#------------------------------------------------------------------------------
#$Date: 2016-02-13 20:28:24 +0100 (Sat 13 de Feb de 2016) $
#$Revision: 176429 $
#$URL: svn://www.crystallography.net/cod/cif/1/52/62/1526206.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_1526206
loop_
_publ_author_name
'Oudalov, J.P.'
'Daoudi, A.'
'Joubert, J.C.'
'le Flem, G.'
'Hagenmuller, P.'
_publ_section_title
;
 Sur une nouvelle serie d'aluminates doubles de calcium et d'elements
 lanthanidiques de structure K2 Ni F4
;
_journal_name_full
'Bulletin de la Societe Chimique de France (Vol=Year)'
_journal_page_first              3408
_journal_page_last               3410
_journal_volume                  1970
_journal_year                    1970
_chemical_formula_sum            'Al Ca Nd O4'
_chemical_name_systematic        'Ca Nd Al 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                   3.688
_cell_length_b                   3.688
_cell_length_c                   12.15
_cell_volume                     165.256
_citation_journal_id_ASTM        BSCFAS
_cod_data_source_file            Oudalov_BSCFAS_1970_597.cif
_cod_data_source_block           Al1Ca1Nd1O4
_cod_original_cell_volume        165.2563
_cod_original_formula_sum        'Al1 Ca1 Nd1 O4'
_cod_database_code               1526206
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 0.5 0 1 0.0
Al1 Al+3 0 0 0 1 0.0
Nd1 Nd+3 0 0 0.35 0.5 0.0
Ca1 Ca+2 0 0 0.35 0.5 0.0
O1 O-2 0 0 0.15 1 0.0
