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#$Date: 2018-09-27 07:13:35 +0300 (Thu, 27 Sep 2018) $
#$Revision: 211196 $
#$URL: file:///home/coder/svn-repositories/cod/cif/1/53/56/1535698.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_1535698
loop_
_publ_author_name
'Troyanov, S.I.'
_publ_section_title
;
 Crystal structure of aluminium tribromide and triiodide
;
_journal_name_full               'Zhurnal Neorganicheskoi Khimii'
_journal_page_first              552
_journal_page_last               555
_journal_volume                  39
_journal_year                    1994
_chemical_formula_sum            'Al Br3'
_space_group_IT_number           14
_symmetry_space_group_name_Hall  '-P 2ybc'
_symmetry_space_group_name_H-M   'P 1 21/c 1'
_cell_angle_alpha                90
_cell_angle_beta                 96.39
_cell_angle_gamma                90
_cell_formula_units_Z            4
_cell_length_a                   7.503
_cell_length_b                   7.073
_cell_length_c                   10.273
_cell_volume                     541.788
_citation_journal_id_ASTM        ZNOKAQ
_cod_data_source_file            Troyanov_ZNOKAQ_1994_1399.cif
_cod_data_source_block           Al1Br3
_cod_original_formula_sum        'Al1 Br3'
_cod_database_code               1535698
loop_
_symmetry_equiv_pos_as_xyz
x,y,z
-x,y+1/2,-z+1/2
-x,-y,-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
Al1 Al+3 0.197 -0.092 0.551 1 0.0
Br1 Br-1 0.398 0.0848 0.6675 1 0.0
Br3 Br-1 -0.0806 -0.0673 0.6452 1 0.0
Br2 Br-1 0.2508 -0.391 0.511 1 0.0
