#------------------------------------------------------------------------------
#$Date: 2016-02-13 20:28:24 +0100 (Sat 13 de Feb de 2016) $
#$Revision: 176429 $
#$URL: svn://www.crystallography.net/cod/cif/8/10/41/8104155.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_8104155
loop_
_publ_author_name
'Range, K.J.'
'Gietl, A.'
'Klement, U.'
'Lange, K.G.'
_publ_section_title
;
 Crystal structure of thulium oxide sulfide
;
_journal_name_full
'Zeitschrift fuer Kristallographie (149,1979-)'
_journal_page_first              95
_journal_page_last               96
_journal_volume                  208
_journal_year                    1993
_chemical_formula_sum            'O2 S Tm2'
_chemical_name_systematic        'Tm2 O2 S'
_space_group_IT_number           164
_symmetry_space_group_name_Hall  '-P 3 2"'
_symmetry_space_group_name_H-M   'P -3 m 1'
_cell_angle_alpha                90
_cell_angle_beta                 90
_cell_angle_gamma                120
_cell_formula_units_Z            1
_cell_length_a                   3.743
_cell_length_b                   3.743
_cell_length_c                   6.523
_cell_volume                     79.144
_citation_journal_id_ASTM        ZEKRDZ
_cod_data_source_file            Range_ZEKRDZ_1993_1555.cif
_cod_data_source_block           O2S1Tm2
_cod_original_cell_volume        79.14394
_cod_original_formula_sum        'O2 S1 Tm2'
_cod_database_code               8104155
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,-y,-z
y,-x+y,-z
x-y,x,-z
-y,-x,z
x,x-y,z
-x+y,y,z
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
Tm1 Tm+3 0.3333 0.6667 0.2818 1 0.0
S1 S-2 0 0 0 1 0.0
O1 O-2 0.3333 0.6667 0.629 1 0.0
