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#$Date: 2018-09-27 07:13:35 +0300 (Thu, 27 Sep 2018) $
#$Revision: 211196 $
#$URL: file:///home/coder/svn-repositories/cod/cif/2/10/63/2106301.cif $
#------------------------------------------------------------------------------
#
# This file is available in the Crystallography Open Database (COD),
# http://www.crystallography.net/. The original data for this entry
# were provided by IUCr Journals, http://journals.iucr.org/.
#
# The file may be used within the scientific community so long as
# proper attribution is given to the journal article from which the
# data were obtained.
#
data_2106301
loop_
_publ_author_name
'Dugue, J.'
'Villers, J.'
'Vovan, T.'
_publ_section_title
;
 Etude Structurale des Oxysulfures de Chrome(III) et de Terres Rares. II.
 Structure de l'Oxysulfure Ce Cr O S2
;
_journal_name_full               'Acta Crystallographica B (24,1968-38,1982)'
_journal_page_first              1294
_journal_page_last               1297
_journal_volume                  36
_journal_year                    1980
_chemical_formula_sum            'Ce Cr O S2'
_space_group_IT_number           12
_symmetry_space_group_name_Hall  '-B 2'
_symmetry_space_group_name_H-M   'B 1 1 2/m'
_cell_angle_alpha                90
_cell_angle_beta                 90
_cell_angle_gamma                90.07
_cell_formula_units_Z            4
_cell_length_a                   11.518
_cell_length_b                   7.951
_cell_length_c                   3.703
_cell_volume                     339.119
_citation_journal_id_ASTM        ACBCAR
_cod_data_source_file            Dugue_ACBCAR_1980_982.cif
_cod_data_source_block           Ce1Cr1O1S2
_cod_original_cell_volume        339.1191
_cod_original_sg_symbol_Hall     '-C 2y (-x,z,y)'
_cod_original_formula_sum        'Ce1 Cr1 O1 S2'
_cod_database_code               2106301
loop_
_symmetry_equiv_pos_as_xyz
x,y,z
-x,-y,z
-x,-y,-z
x,y,-z
x+1/2,y,z+1/2
-x+1/2,-y,z+1/2
-x+1/2,-y,-z+1/2
x+1/2,y,-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
Cr2 Cr+3 0.5 0.5 0 1 0.0
Cr1 Cr+3 0 0 0 1 0.0
Ce1 Ce+3 0.23445 0.20797 0.5 1 0.0
S1 S-2 0.4574 0.1981 0 1 0.0
O1 O-2 0.1652 0.0596 0 1 0.0
S2 S-2 0.135 0.4701 0 1 0.0
