#------------------------------------------------------------------------------
#$Date: 2018-09-27 07:13:35 +0300 (Thu, 27 Sep 2018) $
#$Revision: 211196 $
#$URL: file:///home/coder/svn-repositories/cod/cif/8/10/42/8104272.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_8104272
loop_
_publ_author_name
'Singh, A.K.'
'Swaminathan, S.'
_publ_section_title
;
 Refinement of the crystal structure of arsenic tribromide
;
_journal_name_full
;
Zeitschrift fuer Kristallographie, Kristallgeometrie, Kristallphysik, 
Kristallchemie (-144,1977)
;
_journal_page_first              375
_journal_page_last               377
_journal_volume                  124
_journal_year                    1967
_chemical_formula_sum            'As Br3'
_space_group_IT_number           19
_symmetry_space_group_name_Hall  'P 2ac 2ab'
_symmetry_space_group_name_H-M   'P 21 21 21'
_cell_angle_alpha                90
_cell_angle_beta                 90
_cell_angle_gamma                90
_cell_formula_units_Z            4
_cell_length_a                   10.244
_cell_length_b                   12.148
_cell_length_c                   4.34
_cell_volume                     540.087
_citation_journal_id_ASTM        ZEKGAX
_cod_data_source_file            Singh_ZEKGAX_1967_368.cif
_cod_data_source_block           As1Br3
_cod_original_cell_volume        540.0875
_cod_original_formula_sum        'As1 Br3'
_cod_database_code               8104272
loop_
_symmetry_equiv_pos_as_xyz
x,y,z
-x+1/2,-y,z+1/2
x+1/2,-y+1/2,-z
-x,y+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
Br3 Br-1 0.4831 0.1318 -0.2611 1 0.0
As1 As+3 0.3047 0.2129 0.0085 1 0.0
Br2 Br-1 0.1387 0.1198 -0.2604 1 0.0
Br1 Br-1 0.3022 0.3799 -0.2643 1 0.0
