#------------------------------------------------------------------------------
#$Date: 2024-05-02 11:48:35 +0100 (Thu, 02 May 2024) $
#$Revision: 291455 $
#$URL: svn://www.crystallography.net/cod/cif/9/00/76/9007686.cif $
#------------------------------------------------------------------------------
#
# This file is available in the Crystallography Open Database (COD),
# http://www.crystallography.net/. The original data for this entry
# were provided the American Mineralogist Crystal Structure Database,
# http://rruff.geo.arizona.edu/AMS/amcsd.php
#
# 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_9007686
loop_
_publ_author_name
'Radaev, S. F.'
'Simonov, V. I.'
'Kargin, Y. F.'
_publ_section_title
;Structural features of gamma-phase Bi2O3 and its place in the sillenite
 family
;
_journal_issue                   5
_journal_name_full               'Acta Crystallographica, Section B'
_journal_page_first              604
_journal_page_last               609
_journal_paper_doi               10.1107/S0108768192003847
_journal_volume                  48
_journal_year                    1992
_amcsd_formula_title             Bi2O3
_chemical_formula_structural     Bi2O3
_chemical_formula_sum            'Bi2 O3'
_space_group_IT_number           197
_symmetry_space_group_name_Hall  'I 2 2 3'
_symmetry_space_group_name_H-M   'I 2 3'
_cell_angle_alpha                90
_cell_angle_beta                 90
_cell_angle_gamma                90
_cell_length_a                   10.2501
_cell_length_b                   10.2501
_cell_length_c                   10.2501
_cell_formula_units_Z            13
_cell_volume                     1076.922
_exptl_crystal_density_diffrn    9.196
_database_code_amcsd             0009859
_cod_database_code               9007686
loop_
_symmetry_equiv_pos_as_xyz
x,y,z
1/2+x,1/2+y,1/2+z
-z,-x,y
1/2-z,1/2-x,1/2+y
-z,x,-y
1/2-z,1/2+x,1/2-y
z,-x,-y
1/2+z,1/2-x,1/2-y
z,x,y
1/2+z,1/2+x,1/2+y
y,-z,-x
1/2+y,1/2-z,1/2-x
-y,-z,x
1/2-y,1/2-z,1/2+x
-y,z,-x
1/2-y,1/2+z,1/2-x
y,z,x
1/2+y,1/2+z,1/2+x
-x,y,-z
1/2-x,1/2+y,1/2-z
x,-y,-z
1/2+x,1/2-y,1/2-z
-x,-y,z
1/2-x,1/2-y,1/2+z
loop_
_atom_site_label
_atom_site_fract_x
_atom_site_fract_y
_atom_site_fract_z
_atom_site_occupancy
_atom_site_U_iso_or_equiv
Bi 0.17600 0.32030 0.00960 1.00000 0.02026
BiM 0.00000 0.00000 0.00000 0.80000 0.01013
O1 0.13650 0.24760 0.50380 1.00000 0.01520
O2 0.18740 0.18740 0.18740 1.00000 0.03293
O3 0.88850 0.88850 0.88850 0.80000 0.03420
loop_
_cod_related_entry_id
_cod_related_entry_database
_cod_related_entry_code
1 ChemSpider 141426
2 AMCSD 0009859
_cod_duplicate_entry 2100844