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#$Date: 2016-02-13 21:28:24 +0200 (Sat, 13 Feb 2016) $
#$Revision: 176429 $
#$URL: svn://www.crystallography.net/cod/cif/8/10/38/8103843.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_8103843
loop_
_publ_author_name
'Li, P.-Y.'
'Range, K.J.'
'Andratschke, M.'
_publ_section_title
;
 Crystal structure of lutetium ytterbium oxide sulfide, (Lu1.33 Yb0.67) O2
 S
;
_journal_name_full
'Zeitschrift fuer Kristallographie (149,1979-)'
_journal_page_first              49
_journal_page_last               49
_journal_volume                  212
_journal_year                    1997
_chemical_formula_sum            'Lu1.33 O2 S Yb0.67'
_chemical_name_systematic        '(Lu1.33 Yb0.67) 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                   3.7113
_cell_length_b                   3.7113
_cell_length_c                   6.4878
_cell_volume                     77.389
_citation_journal_id_ASTM        ZEKRDZ
_cod_data_source_file            Li_ZEKRDZ_1997_1931.cif
_cod_data_source_block           Lu1.33O2S1Yb0.67
_cod_original_cell_volume        77.38917
_cod_original_formula_sum        'Lu1.33 O2 S1 Yb0.67'
_cod_database_code               8103843
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
O1 O-2 0.3333 0.6667 0.3712 1 0.0
S1 S-2 0 0 0 1 0.0
Lu1 Lu+3 0.3333 0.6667 0.71771 0.665 0.0
Yb1 Yb+3 0.3333 0.6667 0.71771 0.335 0.0
