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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/1/53/37/1533783.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_1533783
loop_
_publ_author_name
'Blasco, J.'
'Garcia, J.'
'Sanchez, M.C.'
'Campo, J.'
'Subias, G.'
'Perez-Cacho, J.'
_publ_section_title
;
 Magnetic properties of La Ni1-x Mnx O3+d perovskites
;
_journal_name_full               'The European Physical Journal B'
_journal_page_first              469
_journal_page_last               479
_journal_volume                  30
_journal_year                    2002
_chemical_formula_sum            'La Mn0.5 Ni0.5 O3'
_chemical_name_systematic        'La (Ni0.5 Mn0.5) O3'
_space_group_IT_number           148
_symmetry_space_group_name_Hall  '-R 3'
_symmetry_space_group_name_H-M   'R -3 :H'
_cell_angle_alpha                90
_cell_angle_beta                 90
_cell_angle_gamma                120
_cell_formula_units_Z            6
_cell_length_a                   5.5172
_cell_length_b                   5.5172
_cell_length_c                   13.2694
_cell_volume                     349.800
_citation_journal_id_ASTM        EPJBFY
_cod_data_source_file            Blasco_EPJBFY_2002_342.cif
_cod_data_source_block           La1Mn0.5Ni0.5O3
_cod_original_cell_volume        349.7997
_cod_original_formula_sum        'La1 Mn0.5 Ni0.5 O3'
_cod_database_code               1533783
loop_
_symmetry_equiv_pos_as_xyz
x,y,z
-y,x-y,z
-x+y,-x,z
-x,-y,-z
y,-x+y,-z
x-y,x,-z
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
-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
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
-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
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 0.9 0.0
O1 O-2 0.5608 0.0122 0.2523 1 0.0
La1 La+3 0 0 0.2497 1 0.0
Ni1 Ni+3 0 0 0 0.1 0.0
Ni2 Ni+3 0 0 0.5 0.9 0.0
Mn2 Mn+3 0 0 0.5 0.1 0.0
