#------------------------------------------------------------------------------
#$Date: 2024-05-16 09:36:09 +0300 (Thu, 16 May 2024) $
#$Revision: 291877 $
#$URL: file:///home/coder/svn-repositories/cod/cif/9/01/36/9013668.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_9013668
loop_
_publ_author_name
'Lenaz, D.'
'Logvinova, A. M.'
'Princivalle, F.'
'Sobolev, N. V.'
_publ_section_title
;
 Structural parameters of chromite included in diamond and kimberlites
 from Siberia: A new tool for discriminating ultramafic source
 Note: sample Inter-1
;
_journal_name_full               'American Mineralogists'
_journal_page_first              1067
_journal_page_last               1070
_journal_paper_doi               10.2138/am.2009.3165
_journal_volume                  94
_journal_year                    2009
_chemical_compound_source
'Internatsionalnaya mine, Malo-Botuobiya kimberlite field, Russia'
_chemical_formula_sum
'Al0.228 Cr1.7 Fe0.509 Mg0.547 Mn0.009 Ni0.002 O4 Ti0.004'
_chemical_name_mineral           Chromite
_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                   8.3293
_cell_length_b                   8.3293
_cell_length_c                   8.3293
_cell_formula_units_Z            8
_cell_volume                     577.864
_database_code_amcsd             0004965
_exptl_crystal_density_diffrn    4.622
_cod_original_sg_symbol_H-M      'F d 3 m'
_cod_original_formula_sum
'Mg.547 Mn.009 Fe.509 Al.228 Ti.004 Cr1.7 Ni.002 O4'
_cod_database_code               9013668
loop_
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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
MgT 0.12500 0.12500 0.12500 0.51900 0.00650
MnT 0.12500 0.12500 0.12500 0.00900 0.00650
Fe2+T 0.12500 0.12500 0.12500 0.43400 0.00650
Fe3+T 0.12500 0.12500 0.12500 0.03700 0.00650
MgM 0.50000 0.50000 0.50000 0.01400 0.00407
AlM 0.50000 0.50000 0.50000 0.11400 0.00407
TiM 0.50000 0.50000 0.50000 0.00200 0.00407
CrM 0.50000 0.50000 0.50000 0.85000 0.00407
Fe2+M 0.50000 0.50000 0.50000 0.00300 0.00407
Fe3+M 0.50000 0.50000 0.50000 0.01600 0.00407
NiM 0.50000 0.50000 0.50000 0.00100 0.00407
O 0.26213 0.26213 0.26213 1.00000 0.00560
loop_
_cod_related_entry_id
_cod_related_entry_database
_cod_related_entry_code
1 AMCSD 0004965
