#------------------------------------------------------------------------------
#$Date: 2016-02-13 21:28:24 +0200 (Sat, 13 Feb 2016) $
#$Revision: 176429 $
#$URL: svn://www.crystallography.net/cod/cif/8/10/41/8104156.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_8104156
loop_
_publ_author_name
'Yanson, T.I.'
'Manyako, M.B.'
'Bodak, O.I.'
'Cerny, R.'
'Pacheco, J.V.'
'Yvon, K.'
_publ_section_title
;
 Crystal structure of zirconium iron aluminide, Zr6FeAl2.
;
_journal_name_full
;
Zeitschrift fuer Kristallographie - New Crystal Structures
;
_journal_page_first              504
_journal_page_last               504
_journal_volume                  212
_journal_year                    1997
_chemical_formula_sum            'Al2 Fe Zr6'
_chemical_name_systematic        'Zr6 Fe Al2'
_space_group_IT_number           189
_symmetry_space_group_name_Hall  'P -6 -2'
_symmetry_space_group_name_H-M   'P -6 2 m'
_cell_angle_alpha                90
_cell_angle_beta                 90
_cell_angle_gamma                120
_cell_formula_units_Z            1
_cell_length_a                   7.9207
_cell_length_b                   7.9207
_cell_length_c                   3.3603
_cell_volume                     182.573
_citation_journal_id_ASTM        ZKNSFT
_cod_data_source_file            Yanson_ZKNSFT_1997_1987.cif
_cod_data_source_block           Al2Fe1Zr6
_cod_original_cell_volume        182.5727
_cod_original_formula_sum        'Al2 Fe1 Zr6'
_cod_database_code               8104156
loop_
_symmetry_equiv_pos_as_xyz
x,y,z
-x+y,-x,-z
-y,x-y,z
x,y,-z
-x+y,-x,z
-y,x-y,-z
y,x,z
x-y,-y,-z
-x,-x+y,z
y,x,-z
x-y,-y,z
-x,-x+y,-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
Zr1 Zr 0.2531 0 0.5 1 0.0
Al1 Al 0.3333 0.6667 0.5 1 0.0
Fe1 Fe 0 0 0 1 0.0
Zr2 Zr 0.6035 0 0 1 0.0
