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#$Date: 2024-05-02 13:48:35 +0300 (Thu, 02 May 2024) $
#$Revision: 291455 $
#$URL: file:///home/coder/svn-repositories/cod/cif/9/00/80/9008017.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_9008017
loop_
_publ_author_name
'Pauling, L.'
'Weinbaum, S.'
_publ_section_title
;
 The crystal structure of enargite, Cu3AsS4
 Locality: Philippine Islands
;
_journal_name_full               'Zeitschrift fur Kristallographie'
_journal_page_first              48
_journal_page_last               53
_journal_volume                  88
_journal_year                    1934
_chemical_formula_sum            'As Cu3 S4'
_chemical_name_mineral           Enargite
_space_group_IT_number           31
_symmetry_space_group_name_Hall  'P 2bc -2bc'
_symmetry_space_group_name_H-M   'P n m 21'
_cell_angle_alpha                90
_cell_angle_beta                 90
_cell_angle_gamma                90
_cell_length_a                   6.46
_cell_length_b                   7.43
_cell_length_c                   6.18
_cell_formula_units_Z            2
_cell_volume                     296.626
_exptl_crystal_density_diffrn    4.409
_cod_original_formula_sum        'Cu3 As S4'
_cod_database_code               9008017
loop_
_symmetry_equiv_pos_as_xyz
x,y,z
-x,1/2+y,1/2+z
x,-y,z
-x,1/2-y,1/2+z
loop_
_atom_site_label
_atom_site_fract_x
_atom_site_fract_y
_atom_site_fract_z
Cu1 0.16500 0.00000 0.50000
Cu2 0.33300 0.24500 0.99000
As 0.82000 0.00000 0.00000
S1 0.83000 0.00000 0.36000
S2 0.14000 0.00000 0.87500
S3 0.33000 0.25500 0.36700
_cod_duplicate_entry 1011011
