#------------------------------------------------------------------------------
#$Date: 2016-02-13 20:28:24 +0100 (Sat, 13 Feb 2016) $
#$Revision: 176429 $
#$URL: svn://saulius.grazulis.lt/cod-secondary/cif/1/54/10/1541011.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_1541011
loop_
_publ_author_name
'Stoll, H.'
'Brazel, B.'
'Hoppe, R.'
_publ_section_title
;
 Neue Oxoplumbate(II) mit Inselstruktur: Rb4 (Pb O3) und Cs4 (Pb O3)
;
_journal_name_full
'Zeitschrift fuer Anorganische und Allgemeine Chemie'
_journal_page_first              45
_journal_page_last               60
_journal_volume                  564
_journal_year                    1988
_chemical_formula_sum            'O3 Pb Rb4'
_chemical_name_systematic        'Rb4 Pb O3'
_space_group_IT_number           61
_symmetry_space_group_name_Hall  '-P 2ac 2ab'
_symmetry_space_group_name_H-M   'P b c a'
_cell_angle_alpha                90
_cell_angle_beta                 90
_cell_angle_gamma                90
_cell_formula_units_Z            8
_cell_length_a                   6.812
_cell_length_b                   11.7871
_cell_length_c                   19.7991
_cell_volume                     1589.743
_citation_journal_id_ASTM        ZAACAB
_cod_data_source_file            Stoll_ZAACAB_1988_14.cif
_cod_data_source_block           O3Pb1Rb4
_cod_original_cell_volume        1589.744
_cod_original_formula_sum        'O3 Pb1 Rb4'
_cod_database_code               1541011
loop_
_symmetry_equiv_pos_as_xyz
x,y,z
-x+1/2,-y,z+1/2
x+1/2,-y+1/2,-z
-x,y+1/2,-z+1/2
-x,-y,-z
x-1/2,y,-z-1/2
-x-1/2,y-1/2,z
x,-y-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
Rb4 Rb+1 0.4656 0.3816 0.2983 1 0.0
O1 O-2 0.3739 0.4792 0.6001 1 0.0
Rb3 Rb+1 0.2748 0.1896 0.5559 1 0.0
Rb1 Rb+1 0.1272 0.1726 0.3437 1 0.0
Pb1 Pb+2 0.1103 0.0681 0.1519 1 0.0
Rb2 Rb+1 0.2561 0.0582 0.9632 1 0.0
O3 O-2 0.4536 0.3482 0.9296 1 0.0
O2 O-2 0.0378 0.4035 0.3422 1 0.0
