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#$Date: 2016-02-13 21:28:24 +0200 (Sat, 13 Feb 2016) $
#$Revision: 176429 $
#$URL: svn://www.crystallography.net/cod/cif/1/52/58/1525858.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_1525858
loop_
_publ_author_name
'Das, A.'
'Sahana, M.'
'Yusuf, S.M.'
'Madhav Rao, L.'
'Shivakumara, C.'
'Hegde, M.S.'
_publ_section_title
;
 Magnetic structure of sodium and potassium doped lanthanum manganites
;
_journal_name_full               'Materials Research Bulletin'
_journal_page_first              651
_journal_page_last               659
_journal_volume                  35
_journal_year                    2000
_chemical_formula_sum            'La0.79 Mn Na0.12 O2.81'
_chemical_name_systematic        '(La0.79 Na0.12) (Mn O2.81)'
_space_group_IT_number           167
_symmetry_space_group_name_Hall  '-R 3 2"c'
_symmetry_space_group_name_H-M   'R -3 c :H'
_cell_angle_alpha                90
_cell_angle_beta                 90
_cell_angle_gamma                120
_cell_formula_units_Z            6
_cell_length_a                   5.505
_cell_length_b                   5.505
_cell_length_c                   13.32
_cell_volume                     349.582
_citation_journal_id_ASTM        MRBUAC
_cod_data_source_file            Das_MRBUAC_2000_325.cif
_cod_data_source_block           La0.79Mn1Na0.12O2.81
_cod_original_cell_volume        349.5824
_cod_original_formula_sum        'La0.79 Mn1 Na0.12 O2.81'
_cod_database_code               1525858
loop_
_symmetry_equiv_pos_as_xyz
x,y,z
-y,x-y,z
-x+y,-x,z
y,x,-z+1/2
-x,-x+y,-z+1/2
x-y,-y,-z+1/2
-x,-y,-z
y,-x+y,-z
x-y,x,-z
-y,-x,z-1/2
x,x-y,z-1/2
-x+y,y,z-1/2
x+2/3,y+1/3,z+1/3
-y+2/3,x-y+1/3,z+1/3
-x+y+2/3,-x+1/3,z+1/3
y+2/3,x+1/3,-z+5/6
-x+2/3,-x+y+1/3,-z+5/6
x-y+2/3,-y+1/3,-z+5/6
-x+2/3,-y+1/3,-z+1/3
y+2/3,-x+y+1/3,-z+1/3
x-y+2/3,x+1/3,-z+1/3
-y+2/3,-x+1/3,z-1/6
x+2/3,x-y+1/3,z-1/6
-x+y+2/3,y+1/3,z-1/6
x+1/3,y+2/3,z+2/3
-y+1/3,x-y+2/3,z+2/3
-x+y+1/3,-x+2/3,z+2/3
y+1/3,x+2/3,-z+7/6
-x+1/3,-x+y+2/3,-z+7/6
x-y+1/3,-y+2/3,-z+7/6
-x+1/3,-y+2/3,-z+2/3
y+1/3,-x+y+2/3,-z+2/3
x-y+1/3,x+2/3,-z+2/3
-y+1/3,-x+2/3,z+1/6
x+1/3,x-y+2/3,z+1/6
-x+y+1/3,y+2/3,z+1/6
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
Mn1 Mn+3 0 0 0.5 1 0.0
La1 La+3 0 0 0.25 0.79 0.0
O1 O-2 0.432 0 0.25 0.937 0.0
Na1 Na+1 0 0 0.25 0.12 0.0
