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#$Date: 2016-02-13 21:28:24 +0200 (Sat, 13 Feb 2016) $
#$Revision: 176429 $
#$URL: file:///home/coder/svn-repositories/cod/cif/1/52/25/1522557.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_1522557
loop_
_publ_author_name
'Moze, O.'
'Ibberson, R.M.'
'Buschow, K.H.J.'
_publ_section_title
;
 On the preferential site occupation of Fe in R Fe4 Al8 and related
 compounds
;
_journal_name_full               'Journal of Physics: Condensed Matter'
_journal_page_first              1677
_journal_page_last               1681
_journal_volume                  2
_journal_year                    1990
_chemical_formula_sum            'Al7.02 Fe4.98 Y'
_chemical_name_systematic        'Al7.02 Fe4.98 Y'
_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                   8.64
_cell_length_b                   8.64
_cell_length_c                   5.03
_cell_volume                     375.487
_citation_journal_id_ASTM        JCOMEL
_cod_data_source_file            Moze_JCOMEL_1990_1324.cif
_cod_data_source_block           Al7.02Fe4.98Y1
_cod_original_cell_volume        375.4875
_cod_original_formula_sum        'Al7.02 Fe4.98 Y1'
_cod_database_code               1522557
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
Y1 Y 0 0 0 1 0.0
Al2 Al 0.25 0.25 0.25 0.074 0.0
Al3 Al 0.27201 0.5 0 0.68 0.0
Fe2 Fe 0.27201 0.5 0 0.32 0.0
Fe1 Fe 0.25 0.25 0.25 0.926 0.0
Al1 Al 0.34292 0 0 1 0.0