#------------------------------------------------------------------------------
#$Date: 2017-10-06 19:24:22 +0300 (Fri, 06 Oct 2017) $
#$Revision: 201816 $
#$URL: file:///home/coder/svn-repositories/cod/cif/9/01/52/9015298.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_9015298
loop_
_publ_author_name
'Battle, P.'
'Gibb, T.'
'Jones, C.'
'Studer, F.'
_publ_section_title
;
 Spin-Glass Behavior in Sr2 Fe Ru O6 and Ba La Ni Ru O6: A
 Comparison with Antiferromagnetic Ba La Zn Ru O6
 _cod_database_code 1001399
;
_journal_name_full               'Journal of Solid State Chemistry'
_journal_page_first              281
_journal_page_last               293
_journal_paper_doi               10.1016/0022-4596(89)90109-6
_journal_volume                  78
_journal_year                    1989
_chemical_formula_sum            'Fe0.5 O3 Ru0.5 Sr'
_space_group_IT_number           15
_symmetry_space_group_name_Hall  '-I 2yc'
_symmetry_space_group_name_H-M   'I 1 2/c 1'
_cell_angle_alpha                90
_cell_angle_beta                 90.11
_cell_angle_gamma                90
_cell_length_a                   5.5379
_cell_length_b                   5.5429
_cell_length_c                   7.8772
_cell_volume                     241.798
_database_code_amcsd             0013640
_exptl_crystal_density_diffrn    5.881
_cod_duplicate_entry             1001399
_cod_original_formula_sum        'Sr (Fe.5 Ru.5) O3'
_cod_database_code               9015298
_amcsd_formula_title             'Fe O6 Ru Sr2'
loop_
_space_group_symop_operation_xyz
x,y,z
1/2+x,1/2+y,1/2+z
x,-y,1/2+z
1/2+x,1/2-y,+z
-x,y,1/2-z
1/2-x,1/2+y,-z
-x,-y,-z
1/2-x,1/2-y,1/2-z
loop_
_atom_site_label
_atom_site_fract_x
_atom_site_fract_y
_atom_site_fract_z
_atom_site_occupancy
Sr1 0.00000 0.50000 0.25000 1.00000
Fe1 0.00000 0.00000 0.00000 0.50000
Ru1 0.00000 0.00000 0.00000 0.50000
O1 0.00000 0.01100 0.25000 1.00000
O2 0.22800 0.72800 0.00550 1.00000
loop_
_cod_related_entry_id
_cod_related_entry_database
_cod_related_entry_code
1 AMCSD 0013640
