#------------------------------------------------------------------------------
#$Date: 2024-05-02 13:48:35 +0300 (Thu, 02 May 2024) $
#$Revision: 291455 $
#$URL: file:///home/coder/svn-repositories/cod/cif/9/00/80/9008091.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_9008091
loop_
_publ_author_name
'Rentzeperis, P. J.'
_publ_section_title
;
 The crystal structure of the anhydrous stannous sulphate
;
_journal_name_full               'Zeitschrift fur Kristallographie'
_journal_page_first              431
_journal_page_last               436
_journal_volume                  117
_journal_year                    1962
_chemical_formula_structural     SnSO4
_chemical_formula_sum            'O4 S Sn'
_space_group_IT_number           62
_symmetry_space_group_name_Hall  '-P 2ac 2n'
_symmetry_space_group_name_H-M   'P n m a'
_cell_angle_alpha                90
_cell_angle_beta                 90
_cell_angle_gamma                90
_cell_length_a                   8.799
_cell_length_b                   5.319
_cell_length_c                   7.115
_cell_formula_units_Z            4
_cell_volume                     332.995
_database_code_amcsd             0010603
_exptl_crystal_density_diffrn    4.284
_cod_original_formula_sum        'Sn S O4'
_cod_database_code               9008091
_amcsd_formula_title             SnSO4
loop_
_space_group_symop_operation_xyz
x,y,z
x,1/2-y,z
-x,1/2+y,-z
1/2-x,1/2+y,1/2+z
1/2+x,1/2-y,1/2-z
1/2+x,y,1/2-z
1/2-x,-y,1/2+z
-x,-y,-z
loop_
_atom_site_label
_atom_site_fract_x
_atom_site_fract_y
_atom_site_fract_z
Sn 0.20800 0.25000 0.22200
S 0.06900 0.25000 0.69400
O1 -0.08300 0.25000 0.59700
O2 0.19400 0.25000 0.55000
O3 0.08800 0.02000 0.81900
loop_
_cod_related_entry_id
_cod_related_entry_database
_cod_related_entry_code
1 AMCSD 0010603
