#------------------------------------------------------------------------------
#$Date: 2018-09-27 06:13:35 +0200 (Thu, 27 Sep 2018) $
#$Revision: 211196 $
#$URL: svn://saulius.grazulis.lt/cod-secondary/cif/1/52/82/1528272.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_1528272
loop_
_publ_author_name
'von Benda, H.'
'Simon, A.'
'Bauhofer, W.'
_publ_section_title
;
 Zur Kenntnis von Bi Br und Bi Br1.167
;
_journal_name_full
'Zeitschrift fuer Anorganische und Allgemeine Chemie'
_journal_page_first              53
_journal_page_last               67
_journal_volume                  438
_journal_year                    1978
_chemical_formula_sum            'Bi Br'
_space_group_IT_number           12
_symmetry_space_group_name_Hall  '-C 2y'
_symmetry_space_group_name_H-M   'C 1 2/m 1'
_cell_angle_alpha                90
_cell_angle_beta                 107.42
_cell_angle_gamma                90
_cell_formula_units_Z            16
_cell_length_a                   13.064
_cell_length_b                   4.338
_cell_length_c                   20.061
_cell_volume                     1084.747
_citation_journal_id_ASTM        ZAACAB
_cod_data_source_file            vonBenda_ZAACAB_1978_1560.cif
_cod_data_source_block           Bi1Br1
_cod_original_formula_sum        'Bi1 Br1'
_cod_database_code               1528272
loop_
_symmetry_equiv_pos_as_xyz
x,y,z
-x,y,-z
-x,-y,-z
x,-y,z
x+1/2,y+1/2,z
-x+1/2,y+1/2,-z
-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
Bi3 Bi+1 0.06638 0 0.34993 1 0.0
Bi1 Bi+1 0.16753 0 0.99508 1 0.0
Br3 Br-1 0.45494 0 0.88955 1 0.0
Br1 Br-1 0.31168 0 0.68977 1 0.0
Bi2 Bi+1 0.17343 0 0.50701 1 0.0
Bi4 Bi+1 0.20488 0 0.15221 1 0.0
Br4 Br-1 0.43691 0 0.38356 1 0.0
Br2 Br-1 0.13559 0 0.8136 1 0.0
