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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/2/10/73/2107395.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_2107395
loop_
_publ_author_name
'Chapuis, G.'
'Gnehm, C.'
'Kraemer, V.'
_publ_section_title
;
 Crystal structure and crystal chemistry of bismuth indium sulphide, Bi2
 In4 S9
;
_journal_name_full               'Acta Crystallographica B (24,1968-38,1982)'
_journal_page_first              3128
_journal_page_last               3130
_journal_volume                  28
_journal_year                    1972
_chemical_formula_sum            'Bi2 In4 S9'
_space_group_IT_number           11
_symmetry_space_group_name_Hall  '-P 2yb'
_symmetry_space_group_name_H-M   'P 1 21/m 1'
_cell_angle_alpha                90
_cell_angle_beta                 94.044
_cell_angle_gamma                90
_cell_formula_units_Z            2
_cell_length_a                   16.167
_cell_length_b                   3.917
_cell_length_c                   11.111
_cell_volume                     701.865
_citation_journal_id_ASTM        ACBCAR
_cod_data_source_file            Chapuis_ACBCAR_1972_680.cif
_cod_data_source_block           Bi2In4S9
_cod_original_cell_volume        701.8649
_cod_database_code               2107395
loop_
_symmetry_equiv_pos_as_xyz
x,y,z
-x,y+1/2,-z
-x,-y,-z
x,-y-1/2,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
In2 In+3 0.405 0.25 0.5068 1 0.0
S1 S-2 0.259 0.25 0.3755 1 0.0
Bi1 Bi+3 0.1015 0.25 0.1082 1 0.0
S7 S-2 0.9424 0.25 0.0902 1 0.0
S9 S-2 0.9191 0.25 0.7301 1 0.0
S4 S-2 0.5452 0.25 0.6279 1 0.0
S6 S-2 0.918 0.25 0.4141 1 0.0
Bi2 Bi+3 0.4207 0.25 0.1339 1 0.0
S3 S-2 0.4329 0.25 0.9002 1 0.0
In1 In+3 0.6837 0.25 0.1418 1 0.0
S8 S-2 0.6892 0.25 0.9044 1 0.0
S5 S-2 0.6581 0.25 0.3679 1 0.0
In4 In+3 0.0798 0.25 0.7326 1 0.0
In3 In+3 0.7886 0.25 0.5142 1 0.0
S2 S-2 0.2167 0.25 0.8495 1 0.0
