#------------------------------------------------------------------------------
#$Date: 2016-02-13 20:28:24 +0100 (Sat 13 de Feb de 2016) $
#$Revision: 176429 $
#$URL: svn://www.crystallography.net/cod/cif/1/52/74/1527421.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_1527421
loop_
_publ_author_name
'Glaser, J.'
_publ_section_title
;
 Crystal and Molecular Structure of Potassium Tetrachlorothallate(III)
;
_journal_name_full
'Acta Chemica Scandinavica, Series A: (28,1974-)'
_journal_page_first              75
_journal_page_last               76
_journal_volume                  34
_journal_year                    1980
_chemical_formula_sum            'Cl4 K Tl'
_chemical_name_systematic        'K Tl Cl4'
_space_group_IT_number           88
_symmetry_space_group_name_Hall  '-I 4ad'
_symmetry_space_group_name_H-M   'I 41/a :2'
_cell_angle_alpha                90
_cell_angle_beta                 90
_cell_angle_gamma                90
_cell_formula_units_Z            4
_cell_length_a                   6.892
_cell_length_b                   6.892
_cell_length_c                   15.327
_cell_volume                     728.027
_citation_journal_id_ASTM        ACAPCT
_cod_data_source_file            Glaser_ACAPCT_1980_914.cif
_cod_data_source_block           Cl4K1Tl1
_cod_original_cell_volume        728.0274
_cod_original_formula_sum        'Cl4 K1 Tl1'
_cod_database_code               1527421
loop_
_symmetry_equiv_pos_as_xyz
x,y,z
-y+3/4,x+1/4,z+1/4
-x+1/2,-y,z+1/2
y+3/4,-x+3/4,z+3/4
-x,-y,-z
y-3/4,-x-1/4,-z-1/4
x-1/2,y,-z-1/2
-y-3/4,x-3/4,-z-3/4
x+1/2,y+1/2,z+1/2
-y+5/4,x+3/4,z+3/4
-x+1,-y+1/2,z+1
y+5/4,-x+5/4,z+5/4
-x+1/2,-y+1/2,-z+1/2
y-1/4,-x+1/4,-z+1/4
x,y+1/2,-z
-y-1/4,x-1/4,-z-1/4
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
Tl1 Tl+3 0 0.25 0.125 1 0.0
Cl1 Cl-1 0.1615 0.4982 0.2102 1 0.0
K1 K+1 0 0.25 0.625 1 0.0
