#------------------------------------------------------------------------------
#$Date: 2018-09-27 06:13:35 +0200 (Thu, 27 Sep 2018) $
#$Revision: 211196 $
#$URL: svn://saulius.grazulis.lt/cod-secondary/cif/8/10/45/8104500.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_8104500
loop_
_publ_author_name
'Eisenmann, B.'
'Zagler, R.'
_publ_section_title
;
 Crystal structure of tripotassium tritelluroantimonate(III)
;
_journal_name_full
'Zeitschrift fuer Kristallographie (149,1979-)'
_journal_page_first              255
_journal_page_last               256
_journal_volume                  197
_journal_year                    1991
_chemical_formula_sum            'K3 Sb Te3'
_space_group_IT_number           198
_symmetry_space_group_name_Hall  'P 2ac 2ab 3'
_symmetry_space_group_name_H-M   'P 21 3'
_cell_angle_alpha                90
_cell_angle_beta                 90
_cell_angle_gamma                90
_cell_formula_units_Z            4
_cell_length_a                   10.393
_cell_length_b                   10.393
_cell_length_c                   10.393
_cell_volume                     1122.594
_citation_journal_id_ASTM        ZEKRDZ
_cod_data_source_file            Eisenmann_ZEKRDZ_1991_1472.cif
_cod_data_source_block           K3Sb1Te3
_cod_original_formula_sum        'K3 Sb1 Te3'
_cod_database_code               8104500
loop_
_symmetry_equiv_pos_as_xyz
x,y,z
-x+1/2,-y,z+1/2
x+1/2,-y+1/2,-z
-x,y+1/2,-z+1/2
z,x,y
-z+1/2,-x,y+1/2
z+1/2,-x+1/2,-y
-z,x+1/2,-y+1/2
y,z,x
y+1/2,-z+1/2,-x
-y,z+1/2,-x+1/2
-y+1/2,-z,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
Te1 Te-2 0.22288 0.61115 0.49857 1 0.0
K1 K+1 0.5779 0.5779 0.5779 1 0.0
K3 K+1 0.81678 0.81678 0.81678 1 0.0
Sb1 Sb+3 0.03179 0.03179 0.03179 1 0.0
K2 K+1 0.32324 0.32324 0.32324 1 0.0
