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#$Date: 2016-02-13 20:28:24 +0100 (Sat 13 de Feb de 2016) $
#$Revision: 176429 $
#$URL: svn://www.crystallography.net/cod/cif/1/54/07/1540783.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_1540783
loop_
_publ_author_name
'Yang Zhuming'
'Pertlik, F.'
_publ_section_title
;
 The thallium sulfarsenites Tl3 As S3 and Tl As S2 [thallium(I)
 thioarsenates(III)]: structural characterization and syntheses
;
_journal_name_full               'Journal of Alloys Compd.'
_journal_page_first              155
_journal_page_last               158
_journal_volume                  216
_journal_year                    1994
_chemical_formula_sum            'As S2 Tl'
_chemical_name_systematic        'As Tl S2'
_space_group_IT_number           14
_symmetry_space_group_name_Hall  '-P 2ybc'
_symmetry_space_group_name_H-M   'P 1 21/c 1'
_cell_angle_alpha                90
_cell_angle_beta                 104.4
_cell_angle_gamma                90
_cell_formula_units_Z            8
_cell_length_a                   6.12
_cell_length_b                   11.33
_cell_length_c                   12.32
_cell_volume                     827.426
_citation_journal_id_ASTM        JALCEU
_cod_data_source_file            YangZhuming_JALCEU_1994_1017.cif
_cod_data_source_block           As1S2Tl1
_cod_original_cell_volume        827.4255
_cod_original_formula_sum        'As1 S2 Tl1'
_cod_database_code               1540783
loop_
_symmetry_equiv_pos_as_xyz
x,y,z
-x,y+1/2,-z+1/2
-x,-y,-z
x,-y-1/2,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
Tl2 Tl 0.7356 0.9443 0.1012 1 0.0
S2 S 0.1851 0.4441 0.1496 1 0.0
As2 As 0.5343 0.4137 0.1366 1 0.0
S1 S 0.7172 0.6866 0.1251 1 0.0
As1 As 0.2269 0.166 0.1952 1 0.0
S3 S 0.5759 0.2123 0.1673 1 0.0
Tl1 Tl 0.162 0.6877 0.0522 1 0.0
S4 S 0.2742 0.962 0.182 1 0.0
