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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/1/54/01/1540160.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_1540160
loop_
_publ_author_name
'Izumi, F.'
'Takayama-Muromachi, E.'
'Fujimori, A.'
'Sawa, H.'
'Kamiyama, T.'
'Asano, T.'
'Akimitsu, J.'
_publ_section_title
;
 Metal ordering and oxygen displacements in (Nd, Sr, Ce)2 Cu O4-y
;
_journal_name_full               'Physica C (Amsterdam)'
_journal_page_first              440
_journal_page_last               448
_journal_volume                  158
_journal_year                    1989
_chemical_formula_sum            'Ce0.27 Cu Nd1.32 O3.93 Sr0.41'
_chemical_name_systematic        '(Nd1.32 Sr0.41 Ce0.27) Cu O3.93'
_space_group_IT_number           129
_symmetry_space_group_name_Hall  '-P 4a 2a'
_symmetry_space_group_name_H-M   'P 4/n m m :2'
_cell_angle_alpha                90
_cell_angle_beta                 90
_cell_angle_gamma                90
_cell_formula_units_Z            2
_cell_length_a                   3.8554
_cell_length_b                   3.8554
_cell_length_c                   12.4747
_cell_volume                     185.425
_citation_journal_id_ASTM        PHYCE6
_cod_data_source_file            Izumi_PHYCE6_1989_1069.cif
_cod_data_source_block           Ce0.27Cu1Nd1.32O3.93Sr0.41
_cod_original_cell_volume        185.4253
_cod_original_formula_sum        'Ce0.27 Cu1 Nd1.32 O3.93 Sr0.41'
_cod_database_code               1540160
loop_
_symmetry_equiv_pos_as_xyz
x,y,z
-y+1/2,x,z
-x+1/2,-y+1/2,z
y,-x+1/2,z
x+1/2,-y,-z
y+1/2,x+1/2,-z
-x,y+1/2,-z
-y,-x,-z
-x,-y,-z
y-1/2,-x,-z
x-1/2,y-1/2,-z
-y,x-1/2,-z
-x-1/2,y,z
-y-1/2,-x-1/2,z
x,-y-1/2,z
y,x,z
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
Ce1 Ce+3 0.25 0.25 0.1037 0.27 0.0
Nd2 Nd+3 0.25 0.25 0.1037 0.73 0.0
O3 O-2 0.75 0.25 0 1 0.0
O1 O-2 0.75 0.25 0.2372 1 0.0
Cu1 Cu+2 0.25 0.25 -0.2508 1 0.0
O2 O-2 0.2952 0.2952 -0.4278 0.2326 0.0
Sr1 Sr+2 0.25 0.25 0.3894 0.41 0.0
Nd1 Nd+3 0.25 0.25 0.3894 0.59 0.0
