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#$Date: 2016-02-13 21:28:24 +0200 (Sat, 13 Feb 2016) $
#$Revision: 176429 $
#$URL: file:///home/coder/svn-repositories/cod/cif/1/53/06/1530653.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_1530653
loop_
_publ_author_name
'Rosenberg, M.'
'Knulle, A.'
'Platte, C.'
'Sabrowsky, H.'
_publ_section_title
;
 Magnetic properties and structure of some ternary chromium chalcogenides
 with thallium and silver
;
_journal_name_full               'Journal of Physics and Chemistry of Solids'
_journal_page_first              87
_journal_page_last               95
_journal_volume                  43
_journal_year                    1982
_chemical_formula_sum            'Cr S2 Tl'
_chemical_name_systematic        'Tl Cr S2'
_space_group_IT_number           160
_symmetry_space_group_name_Hall  'R 3 -2"'
_symmetry_space_group_name_H-M   'R 3 m :H'
_cell_angle_alpha                90
_cell_angle_beta                 90
_cell_angle_gamma                120
_cell_formula_units_Z            3
_cell_length_a                   3.538
_cell_length_b                   3.538
_cell_length_c                   21.92
_cell_volume                     237.622
_citation_journal_id_ASTM        JPCSAW
_cod_data_source_file            Rosenberg_JPCSAW_1982_928.cif
_cod_data_source_block           Cr1S2Tl1
_cod_original_cell_volume        237.6221
_cod_original_formula_sum        'Cr1 S2 Tl1'
_cod_database_code               1530653
loop_
_symmetry_equiv_pos_as_xyz
x,y,z
-y,x-y,z
-x+y,-x,z
-y,-x,z
x,x-y,z
-x+y,y,z
x+2/3,y+1/3,z+1/3
-y+2/3,x-y+1/3,z+1/3
-x+y+2/3,-x+1/3,z+1/3
-y+2/3,-x+1/3,z+1/3
x+2/3,x-y+1/3,z+1/3
-x+y+2/3,y+1/3,z+1/3
x+1/3,y+2/3,z+2/3
-y+1/3,x-y+2/3,z+2/3
-x+y+1/3,-x+2/3,z+2/3
-y+1/3,-x+2/3,z+2/3
x+1/3,x-y+2/3,z+2/3
-x+y+1/3,y+2/3,z+2/3
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+1 0 0 0.1667 1 0.0
S1 S-2 0 0 0.39 1 0.0
Cr1 Cr+3 0 0 0 1 0.0
S2 S-2 0 0 -0.39 1 0.0