#------------------------------------------------------------------------------
#$Date: 2024-05-02 13:48:35 +0300 (Thu, 02 May 2024) $
#$Revision: 291455 $
#$URL: file:///home/coder/svn-repositories/cod/cif/9/00/82/9008247.cif $
#------------------------------------------------------------------------------
#
# This file is available in the Crystallography Open Database (COD),
# http://www.crystallography.net/. The original data for this entry
# were provided the American Mineralogist Crystal Structure Database,
# http://rruff.geo.arizona.edu/AMS/amcsd.php
#
# 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_9008247
loop_
_publ_author_name
'Srikrishnan, T.'
'Nowacki, W.'
_publ_section_title
;
 A redetermination of the crystal structure of livingstonite, HgSb4S8
;
_journal_name_full               'Zeitschrift fur Kristallographie'
_journal_page_first              174
_journal_page_last               192
_journal_paper_doi               10.1524/zkri.1975.141.3-4.174
_journal_volume                  141
_journal_year                    1975
_chemical_compound_source        'Huitzuco, Guerrero, Mexico'
_chemical_formula_sum            'Hg S8 Sb4'
_chemical_name_mineral           Livingstonite
_space_group_IT_number           15
_symmetry_space_group_name_Hall  '-A 2ya'
_symmetry_space_group_name_H-M   'A 1 2/a 1'
_cell_angle_alpha                90
_cell_angle_beta                 103.39
_cell_angle_gamma                90
_cell_length_a                   30.567
_cell_length_b                   4.015
_cell_length_c                   21.465
_cell_formula_units_Z            8
_cell_volume                     2562.714
_database_code_amcsd             0010773
_exptl_crystal_density_diffrn    4.894
_cod_original_formula_sum        'Hg Sb4 S8'
_cod_database_code               9008247
loop_
_space_group_symop_operation_xyz
x,y,z
x,1/2+y,1/2+z
1/2+x,-y,z
1/2+x,1/2-y,1/2+z
1/2-x,y,-z
1/2-x,1/2+y,1/2-z
-x,-y,-z
-x,1/2-y,1/2-z
loop_
_atom_site_label
_atom_site_fract_x
_atom_site_fract_y
_atom_site_fract_z
Hg1 0.00000 0.50000 0.00000
Hg2 0.25000 0.00890 0.00000
Sb1 0.03950 0.06280 0.21150
Sb2 0.12440 0.05630 0.07790
Sb3 0.13550 0.05860 0.42810
Sb4 0.20570 0.10910 0.28470
S1 0.01480 0.00500 0.31690
S2 0.06420 0.51700 0.09790
S3 0.07570 0.51600 0.46250
S4 0.10770 0.50100 0.28810
S5 0.15270 0.51100 0.23000
S6 0.16980 0.52000 0.03520
S7 0.20600 0.51200 0.42160
S8 0.21770 0.02400 0.17950
loop_
_cod_related_entry_id
_cod_related_entry_database
_cod_related_entry_code
1 AMCSD 0010773
