#------------------------------------------------------------------------------
#$Date: 2017-01-22 03:02:13 +0200 (Sun, 22 Jan 2017) $
#$Revision: 190822 $
#$URL: file:///home/coder/svn-repositories/cod/cif/1/54/51/1545121.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_1545121
loop_
_publ_author_name
'Yamaguchi, G.'
'Miyabe, H.'
_publ_section_title
;
 Crystal structure of a defect spinel, CoO*3Al2O3, constituting cobalt
 blue pigment
;
_journal_name_full               Yogyo-Kyokai-Shi
_journal_page_first              87
_journal_page_last               89
_journal_volume                  83
_journal_year                    1975
_chemical_formula_sum            'Al2.4 Co0.4 O4'
_chemical_name_common            '(Co0.4Al0.4)Al2O4 defect spinel'
_space_group_IT_number           227
_space_group_name_H-M_alt        'F d -3 m'
_symmetry_space_group_name_Hall  'F 4d 2 3 -1d'
_symmetry_space_group_name_H-M   'F d -3 m :1'
_cell_angle_alpha                90
_cell_angle_beta                 90
_cell_angle_gamma                90
_cell_formula_units_Z            8
_cell_length_a                   7.97500
_cell_length_b                   7.97500
_cell_length_c                   7.97500
_cell_volume                     507.215
_cod_data_source_file            CoAl-defect-spinel.cif
_cod_data_source_block           AlCo-defect-spinel
_cod_original_formula_sum        'Co0.4 Al2.4 O4'
_cod_database_code               1545121
loop_
_space_group_symop_operation_xyz
'x, y, z'
'-x, -y+1/2, z+1/2'
'-x+1/2, y+1/2, -z'
'x+1/2, -y, -z+1/2'
'z, x, y'
'z+1/2, -x, -y+1/2'
'-z, -x+1/2, y+1/2'
'-z+1/2, x+1/2, -y'
'y, z, x'
'-y+1/2, z+1/2, -x'
'y+1/2, -z, -x+1/2'
'-y, -z+1/2, x+1/2'
'y+3/4, x+1/4, -z+3/4'
'-y+1/4, -x+1/4, -z+1/4'
'y+1/4, -x+3/4, z+3/4'
'-y+3/4, x+3/4, z+1/4'
'x+3/4, z+1/4, -y+3/4'
'-x+3/4, z+3/4, y+1/4'
'-x+1/4, -z+1/4, -y+1/4'
'x+1/4, -z+3/4, y+3/4'
'z+3/4, y+1/4, -x+3/4'
'z+1/4, -y+3/4, x+3/4'
'-z+3/4, y+3/4, x+1/4'
'-z+1/4, -y+1/4, -x+1/4'
'-x+1/4, -y+1/4, -z+1/4'
'x+1/4, y+3/4, -z+3/4'
'x+3/4, -y+3/4, z+1/4'
'-x+3/4, y+1/4, z+3/4'
'-z+1/4, -x+1/4, -y+1/4'
'-z+3/4, x+1/4, y+3/4'
'z+1/4, x+3/4, -y+3/4'
'z+3/4, -x+3/4, y+1/4'
'-y+1/4, -z+1/4, -x+1/4'
'y+3/4, -z+3/4, x+1/4'
'-y+3/4, z+1/4, x+3/4'
'y+1/4, z+3/4, -x+3/4'
'-y+1/2, -x, z+1/2'
'y, x, z'
'-y, x+1/2, -z+1/2'
'y+1/2, -x+1/2, -z'
'-x+1/2, -z, y+1/2'
'x+1/2, -z+1/2, -y'
'x, z, y'
'-x, z+1/2, -y+1/2'
'-z+1/2, -y, x+1/2'
'-z, y+1/2, -x+1/2'
'z+1/2, -y+1/2, -x'
'z, y, x'
'x, y+1/2, z+1/2'
'-x, -y, z'
'-x+1/2, y, -z+1/2'
'x+1/2, -y+1/2, -z'
'z, x+1/2, y+1/2'
'z+1/2, -x+1/2, -y'
'-z, -x, y'
'-z+1/2, x, -y+1/2'
'y, z+1/2, x+1/2'
'-y+1/2, z, -x+1/2'
'y+1/2, -z+1/2, -x'
'-y, -z, x'
'y+3/4, x+3/4, -z+1/4'
'-y+1/4, -x+3/4, -z+3/4'
'y+1/4, -x+1/4, z+1/4'
'-y+3/4, x+1/4, z+3/4'
'x+3/4, z+3/4, -y+1/4'
'-x+3/4, z+1/4, y+3/4'
'-x+1/4, -z+3/4, -y+3/4'
'x+1/4, -z+1/4, y+1/4'
