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#$Date: 2016-02-13 21:28:24 +0200 (Sat, 13 Feb 2016) $
#$Revision: 176429 $
#$URL: svn://www.crystallography.net/cod/cif/1/54/14/1541473.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_1541473
loop_
_publ_author_name
'Kocharov, A.G.'
'Faek, M.K.'
'Yamzin, I.I.'
_publ_section_title
;
 Neutron-Diffraction Determination of the Oxygen Parameter and the Cation
 Distribution for the Ferrite Spinels Ni Sc.15 Fe1.85 O4 and Ni Sc.4 Fe1.6
 O4
;
_journal_name_full               Kristallografiya
_journal_page_first              634
_journal_page_last               634
_journal_volume                  16
_journal_year                    1971
_chemical_formula_sum            'Fe1.85 Ni O4 Sc0.15'
_chemical_name_systematic        'Ni Sc.15 Fe1.85 O4'
_space_group_IT_number           227
_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                   8.45
_cell_length_b                   8.45
_cell_length_c                   8.45
_cell_volume                     603.351
_citation_journal_id_ASTM        KRISAJ
_cod_data_source_file            Kocharov_KRISAJ_1971_194.cif
_cod_data_source_block           Fe1.85Ni1O4Sc0.15
_cod_original_cell_volume        603.3511
_cod_original_sg_symbol_Hall     '-F 4vw 2vw 3 (x+1/8,y+1/8,z+1/8)'
_cod_original_formula_sum        'Fe1.85 Ni1 O4 Sc0.15'
_cod_database_code               1541473
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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
Fe2 Fe+3 0.625 0.625 0.625 0.425 0.0
Sc1 Sc+3 0.625 0.625 0.625 0.075 0.0
Fe1 Fe+3 0 0 0 1 0.0
O1 O-2 0.3794 0.3794 0.3794 1 0.0
Ni1 Ni+2 0.625 0.625 0.625 0.5 0.0
