#------------------------------------------------------------------------------
#$Date: 2016-10-29 11:13:35 +0300 (Sat, 29 Oct 2016) $
#$Revision: 187684 $
#$URL: file:///home/coder/svn-repositories/cod/cif/1/54/44/1544408.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_1544408
loop_
_publ_author_name
'Hayakawa, H.'
'Akiba, E.'
'Ono, S.'
'Ihara, H.'
'Izumi, F.'
'Asano, H.'
_publ_section_title
;
 Refinement of the crystal strcutures of Cu6O8InCl and Cu6O8Cu2Cl by
 neutron powder diffraction
;
_journal_name_full               'Journal of the Ceramic Society of Japan'
_journal_page_first              745
_journal_page_last               751
_journal_volume                  101
_journal_year                    1993
_chemical_formula_sum            'Cl Cu6 In O8'
_chemical_name_common            Cu6O8InCl
_space_group_IT_number           225
_space_group_name_H-M_alt        'F m -3 m'
_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                   9.1555(2)
_cell_length_b                   9.1555(2)
_cell_length_c                   9.1555(2)
_cell_volume                     767.44(3)
_cod_data_source_file            Cu6O8InCl.cif
_cod_data_source_block           Cu6O8InCl
_cod_original_formula_sum        'Cu6 O8 In Cl'
_cod_database_code               1544408
loop_
_space_group_symop_operation_xyz
'x, y, z'
'-x, -y, -z'
'-x, -y, z'
'x, y, -z'
'-x, y, -z'
'x, -y, z'
'x, -y, -z'
'-x, y, z'
'z, x, y'
'-z, -x, -y'
'z, -x, -y'
'-z, x, y'
'-z, -x, y'
'z, x, -y'
'-z, x, -y'
'z, -x, y'
'y, z, x'
'-y, -z, -x'
'-y, z, -x'
'y, -z, x'
'y, -z, -x'
'-y, z, x'
'-y, -z, x'
'y, z, -x'
'y, x, -z'
'-y, -x, z'
'-y, -x, -z'
'y, x, z'
'y, -x, z'
'-y, x, -z'
'-y, x, z'
'y, -x, -z'
'x, z, -y'
'-x, -z, y'
'-x, z, y'
'x, -z, -y'
'-x, -z, -y'
'x, z, y'
'x, -z, y'
'-x, z, -y'
'z, y, -x'
'-z, -y, x'
'z, -y, x'
'-z, y, -x'
'-z, y, x'
'z, -y, -x'
'-z, -y, -x'
'z, y, x'
'x, y+1/2, z+1/2'
'-x, -y+1/2, -z+1/2'
'-x, -y+1/2, z+1/2'
'x, y+1/2, -z+1/2'
'-x, y+1/2, -z+1/2'
'x, -y+1/2, z+1/2'
'x, -y+1/2, -z+1/2'
'-x, y+1/2, z+1/2'
'z, x+1/2, y+1/2'
'-z, -x+1/2, -y+1/2'
'z, -x+1/2, -y+1/2'
'-z, x+1/2, y+1/2'
'-z, -x+1/2, y+1/2'
'z, x+1/2, -y+1/2'
'-z, x+1/2, -y+1/2'
'z, -x+1/2, y+1/2'
'y, z+1/2, x+1/2'
'-y, -z+1/2, -x+1/2'
'-y, z+1/2, -x+1/2'
'y, -z+1/2, x+1/2'
'y, -z+1/2, -x+1/2'
'-y, z+1/2, x+1/2'
'-y, -z+1/2, x+1/2'
'y, z+1/2, -x+1/2'
'y, x+1/2, -z+1/2'
'-y, -x+1/2, z+1/2'
'-y, -x+1/2, -z+1/2'
'y, x+1/2, z+1/2'
'y, -x+1/2, z+1/2'
'-y, x+1/2, -z+1/2'
'-y, x+1/2, z+1/2'
'y, -x+1/2, -z+1/2'
'x, z+1/2, -y+1/2'
'-x, -z+1/2, y+1/2'
