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#$Date: 2024-05-02 13:48:35 +0300 (Thu, 02 May 2024) $
#$Revision: 291455 $
#$URL: file:///home/coder/svn-repositories/cod/cif/9/00/80/9008002.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_9008002
loop_
_publ_author_name
'Smolentsev, A. I.'
'Naumov, D. Y.'
_publ_section_title
;
 Strontium chlorite, Sr(ClO2)2, from X-ray powder diffraction data
;
_journal_name_full               'Acta Crystallographica, Section E'
_journal_page_first              i249
_journal_page_last               i250
_journal_paper_doi               10.1107/S1600536805034161
_journal_volume                  61
_journal_year                    2005
_chemical_compound_source        Synthetic
_chemical_formula_structural     Sr(ClO2)2
_chemical_formula_sum            'Cl2 O2 Sr'
_space_group_crystal_system      orthorhombic
_space_group_IT_number           68
_space_group_name_Hall           'C 2 2 -1ac'
_space_group_name_H-M_alt        'C c c e :1'
_symmetry_space_group_name_H-M   'C c c a'
_cell_angle_alpha                90
_cell_angle_beta                 90
_cell_angle_gamma                90
_cell_length_a                   5.9799
_cell_length_b                   12.7519
_cell_length_c                   5.9787
_cell_formula_units_Z            8
_cell_volume                     455.906
_database_code_amcsd             0010463
_exptl_crystal_density_diffrn    5.552
_cod_depositor_comments
;
 Updating the space group information after consulting the original publication.

 Antanas Vaitkus,
 2017-07-11
;
_cod_original_sg_symbol_H-M      'C c c a'
_cod_original_formula_sum        'Sr Cl2 O2'
_cod_database_code               9008002
_amcsd_formula_title             Sr(ClO2)2
loop_
_space_group_symop_id
_space_group_symop_operation_xyz
1 x,y,z
2 1/2+x,1/2+y,z
3 x,1/2-y,1/2+z
4 1/2+x,-y,1/2+z
5 -x,y,-z
6 1/2-x,1/2+y,-z
7 -x,1/2+y,1/2+z
8 1/2-x,+y,1/2+z
9 x,-y,-z
10 1/2+x,1/2-y,-z
11 x,1/2+y,1/2-z
12 1/2+x,+y,1/2-z
13 -x,-y,z
14 1/2-x,1/2-y,z
15 -x,1/2-y,1/2-z
16 1/2-x,-y,1/2-z
loop_
_atom_site_label
_atom_site_fract_x
_atom_site_fract_y
_atom_site_fract_z
_atom_site_U_iso_or_equiv
Sr 0.00000 0.25000 0.25000 0.01050
Cl 0.50000 0.07460 0.25000 0.02150
O 0.34430 0.14470 0.10050 0.05000
loop_
_cod_related_entry_id
_cod_related_entry_database
_cod_related_entry_code
1 AMCSD 0010463
