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#$Date: 2015-09-18 00:29:26 +0300 (Fri, 18 Sep 2015) $
#$Revision: 157171 $
#$URL: svn://www.crystallography.net/cod/cif/1/53/16/1531649.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_1531649
loop_
_publ_author_name
'Lafond, A.'
'Meerschaut, A.'
'Andre, G.'
'Bouree, F.'
'Leynaud, O.'
_publ_section_title
;
 Magnetic properties of Ln2 Ti2 S2 O5 compounds and magnetic structure of
 Tb2 Ti2 S2 O5
;
_journal_name_full               'Journal of Alloys Compd.'
_journal_page_first              185
_journal_page_last               193
_journal_volume                  338
_journal_year                    2002
_chemical_formula_sum            'O5 S2 Tb2 Ti2'
_chemical_name_systematic        'Tb2 Ti2 S2 O5'
_space_group_IT_number           139
_symmetry_space_group_name_Hall  '-I 4 2'
_symmetry_space_group_name_H-M   'I 4/m m m'
_cell_angle_alpha                90
_cell_angle_beta                 90
_cell_angle_gamma                90
_cell_formula_units_Z            2
_cell_length_a                   3.78566
_cell_length_b                   3.78566
_cell_length_c                   22.859
_cell_volume                     327.597
_citation_journal_id_ASTM        JALCEU
_cod_data_source_file            Lafond_JALCEU_2002_464.cif
_cod_data_source_block           O5S2Tb2Ti2
_cod_original_cell_volume        327.5974
_cod_database_code               1531649
loop_
_symmetry_equiv_pos_as_xyz
x,y,z
-y,x,z
-x,-y,z
y,-x,z
x,-y,-z
y,x,-z
-x,y,-z
-y,-x,-z
-x,-y,-z
y,-x,-z
x,y,-z
-y,x,-z
-x,y,z
-y,-x,z
x,-y,z
y,x,z
x+1/2,y+1/2,z+1/2
-y+1/2,x+1/2,z+1/2
-x+1/2,-y+1/2,z+1/2
y+1/2,-x+1/2,z+1/2
x+1/2,-y+1/2,-z+1/2
y+1/2,x+1/2,-z+1/2
-x+1/2,y+1/2,-z+1/2
-y+1/2,-x+1/2,-z+1/2
-x+1/2,-y+1/2,-z+1/2
y+1/2,-x+1/2,-z+1/2
x+1/2,y+1/2,-z+1/2
-y+1/2,x+1/2,-z+1/2
-x+1/2,y+1/2,z+1/2
-y+1/2,-x+1/2,z+1/2
x+1/2,-y+1/2,z+1/2
y+1/2,x+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
Tb1 Tb+3 0 0 0.1665 1 0.0
S1 S-2 0.5 0.5 0.2046 1 0.0
O2 O-2 0.5 0 0.0981 1 0.0
Ti1 Ti+4 0.5 0.5 0.07884 1 0.0
O1 O-2 0.5 0.5 0 1 0.0
