#------------------------------------------------------------------------------
#$Date: 2016-02-13 20:28:24 +0100 (Sat, 13 Feb 2016) $
#$Revision: 176429 $
#$URL: svn://saulius.grazulis.lt/cod-secondary/cif/1/54/11/1541132.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_1541132
loop_
_publ_author_name
'Pilchowski, I.'
'Gruehn, R.'
'Mewis, A.'
'Wenzel, M.'
_publ_section_title
;
 Ba Cu8 P4 und Ba Cu8 As4: Darstellung, Strukturbestimmung und
 elektronenmikroskopische Untersuchungen
;
_journal_name_full
'Zeitschrift fuer Anorganische und Allgemeine Chemie'
_journal_page_first              109
_journal_page_last               116
_journal_volume                  588
_journal_year                    1990
_chemical_formula_sum            'As4 Ba Cu8'
_chemical_name_systematic        'Ba Cu8 As4'
_space_group_IT_number           87
_symmetry_space_group_name_Hall  '-I 4'
_symmetry_space_group_name_H-M   'I 4/m'
_cell_angle_alpha                90
_cell_angle_beta                 90
_cell_angle_gamma                90
_cell_formula_units_Z            2
_cell_length_a                   10.455
_cell_length_b                   10.455
_cell_length_c                   3.969
_cell_volume                     433.840
_citation_journal_id_ASTM        ZAACAB
_cod_data_source_file            Pilchowski_ZAACAB_1990_1294.cif
_cod_data_source_block           As4Ba1Cu8
_cod_original_cell_volume        433.8396
_cod_original_formula_sum        'As4 Ba1 Cu8'
_cod_database_code               1541132
loop_
_symmetry_equiv_pos_as_xyz
x,y,z
-y,x,z
-x,-y,z
y,-x,z
-x,-y,-z
y,-x,-z
x,y,-z
-y,x,-z
x+1/2,y+1/2,z+1/2
-y+1/2,x+1/2,z+1/2
-x+1/2,-y+1/2,z+1/2
y+1/2,-x+1/2,z+1/2
-x+1/2,-y+1/2,-z+1/2
y+1/2,-x+1/2,-z+1/2
x+1/2,y+1/2,-z+1/2
-y+1/2,x+1/2,-z+1/2
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 0.0179 0.3712 0 1 0.0
Cu1 Cu+1 0.215 0.672 0 1 0.0
Ba1 Ba+2 0 0 0 1 0.0
As1 As-3 0.242 0.4289 0 1 0.0
