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#$Date: 2016-02-13 20:28:24 +0100 (Sat 13 de Feb de 2016) $
#$Revision: 176429 $
#$URL: svn://www.crystallography.net/cod/cif/1/52/84/1528495.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_1528495
loop_
_publ_author_name
'Foo, M.L.'
'Klimczuk, T.'
'Huang, Q.'
'Lee, W.-L.'
'Lynn, J.W.'
'Cava, R.J.'
'Hagemann, I.S.'
'Ong, N.P.'
_publ_section_title
;
 Synthesis, structure and physical properties of Ru ferrites: Ba M Ru5 O11
 (M = Li and Cu) and Ba M'2 Ru4 O11 (M' = Mn, Fe and Co)
;
_journal_name_full               'Journal of Solid State Chemistry'
_journal_page_first              563
_journal_page_last               572
_journal_volume                  179
_journal_year                    2006
_chemical_formula_sum            'Li0.8 O3 Ru'
_chemical_name_systematic        'Li0.80 O3 Ru'
_space_group_IT_number           15
_symmetry_space_group_name_Hall  '-C 2yc'
_symmetry_space_group_name_H-M   'C 1 2/c 1'
_cell_angle_alpha                90
_cell_angle_beta                 100.023
_cell_angle_gamma                90
_cell_formula_units_Z            8
_cell_length_a                   4.9274
_cell_length_b                   8.786
_cell_length_c                   9.886
_cell_volume                     421.454
_citation_journal_id_ASTM        JSSCBI
_cod_data_source_file            Foo_JSSCBI_2006_935.cif
_cod_data_source_block           Li0.8O3Ru1
_cod_original_cell_volume        421.4541
_cod_original_formula_sum        'Li0.8 O3 Ru1'
_cod_database_code               1528495
loop_
_symmetry_equiv_pos_as_xyz
x,y,z
-x,y,-z+1/2
-x,-y,-z
x,-y,z-1/2
x+1/2,y+1/2,z
-x+1/2,y+1/2,-z+1/2
-x+1/2,-y+1/2,-z
x+1/2,-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
O3 O-2 0.17211 0.91499 0.09665 1 0.0
O2 O-2 0.05165 0.26876 0.11522 1 0.0
Li1 Li+1 0.25 0.25 0.5 0.4 0.0
O1 O-2 0.13256 0.22125 0.08826 1 0.0
Li4 Li+1 0 0.72 0.25 0.4 0.0
Li3 Li+1 0 0.41 0.25 0.4 0.0
Li2 Li+1 0 0.1 0.25 0.4 0.0
Ru1 Ru+5 0.22889 0.06352 -0.0084 1 0.0
