#------------------------------------------------------------------------------
#$Date: 2016-02-14 15:26:36 +0100 (Sun, 14 Feb 2016) $
#$Revision: 176435 $
#$URL: svn://saulius.grazulis.lt/cod-secondary/cif/1/50/90/1509010.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_1509010
loop_
_publ_author_name
'Schleid, T.'
'Hartenbach, I.'
'Nilges, T.'
_publ_section_title
;
 Thiosilicates of the rare-earth elements. IV. The quasi-isostructural
 compounds Na Sm3 S3 [Si S4], Cu Ce3 S3 [Si S4], Ag0.63 Ce3 S2.63 Cl0.37
 [Si S4] and Sm3 S2 Cl [Si S4] - synthesis, crystal structure and
 investigations of the silver-cation motion
;
_journal_name_full
'Zeitschrift fuer Anorganische und Allgemeine Chemie'
_journal_page_first              2445
_journal_page_last               2452
_journal_volume                  633
_journal_year                    2007
_chemical_formula_sum            'Ag0.627 Ce3 Cl0.37 S6.63 Si'
_chemical_name_systematic
;
Silver cerium sulfide chloride thiosilicate (0.63/3/2.63/0.37/1)
;
_space_group_IT_number           173
_symmetry_space_group_name_Hall  'P 6c'
_symmetry_space_group_name_H-M   'P 63'
_cell_angle_alpha                90
_cell_angle_beta                 90
_cell_angle_gamma                120
_cell_formula_units_Z            2
_cell_length_a                   10.2898
_cell_length_b                   10.2898
_cell_length_c                   5.7334
_cell_volume                     525.723
_citation_journal_id_ASTM        ZAACAB
_cod_data_source_file            silver0-1_136.cif
_cod_data_source_block           Ag0.627Ce3Cl0.37S6.63Si1
_cod_original_cell_volume        525.7227
_cod_original_formula_sum        'Ag0.627 Ce3 Cl0.37 S6.63 Si1'
_cod_database_code               1509010
loop_
_symmetry_equiv_pos_as_xyz
x,y,z
x-y,x,z+1/2
-y,x-y,z
-x,-y,z+1/2
-x+y,-x,z
y,-x+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
Ce1 Ce+3 0.358067 0.122461 0.25 1
S3 S-2 0.26102 0.08802 0.76398 0.876
Ag1 Ag+1 0 0 0.3573 0.627
S2 S-2 0.52424 0.4092 0.52066 1
Si1 Si+4 0.333333 0.666667 0.1635 0.9999
Cl3 Cl-1 0.26102 0.08802 0.76398 0.123
S1 S-2 0.333333 0.666667 0.52885 0.9999
