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#$Date: 2015-09-17 03:29:44 +0200 (jue 17 de sep de 2015) $
#$Revision: 156672 $
#$URL: svn://www.crystallography.net/cod/cif/1/53/12/1531284.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_1531284
loop_
_publ_author_name
'Charkin, D.O.'
'Dytyatev, O.A.'
'Lightfoot, P.'
'Dolgikh, V.A.'
_publ_section_title
;
 A novel family of layered bismuth compounds II: the crystal structures of
 Pb0.6 Bi1.4 Rb0.6 O2 Z2, Z = Cl, Br and I
;
_journal_name_full               'Journal of Solid State Chemistry'
_journal_page_first              83
_journal_page_last               90
_journal_volume                  173
_journal_year                    2003
_chemical_formula_sum            'Bi1.4 I2 O2 Pb0.6 Rb0.6'
_chemical_name_systematic        '(Pb0.6 Bi1.4) Rb0.6 O2 I2'
_space_group_IT_number           139
_symmetry_space_group_name_Hall  '-I 4 2'
_symmetry_space_group_name_H-M   'I 4/m m m'
_cell_angle_alpha                90
_cell_angle_beta                 90
_cell_angle_gamma                90
_cell_formula_units_Z            2
_cell_length_a                   4.0386
_cell_length_b                   4.0386
_cell_length_c                   22.3213
_cell_volume                     364.067
_citation_journal_id_ASTM        JSSCBI
_cod_data_source_file            Charkin_JSSCBI_2003_1619.cif
_cod_data_source_block           Bi1.4I2O2Pb0.6Rb0.6
_cod_original_cell_volume        364.0669
_cod_database_code               1531284
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
x+1/2,y+1/2,z+1/2
-y+1/2,x+1/2,z+1/2
-x+1/2,-y+1/2,z+1/2
y+1/2,-x+1/2,z+1/2
x+1/2,-y+1/2,-z+1/2
y+1/2,x+1/2,-z+1/2
-x+1/2,y+1/2,-z+1/2
-y+1/2,-x+1/2,-z+1/2
-x+1/2,-y+1/2,-z+1/2
y+1/2,-x+1/2,-z+1/2
x+1/2,y+1/2,-z+1/2
-y+1/2,x+1/2,-z+1/2
-x+1/2,y+1/2,z+1/2
-y+1/2,-x+1/2,z+1/2
x+1/2,-y+1/2,z+1/2
y+1/2,x+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
Bi1 Bi+3 0 0 0.1962 0.7 0.0
Rb1 Rb+1 0 0 0 0.6 0.0
O1 O-2 0.5 0 0.25 1 0.0
Pb1 Pb+2 0 0 0.1962 0.3 0.0
I1 I-1 0.5 0.5 0.1074 1 0.0