'z+3/4, y+3/4, -x+1/4'
'z+1/4, -y+1/4, x+1/4'
'-z+3/4, y+1/4, x+3/4'
'-z+1/4, -y+3/4, -x+3/4'
'-x+1/4, -y+3/4, -z+3/4'
'x+1/4, y+1/4, -z+1/4'
'x+3/4, -y+1/4, z+3/4'
'-x+3/4, y+3/4, z+1/4'
'-z+1/4, -x+3/4, -y+3/4'
'-z+3/4, x+3/4, y+1/4'
'z+1/4, x+1/4, -y+1/4'
'z+3/4, -x+1/4, y+3/4'
'-y+1/4, -z+3/4, -x+3/4'
'y+3/4, -z+1/4, x+3/4'
'-y+3/4, z+3/4, x+1/4'
'y+1/4, z+1/4, -x+1/4'
'-y+1/2, -x+1/2, z'
'y, x+1/2, z+1/2'
'-y, x, -z'
'y+1/2, -x, -z+1/2'
'-x+1/2, -z+1/2, y'
'x+1/2, -z, -y+1/2'
'x, z+1/2, y+1/2'
'-x, z, -y'
'-z+1/2, -y+1/2, x'
'-z, y, -x'
'z+1/2, -y, -x+1/2'
'z, y+1/2, x+1/2'
'x+1/2, y, z+1/2'
'-x+1/2, -y+1/2, z'
'-x, y+1/2, -z+1/2'
'x, -y, -z'
'z+1/2, x, y+1/2'
'z, -x, -y'
'-z+1/2, -x+1/2, y'
'-z, x+1/2, -y+1/2'
'y+1/2, z, x+1/2'
'-y, z+1/2, -x+1/2'
'y, -z, -x'
'-y+1/2, -z+1/2, x'
'y+1/4, x+1/4, -z+1/4'
'-y+3/4, -x+1/4, -z+3/4'
'y+3/4, -x+3/4, z+1/4'
'-y+1/4, x+3/4, z+3/4'
'x+1/4, z+1/4, -y+1/4'
'-x+1/4, z+3/4, y+3/4'
'-x+3/4, -z+1/4, -y+3/4'
'x+3/4, -z+3/4, y+1/4'
'z+1/4, y+1/4, -x+1/4'
'z+3/4, -y+3/4, x+1/4'
'-z+1/4, y+3/4, x+3/4'
'-z+3/4, -y+1/4, -x+3/4'
'-x+3/4, -y+1/4, -z+3/4'
'x+3/4, y+3/4, -z+1/4'
'x+1/4, -y+3/4, z+3/4'
'-x+1/4, y+1/4, z+1/4'
'-z+3/4, -x+1/4, -y+3/4'
'-z+1/4, x+1/4, y+1/4'
'z+3/4, x+3/4, -y+1/4'
'z+1/4, -x+3/4, y+3/4'
'-y+3/4, -z+1/4, -x+3/4'
'y+1/4, -z+3/4, x+3/4'
'-y+1/4, z+1/4, x+1/4'
'y+3/4, z+3/4, -x+1/4'
'-y, -x, z'
'y+1/2, x, z+1/2'
'-y+1/2, x+1/2, -z'
'y, -x+1/2, -z+1/2'
'-x, -z, y'
'x, -z+1/2, -y+1/2'
'x+1/2, z, y+1/2'
'-x+1/2, z+1/2, -y'
'-z, -y, x'
'-z+1/2, y+1/2, -x'
'z, -y+1/2, -x+1/2'
'z+1/2, y, x+1/2'
'x+1/2, y+1/2, z'
'-x+1/2, -y, z+1/2'
'-x, y, -z'
'x, -y+1/2, -z+1/2'
'z+1/2, x+1/2, y'
'z, -x+1/2, -y+1/2'
'-z+1/2, -x, y+1/2'
'-z, x, -y'
'y+1/2, z+1/2, x'
'-y, z, -x'
'y, -z+1/2, -x+1/2'
'-y+1/2, -z, x+1/2'
'y+1/4, x+3/4, -z+3/4'
'-y+3/4, -x+3/4, -z+1/4'
'y+3/4, -x+1/4, z+3/4'
'-y+1/4, x+1/4, z+1/4'
'x+1/4, z+3/4, -y+3/4'
'-x+1/4, z+1/4, y+1/4'
'-x+3/4, -z+3/4, -y+1/4'
'x+3/4, -z+1/4, y+3/4'
'z+1/4, y+3/4, -x+3/4'
'z+3/4, -y+1/4, x+3/4'
'-z+1/4, y+1/4, x+1/4'
'-z+3/4, -y+3/4, -x+1/4'
'-x+3/4, -y+3/4, -z+1/4'
'x+3/4, y+1/4, -z+3/4'
'x+1/4, -y+1/4, z+1/4'
'-x+1/4, y+3/4, z+3/4'
'-z+3/4, -x+3/4, -y+1/4'
'-z+1/4, x+3/4, y+3/4'
'z+3/4, x+1/4, -y+3/4'
'z+1/4, -x+1/4, y+1/4'
'-y+3/4, -z+3/4, -x+1/4'
'y+1/4, -z+1/4, x+1/4'
'-y+1/4, z+3/4, x+3/4'
'y+3/4, z+1/4, -x+3/4'
'-y, -x+1/2, z+1/2'
'y+1/2, x+1/2, z'
'-y+1/2, x, -z+1/2'
'y, -x, -z'
'-x, -z+1/2, y+1/2'
'x, -z, -y'
'x+1/2, z+1/2, y'
'-x+1/2, z, -y+1/2'
'-z, -y+1/2, x+1/2'
'-z+1/2, y, -x+1/2'
'z, -y, -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
AlCo1 0.1600 0.250000 0.250000 0.250000 Biso 1.330000 Al
AlCo1 0.0900 0.250000 0.250000 0.250000 Biso 1.330000 Co
AlCo2 0.4400 0.625000 0.625000 0.625000 Biso 1.330000 Al
AlCo2 0.0100 0.625000 0.625000 0.625000 Biso 1.330000 Co
O 1.0 0.38000(13) 0.38000(13) 0.38000(13) Biso 1.330000 O
