#------------------------------------------------------------------------------
#$Date: 2024-04-25 17:59:02 +0300 (Thu, 25 Apr 2024) $
#$Revision: 291351 $
#$URL: file:///home/coder/svn-repositories/cod/cif/9/00/49/9004945.cif $
#------------------------------------------------------------------------------
#
# This file is available in the Crystallography Open Database (COD),
# http://www.crystallography.net/. The original data for this entry
# were provided the American Mineralogist Crystal Structure Database,
# http://rruff.geo.arizona.edu/AMS/amcsd.php
#
# The file may be used within the scientific community so long as
# proper attribution is given to the journal article from which the
# data were obtained.
#
data_9004945
loop_
_publ_author_name
'Lenaz, D.'
'Princivalle, F.'
_publ_section_title
;
 The crystal chemistry of detrital chromian spinel from the
 southeastern Alps and Outer Dinarides: The discrimination of
 supplies from areas of similar tectonic setting?
 Sample: BK 36
;
_journal_name_full               'The Canadian Mineralogist'
_journal_page_first              1305
_journal_page_last               1314
_journal_paper_doi               10.2113/gscanmin.43.4.1305
_journal_volume                  43
_journal_year                    2005
_chemical_formula_sum
'Al1.264 Cr0.652 Fe0.346 Mg0.722 Ni0.005 O4 Ti0.011'
_chemical_name_mineral           Spinel
_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_length_a                   8.1904
_cell_length_b                   8.1904
_cell_length_c                   8.1904
_cell_formula_units_Z            8
_cell_volume                     549.434
_database_code_amcsd             0006043
_exptl_crystal_density_diffrn    4.103
_cod_original_sg_symbol_H-M      'F d -3 m'
_cod_original_formula_sum
'Al1.264 Fe.346 Mg.722 Cr.652 Ni.005 Ti.011 O4'
_cod_database_code               9004945
loop_
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1/4-y,1/2+z,3/4-x
1/4-y,+z,1/4-x
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loop_
_atom_site_label
_atom_site_fract_x
_atom_site_fract_y
_atom_site_fract_z
_atom_site_occupancy
_atom_site_U_iso_or_equiv
AlT 0.12500 0.12500 0.12500 0.13100 0.00460
Fe2+T 0.12500 0.12500 0.12500 0.27100 0.00460
Fe3+T 0.12500 0.12500 0.12500 0.01800 0.00460
MgT 0.12500 0.12500 0.12500 0.58000 0.00460
AlM 0.50000 0.50000 0.50000 0.56650 0.00670
Fe2+M 0.50000 0.50000 0.50000 0.00400 0.00670
Fe3+M 0.50000 0.50000 0.50000 0.02450 0.00670
MgM 0.50000 0.50000 0.50000 0.07100 0.00670
CrM 0.50000 0.50000 0.50000 0.32600 0.00670
NiM 0.50000 0.50000 0.50000 0.00250 0.00670
TiM 0.50000 0.50000 0.50000 0.00550 0.00670
O 0.26235 0.26235 0.26235 1.00000 0.00790
loop_
_cod_related_entry_id
_cod_related_entry_database
_cod_related_entry_code
1 AMCSD 0006043
