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#$Date: 2012-02-28 17:44:07 +0200 (Tue, 28 Feb 2012) $
#$Revision: 35913 $
#$URL: file:///home/coder/svn-repositories/cod/cif/9/01/09/9010925.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_9010925
loop_
_publ_author_name
'Olsen, L. A.'
'Balic-Zunic T'
'Makovicky, E.'
'Ullrich, A.'
'Miletich, R.'
_publ_section_title
;
 Hydrostatic compression of galenobismutite (PbBi2S4): elastic properties and
 high-pressure crystal chemistry
 Locality: synthetic
 Sample: P = 8.92 GPa
;
_journal_name_full               'Physics and Chemistry of Minerals'
_journal_page_first              467
_journal_page_last               475
_journal_volume                  34
_journal_year                    2007
_chemical_formula_sum            'Bi2 Pb S4'
_chemical_name_mineral           Galenobismutite
_space_group_IT_number           62
_symmetry_space_group_name_Hall  '-P 2c 2n'
_symmetry_space_group_name_H-M   'P n a m'
_cell_angle_alpha                90
_cell_angle_beta                 90
_cell_angle_gamma                90
_cell_length_a                   11.2863
_cell_length_b                   13.8907
_cell_length_c                   3.9233
_cell_volume                     615.074
_diffrn_ambient_pressure         8.92e+06
_exptl_crystal_density_diffrn    8.136
_cod_database_code               9010925
_amcsd_database_code             AMCSD#0009034
loop_
_symmetry_equiv_pos_as_xyz
x,y,z
x,y,1/2-z
-x,-y,1/2+z
1/2-x,1/2+y,1/2+z
1/2+x,1/2-y,1/2-z
1/2+x,1/2-y,z
1/2-x,1/2+y,-z
-x,-y,-z
loop_
_atom_site_label
_atom_site_fract_x
_atom_site_fract_y
_atom_site_fract_z
_atom_site_U_iso_or_equiv
Bi1 0.06170 0.39259 0.25000 0.01220
Bi2 0.11290 0.90847 0.25000 0.01270
Pb 0.26280 0.65216 0.25000 0.01590
S1 0.33120 0.01860 0.25000 0.01300
S2 0.25990 0.29670 0.25000 0.01200
S3 0.05330 0.09910 0.25000 0.01300
S4 0.02050 0.71310 0.25000 0.01300