#------------------------------------------------------------------------------
#$Date: 2016-02-13 20:28:24 +0100 (Sat, 13 Feb 2016) $
#$Revision: 176429 $
#$URL: svn://saulius.grazulis.lt/cod-secondary/cif/1/53/73/1537383.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_1537383
loop_
_publ_author_name
'Hahn, H.'
'de Lorent, V.'
_publ_section_title
;
 Ueber ternaere Chalkogenide des Chroms mit einwertigem Kupfer und Silber
;
_journal_name_full
'Zeitschrift fuer Anorganische und Allgemeine Chemie'
_journal_page_first              68
_journal_page_last               81
_journal_volume                  290
_journal_year                    1957
_chemical_formula_sum            'Cr Cu S2'
_chemical_name_systematic        'Cu Cr S2'
_space_group_IT_number           160
_symmetry_space_group_name_Hall  'R 3 -2"'
_symmetry_space_group_name_H-M   'R 3 m :H'
_cell_angle_alpha                90
_cell_angle_beta                 90
_cell_angle_gamma                120
_cell_formula_units_Z            3
_cell_length_a                   3.492
_cell_length_b                   3.492
_cell_length_c                   18.87
_cell_volume                     199.274
_citation_journal_id_ASTM        ZAACAB
_cod_data_source_file            Hahn_ZAACAB_1957_855.cif
_cod_data_source_block           Cr1Cu1S2
_cod_original_cell_volume        199.2742
_cod_original_formula_sum        'Cr1 Cu1 S2'
_cod_database_code               1537383
loop_
_symmetry_equiv_pos_as_xyz
x,y,z
-y,x-y,z
-x+y,-x,z
-y,-x,z
x,x-y,z
-x+y,y,z
x+2/3,y+1/3,z+1/3
-y+2/3,x-y+1/3,z+1/3
-x+y+2/3,-x+1/3,z+1/3
-y+2/3,-x+1/3,z+1/3
x+2/3,x-y+1/3,z+1/3
-x+y+2/3,y+1/3,z+1/3
x+1/3,y+2/3,z+2/3
-y+1/3,x-y+2/3,z+2/3
-x+y+1/3,-x+2/3,z+2/3
-y+1/3,-x+2/3,z+2/3
x+1/3,x-y+2/3,z+2/3
-x+y+1/3,y+2/3,z+2/3
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
S2 S-2 0 0 0.26 1 0.0
Cr1 Cr+3 0 0 0.86 1 0.0
S1 S-2 0 0 0.13 1 0.0
Cu1 Cu+1 0 0 0 1 0.0
