#------------------------------------------------------------------------------
#$Date: 2017-10-06 18:24:22 +0200 (Fri 06 de Oct de 2017) $
#$Revision: 201816 $
#$URL: svn://www.crystallography.net/cod/cif/9/01/49/9014920.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_9014920
loop_
_publ_author_name
'Barnes, W. H.'
'Wendling, A. V.'
_publ_section_title
;
 The structure of rubidium dithionate Rb₂S₂O₆
;
_journal_issue                   1-6
_journal_name_full
;
 Zeitschrift für Kristallographie - Crystalline Materials
;
_journal_page_first              153
_journal_page_last               180
_journal_paper_doi               10.1524/zkri.1938.99.1.153
_journal_volume                  99
_journal_year                    1938
_chemical_formula_sum            'O3 Rb S'
_space_group_IT_number           150
_symmetry_space_group_name_Hall  'P 3 2"'
_symmetry_space_group_name_H-M   'P 3 2 1'
_cell_angle_alpha                90
_cell_angle_beta                 90
_cell_angle_gamma                120
_cell_formula_units_Z            3
_cell_length_a                   10.02
_cell_length_b                   10.02
_cell_length_c                   6.35
_cell_volume                     552.128
_database_code_amcsd             0016947
_exptl_crystal_density_diffrn    2.987
_cod_duplicate_entry             1010014
_cod_original_formula_sum        'S Rb O3'
_cod_database_code               9014920
_amcsd_formula_title             'O6 Rb2 S2'
loop_
_space_group_symop_operation_xyz
x,y,z
y,x,-z
-y,x-y,z
-x,-x+y,-z
-x+y,-x,z
x-y,-y,-z
loop_
_atom_site_label
_atom_site_fract_x
_atom_site_fract_y
_atom_site_fract_z
S1 0.00000 0.00000 0.16500
S2 0.33333 0.66667 0.25000
S3 0.33333 0.66667 0.58000
Rb1 0.37500 0.37500 0.00000
Rb2 0.71200 0.71200 0.50000
O1 0.16000 0.12000 0.22500
O2 0.53200 0.34900 0.36000
O3 0.50900 0.20900 0.81000
loop_
_cod_related_entry_id
_cod_related_entry_database
_cod_related_entry_code
1 AMCSD 0016947
