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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/2/31/07/2310719.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_2310719
loop_
_publ_author_name
'Abrahams, S.C.'
'Grison, E.'
_publ_section_title
;
 The Crystal Structure of Cesium Hexasulfide
;
_journal_name_full               'Acta Crystallographica (1,1948-23,1967)'
_journal_page_first              206
_journal_page_last               213
_journal_volume                  6
_journal_year                    1953
_chemical_formula_sum            'Cs2 S6'
_space_group_IT_number           2
_symmetry_space_group_name_Hall  '-P 1'
_symmetry_space_group_name_H-M   'P -1'
_cell_angle_alpha                89.22
_cell_angle_beta                 95.2
_cell_angle_gamma                95.13
_cell_formula_units_Z            2
_cell_length_a                   11.53
_cell_length_b                   9.18
_cell_length_c                   4.67
_cell_volume                     490.284
_citation_journal_id_ASTM        ACCRA9
_cod_data_source_file            Abrahams_ACCRA9_1953_191.cif
_cod_data_source_block           Cs2S6
_cod_original_cell_volume        490.2843
_cod_database_code               2310719
loop_
_symmetry_equiv_pos_as_xyz
x,y,z
-x,-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
S6 S 0.33 0.387 0.5752 1 0.0
S3 S 0.214 -0.0146 0.8085 1 0.0
S4 S 0.369 0.027 0.6355 1 0.0
S2 S 0.102 -0.1379 0.5022 1 0.0
Cs1 Cs+1 0.0959 0.3237 0.05 1 0.0
S1 S 0.146 -0.3432 0.5312 1 0.0
Cs2 Cs+1 0.3849 -0.3103 0.1018 1 0.0
S5 S 0.3601 0.2086 0.3518 1 0.0
