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#$Date: 2016-02-13 21:28:24 +0200 (Sat, 13 Feb 2016) $
#$Revision: 176429 $
#$URL: svn://www.crystallography.net/cod/cif/1/52/39/1523991.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_1523991
loop_
_publ_author_name
'Aresti, A.'
'Manca, P.'
'Garbato, L.'
'Lehmann, A.G.'
_publ_section_title
;
 Phase relationships of Mn Te in ternary chalcogenides
;
_journal_name_full
'Ternary Multinary Compd.,Proc. Int. Conf., 7th (1986)'
_journal_page_first              497
_journal_page_last               502
_journal_volume                  1986
_journal_year                    1987
_chemical_formula_sum            'Cu0.5 In0.5 Te'
_chemical_name_systematic        '(Cu0.5 In0.5) Te'
_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            4
_cell_length_a                   6.191
_cell_length_b                   6.191
_cell_length_c                   6.191
_cell_volume                     237.292
_citation_journal_id_ASTM        56EEA3
_cod_data_source_file            Aresti_56EEA3_1987_1533.cif
_cod_data_source_block           Cu0.5In0.5Te1
_cod_original_cell_volume        237.2916
_cod_original_formula_sum        'Cu0.5 In0.5 Te1'
_cod_database_code               1523991
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
z,x,y
x,-z,-y
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z,-x,-y
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x,z,y
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z,y,x
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x,y+1/2,z+1/2
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-x,-y+1/2,z+1/2
-y,x+1/2,-z+1/2
x,-y+1/2,-z+1/2
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-x,y+1/2,-z+1/2
y,x+1/2,z+1/2
z,x+1/2,y+1/2
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-x,z+1/2,-y+1/2
z,-x+1/2,-y+1/2
-x,-z+1/2,y+1/2
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y,-z+1/2,-x+1/2
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z,y+1/2,x+1/2
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x+1/2,-y,-z+1/2
-y+1/2,-x,z+1/2
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y+1/2,x,z+1/2
z+1/2,x,y+1/2
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-x+1/2,-z+1/2,y
-z+1/2,x+1/2,-y
x+1/2,z+1/2,y
y+1/2,z+1/2,x
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
-z+1/2,y+1/2,-x
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
Cu1 Cu+1 0 0 0 0.5 0.0
In1 In+3 0 0 0 0.5 0.0
Te1 Te-2 0.25 0.25 0.25 1 0.0
