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#$Date: 2015-10-10 01:58:08 +0200 (Sat 10 de Oct de 2015) $
#$Revision: 163949 $
#$URL: svn://www.crystallography.net/cod/cif/1/53/62/1536288.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_1536288
loop_
_publ_author_name
'Deiseroth, H.J.'
'Simon, A.'
_publ_section_title
;
 Die gegenseitige Substitution von Rubidium und Caesium in
 Alkalimetallsuboxiden
;
_journal_name_full               'Revue de Chimie Minerale'
_journal_page_first              475
_journal_page_last               487
_journal_volume                  20
_journal_year                    1983
_chemical_formula_sum            'Cs8.37 O3 Rb2.59'
_chemical_name_systematic        'Rb2.59 Cs8.37 O3'
_space_group_IT_number           14
_symmetry_space_group_name_Hall  '-P 2ybc'
_symmetry_space_group_name_H-M   'P 1 21/c 1'
_cell_angle_alpha                90
_cell_angle_beta                 100.5
_cell_angle_gamma                90
_cell_formula_units_Z            4
_cell_length_a                   17.14
_cell_length_b                   8.92
_cell_length_c                   23.46
_cell_volume                     3526.710
_citation_journal_id_ASTM        RVCMA8
_cod_data_source_file            Deiseroth_RVCMA8_1983_332.cif
_cod_data_source_block           Cs8.37O3Rb2.59
_cod_original_cell_volume        3526.71
_cod_database_code               1536288
loop_
_symmetry_equiv_pos_as_xyz
x,y,z
-x,y+1/2,-z+1/2
-x,-y,-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
Rb3 Rb 0.222 0.12 0.3224 0.63 0.0
Cs5 Cs 0.4379 0.934 0.3844 0.7 0.0
O3 O-2 0.388 0.211 0.37 1 0.0
Cs2 Cs 0.0938 0.44 0.2811 0.79 0.0
Cs6 Cs 0.5261 0.339 0.4038 0.85 0.0
Cs1 Cs 0.3801 0.222 0.2448 0.91 0.0
Cs11 Cs 0.2306 0.582 0.1681 0.97 0.0
Cs9 Cs 0.3144 0.239 0.4668 0.79 0.0
Rb7 Rb 0.1583 0.609 0.4514 0.21 0.0
Rb6 Rb 0.5261 0.339 0.4038 0.15 0.0
Rb8 Rb 0.3144 0.239 0.4668 0.21 0.0
O2 O-2 0.172 0.362 0.393 1 0.0
Cs4 Cs 0.3022 0.478 0.3402 0.33 0.0
Rb1 Rb 0.3801 0.222 0.2448 0.09 0.0
O1 O-2 0.2193 0.366 0.232 1 0.0
Rb2 Rb 0.0938 0.44 0.2811 0.21 0.0
Cs8 Cs 0.1583 0.609 0.4514 0.79 0.0
Rb9 Rb 0.1528 0.166 0.1486 0.09 0.0
Rb4 Rb 0.3022 0.478 0.3402 0.67 0.0
Rb10 Rb 0.2306 0.582 0.1681 0.03 0.0
Cs7 Cs 0.0638 0.198 0.4291 1 0.0
Cs3 Cs 0.222 0.12 0.3224 0.33 0.0
Rb5 Rb 0.4379 0.934 0.3844 0.3 0.0
Cs10 Cs 0.1528 0.166 0.1486 0.91 0.0
