#------------------------------------------------------------------------------
#$Date: 2016-02-13 20:28:24 +0100 (Sat 13 de Feb de 2016) $
#$Revision: 176429 $
#$URL: svn://www.crystallography.net/cod/cif/4/00/23/4002333.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_4002333
loop_
_publ_author_name
'Hong, C.S.'
'Chi, E.O.'
'Lee, K.W.'
'Hur, N.H.'
'Kim, W.S.'
'Lee, C.H.'
_publ_section_title
;
 Magnetic properties and structural evolution in Nd0.5 Sr1.5 Mn O4
;
_journal_name_full               'Chemistry of Materials (1,1989-)'
_journal_page_first              945
_journal_page_last               951
_journal_volume                  13
_journal_year                    2001
_chemical_formula_sum            'Mn O4 Pr0.5 Sr1.5'
_chemical_name_systematic        '(Pr0.5 Sr1.5) (Mn O4)'
_space_group_IT_number           139
_symmetry_space_group_name_Hall  '-I 4 2'
_symmetry_space_group_name_H-M   'I 4/m m m'
_cell_angle_alpha                90
_cell_angle_beta                 90
_cell_angle_gamma                90
_cell_formula_units_Z            2
_cell_length_a                   3.8362
_cell_length_b                   3.8362
_cell_length_c                   12.395
_cell_volume                     182.410
_citation_journal_id_ASTM        CMATEX
_cod_data_source_file            Hong_CMATEX_2001_967.cif
_cod_data_source_block           Mn1O4Pr0.5Sr1.5
_cod_original_cell_volume        182.4102
_cod_original_formula_sum        'Mn1 O4 Pr0.5 Sr1.5'
_cod_database_code               4002333
loop_
_symmetry_equiv_pos_as_xyz
x,y,z
-y,x,z
-x,-y,z
y,-x,z
x,-y,-z
y,x,-z
-x,y,-z
-y,-x,-z
-x,-y,-z
y,-x,-z
x,y,-z
-y,x,-z
-x,y,z
-y,-x,z
x,-y,z
y,x,z
x+1/2,y+1/2,z+1/2
-y+1/2,x+1/2,z+1/2
-x+1/2,-y+1/2,z+1/2
y+1/2,-x+1/2,z+1/2
x+1/2,-y+1/2,-z+1/2
y+1/2,x+1/2,-z+1/2
-x+1/2,y+1/2,-z+1/2
-y+1/2,-x+1/2,-z+1/2
-x+1/2,-y+1/2,-z+1/2
y+1/2,-x+1/2,-z+1/2
x+1/2,y+1/2,-z+1/2
-y+1/2,x+1/2,-z+1/2
-x+1/2,y+1/2,z+1/2
-y+1/2,-x+1/2,z+1/2
x+1/2,-y+1/2,z+1/2
y+1/2,x+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
O2 O-2 0 0 0.1624 1 0.0
Sr1 Sr+2 0 0 0.3574 0.75 0.0
Mn1 Mn+3 0 0 0 1 0.0
Pr1 Pr+3 0 0 0.3574 0.25 0.0
O1 O-2 0 0.5 0 1 0.0
