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#$Date: 2016-02-13 21:28:24 +0200 (Sat, 13 Feb 2016) $
#$Revision: 176429 $
#$URL: svn://www.crystallography.net/cod/cif/1/54/14/1541400.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_1541400
loop_
_publ_author_name
'Fergusson, J.E.'
'Greenaway, A.M.'
'Penfold, B.R.'
_publ_section_title
;
 Preparative and Structural Studies of Pentahalogeno-Oxometallate(V) Salts
 of the Transition Metals Cr, Mo, W, Tc, Re
;
_journal_name_full               'Inorganica Chimica Acta'
_journal_page_first              29
_journal_page_last               34
_journal_volume                  71
_journal_year                    1983
_chemical_formula_sum            'Br5 Cs2 Mo O'
_chemical_name_systematic        'Cs2 (Mo O Br5)'
_space_group_IT_number           225
_symmetry_space_group_name_Hall  '-F 4 2 3'
_symmetry_space_group_name_H-M   'F m -3 m'
_cell_angle_alpha                90
_cell_angle_beta                 90
_cell_angle_gamma                90
_cell_formula_units_Z            4
_cell_length_a                   10.654
_cell_length_b                   10.654
_cell_length_c                   10.654
_cell_volume                     1209.311
_citation_journal_id_ASTM        ICHAA3
_cod_data_source_file            Fergusson_ICHAA3_1983_1876.cif
_cod_data_source_block           Br5Cs2Mo1O1
_cod_original_formula_sum        'Br5 Cs2 Mo1 O1'
_cod_database_code               1541400
loop_
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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 0.2339 0 0 0.8333 0.0
Mo1 Mo+5 0 0 0 1 0.0
Cs1 Cs+1 0.25 0.25 0.25 1 0.0
O1 O-2 0.1539 0 0 0.1667 0.0
