Open Database (COD),
# http://www.crystallography.net/. The original data for this entry
# were provided by IUCr Journals, http://journals.iucr.org/.
#
# The file may be used within the scientific community so long as
# proper attribution is given to the journal article from which the
# data were obtained.
#
data_2106376
loop_
_publ_author_name
'Lazarini, F.'
_publ_section_title
;
 Cesium enneabromodibismuthate(III)
;
_journal_name_full               'Acta Crystallographica B (24,1968-38,1982)'
_journal_page_first              2961
_journal_page_last               2964
_journal_volume                  33
_journal_year                    1977
_chemical_formula_sum            'Bi2 Br9 Cs3'
_chemical_name_systematic        'Cs3 (Bi2 Br9)'
_space_group_IT_number           164
_symmetry_space_group_name_Hall  '-P 3 2"'
_symmetry_space_group_name_H-M   'P -3 m 1'
_cell_angle_alpha                90
_cell_angle_beta                 90
_cell_angle_gamma                120
_cell_formula_units_Z            1
_cell_length_a                   7.972
_cell_length_b                   7.972
_cell_length_c                   9.867
_cell_volume                     543.063
_citation_journal_id_ASTM        ACBCAR
_cod_data_source_file            Lazarini_ACBCAR_1977_615.cif
_cod_data_source_block           Bi2Br9Cs3
_cod_original_cell_volume        543.0632
_cod_database_code               2106376
loop_
_symmetry_equiv_pos_as_xyz
x,y,z
-y,x-y,z
-x+y,-x,z
y,x,-z
-x,-x+y,-z
x-y,-y,-z
-x,-y,-z
y,-x+y,-z
x-y,x,-z
-y,-x,z
x,x-y,z
-x+y,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
Br1 Br-1 0.5 0.5 0 1 0.0
Br2 Br-1 0.3352 0.1676 0.3394 1 0.0
Cs2 Cs+1 0.6667 0.3333 0.6669 1 0.0
Bi1 Bi+3 0.6667 0.3333 0.1918 1 0.0
Cs1 Cs+1 0 0 0 1 0.0
