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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/2/10/65/2106546.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_2106546
loop_
_publ_author_name
'Lazarini, F.'
'Leban, I.'
_publ_section_title
;
 Octaaquastrontium(II) Decabromodibismuthate(III)
;
_journal_name_full               'Acta Crystallographica B (24,1968-38,1982)'
_journal_page_first              2745
_journal_page_last               2747
_journal_volume                  36
_journal_year                    1980
_chemical_formula_sum            'Bi2 Br10 H32 O16 Sr2'
_chemical_name_systematic        '(Sr (H2 O)8)2 (Bi2 Br10)'
_space_group_IT_number           55
_symmetry_space_group_name_Hall  '-P 2 2ab'
_symmetry_space_group_name_H-M   'P b a m'
_cell_angle_alpha                90
_cell_angle_beta                 90
_cell_angle_gamma                90
_cell_formula_units_Z            2
_cell_length_a                   15.727
_cell_length_b                   12.328
_cell_length_c                   9.521
_cell_volume                     1845.955
_citation_journal_id_ASTM        ACBCAR
_cod_data_source_file            Lazarini_ACBCAR_1980_59.cif
_cod_data_source_block           H32Bi2Br10O16Sr2
_cod_original_formula_sum        'H32 Bi2 Br10 O16 Sr2'
_cod_database_code               2106546
loop_
_symmetry_equiv_pos_as_xyz
x,y,z
-x,-y,z
x+1/2,-y+1/2,-z
-x+1/2,y+1/2,-z
-x,-y,-z
x,y,-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
Br2 Br-1 0.0092 0.3223 0.2979 1 0.0
O5 O-2 0.227 0.651 0.306 1 0.0
O3 O-2 0.126 0.506 0.5 1 0.0
O2 O-2 0.369 0.328 0.5 1 0.0
Bi1 Bi+3 0.0105 0.3186 0 1 0.0
O1 O-2 0.416 0.553 0.333 1 0.0
Sr1 Sr+2 0.2932 0.5172 0.5 1 0.0
Br4 Br-1 -0.1001 0.1482 0 1 0.0
Br3 Br-1 0.1501 0.1884 0 1 0.0
Br1 Br-1 0.1311 0.5126 0 1 0.0
O4 O-2 0.254 0.397 0.276 1 0.0
