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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/1/52/64/1526499.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_1526499
loop_
_publ_author_name
'Schmidt, M.'
'Henn, R.W.'
'Oppermann, H.'
'Binnewies, M.'
'Hennig, C.'
'Gmelin, E.'
'Soeger, N.'
_publ_section_title
;
 Untersuchungen zu Bismutseltenerdoxidhalogeniden der Zusammensetzung Bi2
 SE O4 X (X=Cl,Br,I)
;
_journal_name_full
'Zeitschrift fuer Anorganische und Allgemeine Chemie'
_journal_page_first              125
_journal_page_last               135
_journal_volume                  626
_journal_year                    2000
_chemical_formula_sum            'Bi2 Cl O4 Y'
_chemical_name_systematic        'Bi2 Y O4 Cl'
_space_group_IT_number           123
_symmetry_space_group_name_Hall  '-P 4 2'
_symmetry_space_group_name_H-M   'P 4/m m m'
_cell_angle_alpha                90
_cell_angle_beta                 90
_cell_angle_gamma                90
_cell_formula_units_Z            1
_cell_length_a                   3.8493
_cell_length_b                   3.8493
_cell_length_c                   8.885
_cell_volume                     131.650
_citation_journal_id_ASTM        ZAACAB
_cod_data_source_file            Schmidt_ZAACAB_2000_698.cif
_cod_data_source_block           Bi2Cl1O4Y1
_cod_original_cell_volume        131.65
_cod_original_formula_sum        'Bi2 Cl1 O4 Y1'
_cod_database_code               1526499
loop_
_symmetry_equiv_pos_as_xyz
x,y,z
-y,x,z
-x,-y,z
y,-x,z
x,-y,-z
y,x,-z
-x,y,-z
-y,-x,-z
-x,-y,-z
y,-x,-z
x,y,-z
-y,x,-z
-x,y,z
-y,-x,z
x,-y,z
y,x,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
O1 O-2 0.5 0 0.846 1 0.0
Y1 Y+3 0 0 0 1 0.0
Cl1 Cl-1 0 0 0.5 1 0.0
Bi1 Bi+3 0.5 0.5 0.7193 1 0.0