'-x, z+1/2, y+1/2'
'x, -z+1/2, -y+1/2'
'-x, -z+1/2, -y+1/2'
'x, z+1/2, y+1/2'
'x, -z+1/2, y+1/2'
'-x, z+1/2, -y+1/2'
'z, y+1/2, -x+1/2'
'-z, -y+1/2, x+1/2'
'z, -y+1/2, x+1/2'
'-z, y+1/2, -x+1/2'
'-z, y+1/2, x+1/2'
'z, -y+1/2, -x+1/2'
'-z, -y+1/2, -x+1/2'
'z, y+1/2, x+1/2'
'x+1/2, y, z+1/2'
'-x+1/2, -y, -z+1/2'
'-x+1/2, -y, z+1/2'
'x+1/2, y, -z+1/2'
'-x+1/2, y, -z+1/2'
'x+1/2, -y, z+1/2'
'x+1/2, -y, -z+1/2'
'-x+1/2, y, z+1/2'
'z+1/2, x, y+1/2'
'-z+1/2, -x, -y+1/2'
'z+1/2, -x, -y+1/2'
'-z+1/2, x, y+1/2'
'-z+1/2, -x, y+1/2'
'z+1/2, x, -y+1/2'
'-z+1/2, x, -y+1/2'
'z+1/2, -x, y+1/2'
'y+1/2, z, x+1/2'
'-y+1/2, -z, -x+1/2'
'-y+1/2, z, -x+1/2'
'y+1/2, -z, x+1/2'
'y+1/2, -z, -x+1/2'
'-y+1/2, z, x+1/2'
'-y+1/2, -z, x+1/2'
'y+1/2, z, -x+1/2'
'y+1/2, x, -z+1/2'
'-y+1/2, -x, z+1/2'
'-y+1/2, -x, -z+1/2'
'y+1/2, x, z+1/2'
'y+1/2, -x, z+1/2'
'-y+1/2, x, -z+1/2'
'-y+1/2, x, z+1/2'
'y+1/2, -x, -z+1/2'
'x+1/2, z, -y+1/2'
'-x+1/2, -z, y+1/2'
'-x+1/2, z, y+1/2'
'x+1/2, -z, -y+1/2'
'-x+1/2, -z, -y+1/2'
'x+1/2, z, y+1/2'
'x+1/2, -z, y+1/2'
'-x+1/2, z, -y+1/2'
'z+1/2, y, -x+1/2'
'-z+1/2, -y, x+1/2'
'z+1/2, -y, x+1/2'
'-z+1/2, y, -x+1/2'
'-z+1/2, y, x+1/2'
'z+1/2, -y, -x+1/2'
'-z+1/2, -y, -x+1/2'
'z+1/2, y, x+1/2'
'x+1/2, y+1/2, z'
'-x+1/2, -y+1/2, -z'
'-x+1/2, -y+1/2, z'
'x+1/2, y+1/2, -z'
'-x+1/2, y+1/2, -z'
'x+1/2, -y+1/2, z'
'x+1/2, -y+1/2, -z'
'-x+1/2, y+1/2, z'
'z+1/2, x+1/2, y'
'-z+1/2, -x+1/2, -y'
'z+1/2, -x+1/2, -y'
'-z+1/2, x+1/2, y'
'-z+1/2, -x+1/2, y'
'z+1/2, x+1/2, -y'
'-z+1/2, x+1/2, -y'
'z+1/2, -x+1/2, y'
'y+1/2, z+1/2, x'
'-y+1/2, -z+1/2, -x'
'-y+1/2, z+1/2, -x'
'y+1/2, -z+1/2, x'
'y+1/2, -z+1/2, -x'
'-y+1/2, z+1/2, x'
'-y+1/2, -z+1/2, x'
'y+1/2, z+1/2, -x'
'y+1/2, x+1/2, -z'
'-y+1/2, -x+1/2, z'
'-y+1/2, -x+1/2, -z'
'y+1/2, x+1/2, z'
'y+1/2, -x+1/2, z'
'-y+1/2, x+1/2, -z'
'-y+1/2, x+1/2, z'
'y+1/2, -x+1/2, -z'
'x+1/2, z+1/2, -y'
'-x+1/2, -z+1/2, y'
'-x+1/2, z+1/2, y'
'x+1/2, -z+1/2, -y'
'-x+1/2, -z+1/2, -y'
'x+1/2, z+1/2, y'
'x+1/2, -z+1/2, y'
'-x+1/2, z+1/2, -y'
'z+1/2, y+1/2, -x'
'-z+1/2, -y+1/2, x'
'z+1/2, -y+1/2, x'
'-z+1/2, y+1/2, -x'
'-z+1/2, y+1/2, x'
'z+1/2, -y+1/2, -x'
'-z+1/2, -y+1/2, -x'
'z+1/2, y+1/2, x'
loop_
_atom_site_label
_atom_site_occupancy
_atom_site_fract_x
_atom_site_fract_y
_atom_site_fract_z
_atom_site_adp_type
_atom_site_B_iso_or_equiv
_atom_site_type_symbol
Cu 1.0 0.000000 0.250000 0.250000 Biso 0.480000 Cu
In 0.9800 0.000000 0.000000 0.000000 Biso 0.540000 In
Cl 1.0 0.500000 0.500000 0.500000 Biso 2.720000 Cl
O 1.0 0.14232(5) 0.14232(5) 0.14232(5) Biso 0.490000 O
