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#$Date: 2018-09-27 07:13:35 +0300 (Thu, 27 Sep 2018) $
#$Revision: 211196 $
#$URL: file:///home/coder/svn-repositories/cod/cif/1/52/25/1522556.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_1522556
loop_
_publ_author_name
'Moze, O.'
'Ibberson, R.M.'
'Caciuffo, R.'
'Buschow, K.H.J.'
_publ_section_title
;
 On the preferential site occupation of T= Cr, or Mn in rare earth
 compounds of the type R T4 Al8
;
_journal_name_full               'Journal of the Less-Common Metals'
_journal_page_first              329
_journal_page_last               334
_journal_volume                  166
_journal_year                    1990
_chemical_formula_sum            'Al8 Cr4 Er'
_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                   8.9244
_cell_length_b                   8.9244
_cell_length_c                   5.1244
_cell_volume                     408.132
_citation_journal_id_ASTM        JCOMAH
_cod_data_source_file            Moze_JCOMAH_1990_970.cif
_cod_data_source_block           Al8Cr4Er1
_cod_original_cell_volume        408.1324
_cod_original_formula_sum        'Al8 Cr4 Er1'
_cod_database_code               1522556
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
Cr2 Cr 0.3432 0 0 0.02 0.0
Al2 Al 0.3421 0 0 0.98 0.0
Cr1 Cr 0.25 0.25 0.25 0.932 0.0
Er1 Er 0 0 0 1 0.0
Cr3 Cr 0.2811 0.5 0 0.048 0.0
Al3 Al 0.281 0.5 0 0.952 0.0
Al1 Al 0.25 0.25 0.25 0.068 0.0