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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/1/52/30/1523078.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_1523078
loop_
_publ_author_name
'Westin, L.'
'Edshammar, L.E.'
_publ_section_title
;
 The crystal structure of Ir7 Mg44
;
_journal_name_full
'Acta Chemica Scandinavica (1-27,1973-42,1988)'
_journal_page_first              3619
_journal_page_last               3626
_journal_volume                  26
_journal_year                    1972
_chemical_formula_sum            'Ir7 Mg44'
_space_group_IT_number           216
_symmetry_space_group_name_Hall  'F -4 2 3'
_symmetry_space_group_name_H-M   'F -4 3 m'
_cell_angle_alpha                90
_cell_angle_beta                 90
_cell_angle_gamma                90
_cell_formula_units_Z            8
_cell_length_a                   20.097
_cell_length_b                   20.097
_cell_length_c                   20.097
_cell_volume                     8116.965
_citation_journal_id_ASTM        ACSAA4
_cod_data_source_file            Westin_ACSAA4_1972_757.cif
_cod_data_source_block           Ir7Mg44
_cod_original_cell_volume        8116.966
_cod_database_code               1523078
loop_
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x,y,z
y,-x,-z
-x,-y,z
-y,x,-z
x,-y,-z
-y,-x,z
-x,y,-z
y,x,z
z,x,y
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z,-x,-y
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y+1/2,-z+1/2,-x
-z+1/2,-y+1/2,x
-y+1/2,z+1/2,-x
z+1/2,y+1/2,x
-y+1/2,-z+1/2,x
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z+1/2,-y+1/2,-x
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
Mg2 Mg 0.8338 0.8338 0.8338 1 0.0
Mg1 Mg 0.6973 0.6973 0.6973 1 0.0
Mg4 Mg 0.9482 0.9482 0.9482 1 0.0
Mg3 Mg 0.5623 0.5623 0.5623 1 0.0
Ir1 Ir 0.0839 0.0839 0.0839 1 0.0
Mg6 Mg 0.3561 0.25 0.25 1 0.0
Ir2 Ir 0.3482 0.3482 0.3482 1 0.0
Mg9 Mg 0.1928 0.1928 0.4799 1 0.0
Mg11 Mg 0.1561 0.1561 0.9797 1 0.0
Ir3 Ir 0.5867 0.25 0.25 1 0.0
Mg8 Mg 0.1067 0.1067 0.2147 1 0.0
Mg5 Mg 0.1814 0 0 1 0.0
Mg10 Mg 0.0985 0.0985 0.7194 1 0.0
Mg7 Mg 0.0517 0.0517 0.3385 1 0.0
