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#$Date: 2024-04-25 17:59:02 +0300 (Thu, 25 Apr 2024) $
#$Revision: 291351 $
#$URL: file:///home/coder/svn-repositories/cod/cif/9/00/40/9004074.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_9004074
loop_
_publ_author_name
'Hall, S. R.'
'Stewart, J. M.'
_publ_section_title
;
 The crystal structure of argentian pentlandite (Fe,Ni)8AgS8, compared with
 the refined structure of pentlandite (Fe,Ni)9S8
;
_journal_name_full               'The Canadian Mineralogist'
_journal_page_first              169
_journal_page_last               177
_journal_volume                  12
_journal_year                    1973
_chemical_formula_sum            'Ag Fe4.8 Ni3.2 S8'
_chemical_name_mineral           Argentopentlandite
_space_group_IT_number           225
_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_length_a                   10.521
_cell_length_b                   10.521
_cell_length_c                   10.521
_cell_formula_units_Z            4
_cell_volume                     1164.585
_database_code_amcsd             0005093
_exptl_crystal_density_diffrn    4.678
_cod_original_sg_symbol_H-M      'F m 3 m'
_cod_original_formula_sum        'Ag (Fe4.8 Ni3.2) S8'
_cod_database_code               9004074
loop_
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loop_
_atom_site_label
_atom_site_fract_x
_atom_site_fract_y
_atom_site_fract_z
_atom_site_occupancy
Ag1 0.50000 0.50000 0.50000 1.00000
Fe2 0.12690 0.12690 0.12690 0.60000
Ni2 0.12690 0.12690 0.12690 0.40000
S1 0.25000 0.25000 0.25000 1.00000
S2 0.24560 0.00000 0.00000 1.00000
loop_
_cod_related_entry_id
_cod_related_entry_database
_cod_related_entry_code
1 AMCSD 0005093
