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#$Date: 2023-04-10 23:38:45 +0300 (Mon, 10 Apr 2023) $
#$Revision: 282548 $
#$URL: file:///home/coder/svn-repositories/cod/cif/5/00/00/5000087.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_5000087
loop_
_publ_author_name
'Noda, Y.'
'Masumoto, K.'
'Ohba, S.'
'Saito, Y.'
'Toriumi, K.'
'Iwata, Y.'
'Shibuya, I.'
_publ_section_title
;Temperature dependence of atomic thermal parameters of lead chalcogenides,
 PbS, PbSe and PbTe Locality: synthetic Sample: T = 200 K
;
_journal_name_full               'Acta Crystallographica, Section C'
_journal_page_first              1443
_journal_page_last               1445
_journal_paper_doi               10.1107/S0108270187091509
_journal_volume                  43
_journal_year                    1987
_chemical_compound_source        Synthetic
_chemical_formula_sum            'Pb S'
_chemical_name_mineral           Galena
_chemical_name_systematic        'Lead sulfide'
_space_group_IT_number           225
_symmetry_cell_setting           cubic
_symmetry_space_group_name_Hall  '-F 4 2 3'
_symmetry_space_group_name_H-M   'F m -3 m'
_cell_angle_alpha                90
_cell_angle_beta                 90
_cell_angle_gamma                90
_cell_formula_units_Z            4
_cell_length_a                   5.9237(3)
_cell_length_b                   5.9237(3)
_cell_length_c                   5.9237(3)
_cell_volume                     207.864(18)
_database_code_amcsd             0010044
_diffrn_ambient_temperature      200
_exptl_crystal_density_diffrn    7.646
_exptl_crystal_density_meas      7.57
_refine_ls_R_factor_all          0.05
_cod_data_source_file            cifdata.txt
_cod_data_source_block           'global_9388'
_cod_original_sg_symbol_H-M      'F m 3 m'
_cod_database_code               5000087
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loop_
_atom_site_label
_atom_site_fract_x
_atom_site_fract_y
_atom_site_fract_z
_atom_site_U_iso_or_equiv
Pb 0.00000 0.00000 0.00000 0.01115
S 0.50000 0.50000 0.50000 0.01127
loop_
_cod_related_entry_id
_cod_related_entry_database
_cod_related_entry_code
1 AMCSD 0010044
