#------------------------------------------------------------------------------
#$Date: 2016-02-13 20:28:24 +0100 (Sat 13 de Feb de 2016) $
#$Revision: 176429 $
#$URL: svn://www.crystallography.net/cod/cif/1/52/47/1524707.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_1524707
loop_
_publ_author_name
'Klepp, K.O.'
'Boller, H.'
_publ_section_title
;
 Die Kristallstruktur von Tl Fe3 Te3
;
_journal_name_full
;
Monatshefte fuer Chemie und verwandte Teile anderer Wissenschaften (109,1978-)
;
_journal_page_first              677
_journal_page_last               684
_journal_volume                  110
_journal_year                    1979
_chemical_formula_sum            'Fe3 Te3 Tl'
_chemical_name_systematic        'Tl Fe3 Te3'
_space_group_IT_number           176
_symmetry_space_group_name_Hall  '-P 6c'
_symmetry_space_group_name_H-M   'P 63/m'
_cell_angle_alpha                90
_cell_angle_beta                 90
_cell_angle_gamma                120
_cell_formula_units_Z            2
_cell_length_a                   9.35
_cell_length_b                   9.35
_cell_length_c                   4.223
_cell_volume                     319.724
_citation_journal_id_ASTM        MOCMB7
_cod_data_source_file            Klepp_MOCMB7_1979_297.cif
_cod_data_source_block           Fe3Te3Tl1
_cod_original_cell_volume        319.7238
_cod_original_formula_sum        'Fe3 Te3 Tl1'
_cod_database_code               1524707
loop_
_symmetry_equiv_pos_as_xyz
x,y,z
x-y,x,z+1/2
-y,x-y,z
-x,-y,z+1/2
-x+y,-x,z
y,-x+y,z+1/2
-x,-y,-z
-x+y,-x,-z-1/2
y,-x+y,-z
x,y,-z-1/2
x-y,x,-z
-y,x-y,-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
Fe1 Fe+1 0.1701 0.1493 0.25 1 0.0
Tl1 Tl+1 0.6667 0.3333 0.25 1 0.0
Te1 Te-2 0.0462 0.357 0.25 1 0.0
