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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/1/54/16/1541616.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_1541616
loop_
_publ_author_name
'Jensen, P.'
'Kjekshus, A.'
_publ_section_title
;
 The crystal structure of Nb3 Sb2 Te5
;
_journal_name_full               'Journal of the Less-Common Metals'
_journal_page_first              357
_journal_page_last               359
_journal_volume                  13
_journal_year                    1967
_chemical_formula_sum            'Nb3 Sb2 Te5'
_space_group_IT_number           229
_symmetry_space_group_name_Hall  '-I 4 2 3'
_symmetry_space_group_name_H-M   'I m -3 m'
_cell_angle_alpha                90
_cell_angle_beta                 90
_cell_angle_gamma                90
_cell_formula_units_Z            4
_cell_length_a                   9.8155
_cell_length_b                   9.8155
_cell_length_c                   9.8155
_cell_volume                     945.665
_citation_journal_id_ASTM        JCOMAH
_cod_data_source_file            Jensen_JCOMAH_1967_1708.cif
_cod_data_source_block           Nb3Sb2Te5
_cod_database_code               1541616
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
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z,-x,-y
x,z,-y
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y,-z,-x
z,y,-x
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y,-x,-z
x,y,-z
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x,-y,z
y,x,z
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z,x,-y
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-z,x,y
-x,-z,y
z,-x,y
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-y,-z,-x
-y,z,x
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y,-z,x
z,y,x
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-z,y,-x
z,-y,-x
x+1/2,y+1/2,z+1/2
-y+1/2,x+1/2,z+1/2
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y+1/2,-x+1/2,z+1/2
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z+1/2,x+1/2,y+1/2
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z+1/2,-x+1/2,-y+1/2
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y+1/2,z+1/2,x+1/2
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z+1/2,y+1/2,-x+1/2
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-y+1/2,z+1/2,x+1/2
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y+1/2,-z+1/2,x+1/2
z+1/2,y+1/2,x+1/2
y+1/2,z+1/2,-x+1/2
-z+1/2,y+1/2,-x+1/2
z+1/2,-y+1/2,-x+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
Nb1 Nb 0.3426 0 0 1 0.0
Te2 Te 0.165 0.165 0.165 0.5 0.0
Sb1 Sb 0.165 0.165 0.165 0.5 0.0
Te1 Te 0.25 0 0.5 1 0.0
