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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/1/53/23/1532316.cif $
#------------------------------------------------------------------------------
#
# This file is available in the Crystallography Open Database (COD),
# http://www.crystallography.net/
#
# All data on this site have been placed in the public domain by the
# contributors.
#
data_1532316
loop_
_publ_author_name
'Will, G.'
'Hinze, E.'
'Abdel Rahman, A.M.'
_publ_section_title
;
 Crystal structure analysis and refinement of digenite, Cu1.8 S, in the
 temperature range 20 to 500 C under controlled sulfur partial pressure
;
_journal_name_full               'European Journal of Mineralogy (1,1989-)'
_journal_page_first              591
_journal_page_last               598
_journal_volume                  14
_journal_year                    2002
_chemical_formula_sum            'Cu2 S'
_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_formula_units_Z            4
_cell_length_a                   5.762
_cell_length_b                   5.762
_cell_length_c                   5.762
_cell_volume                     191.302
_citation_journal_id_ASTM        EJMIER
_cod_data_source_file            Will_EJMIER_2002_687.cif
_cod_data_source_block           Cu2S1
_cod_original_cell_volume        191.3021
_cod_original_formula_sum        'Cu2 S1'
_cod_database_code               1532316
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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
Cu2 Cu+1 0.5 0.5 0.5 0.095 0.0
Cu3 Cu+1 0.1067 0.166 0.2826 0.029 0.0
S1 S-2 0 0 0 1 0.0
Cu1 Cu+1 0.25 0.25 0.25 0.2575 0.0
