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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/1/54/15/1541587.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_1541587
loop_
_publ_author_name
'Stout, M.Z.'
'Bayliss, P.'
_publ_section_title
;
 Crystal Structure of a Natural Titanomagnetite
;
_journal_name_full               'Canadian Mineralogist'
_journal_page_first              86
_journal_page_last               88
_journal_volume                  13
_journal_year                    1975
_chemical_formula_sum
'Al0.7 Cr0.3 Fe17.485 Mg0.4 Mn0.114 O32 Si0.06 Ti4.72 V0.15'
_chemical_name_systematic
;
(Fe4.42 Fe5.245 Ti4.72 Al0.7 Mg0.4 Cr0.3 V.15) (Fe7.82 Mn.114 Si0.06) O32
;
_space_group_IT_number           227
_symmetry_space_group_name_Hall  '-F 4vw 2vw 3'
_symmetry_space_group_name_H-M   'F d -3 m :2'
_cell_angle_alpha                90
_cell_angle_beta                 90
_cell_angle_gamma                90
_cell_formula_units_Z            1
_cell_length_a                   8.3976
_cell_length_b                   8.3976
_cell_length_c                   8.3976
_cell_volume                     592.196
_citation_journal_id_ASTM        CAMIA6
_cod_data_source_file            Stout_CAMIA6_1975_272.cif
_cod_data_source_block
Al0.7Cr0.3Fe17.485Mg0.4Mn0.114O32Si0.06Ti4.72V0.15
_cod_original_cell_volume        592.1962
_cod_original_formula_sum
;
Al0.7 Cr0.3 Fe17.485 Mg0.4 Mn0.114 O32 Si0.06 Ti4.72 V0.15
;
_cod_database_code               1541587
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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
Fe1 Fe+2 0.125 0.125 0.125 0.978 0.0
Al1 Al+3 0.5 0.5 0.5 0.044 0.0
Mg1 Mg+2 0.5 0.5 0.5 0.025 0.0
Mn1 Mn+2 0.125 0.125 0.125 0.014 0.0
O1 O-2 0.26277 0.26277 0.26277 1 0.0
V1 V+3 0.5 0.5 0.5 0.01 0.0
Fe3 Fe+3 0.5 0.5 0.5 0.3278 0.0
Fe2 Fe+2 0.5 0.5 0.5 0.2763 0.0
Si1 Si+4 0.125 0.125 0.125 0.008 0.0
Cr1 Cr+3 0.5 0.5 0.5 0.019 0.0
Ti1 Ti+4 0.5 0.5 0.5 0.295 0.0
