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#$Date: 2024-05-16 09:36:09 +0300 (Thu, 16 May 2024) $
#$Revision: 291877 $
#$URL: file:///home/coder/svn-repositories/cod/cif/9/01/25/9012564.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_9012564
loop_
_publ_author_name
'Christensen, A. N.'
_publ_section_title
;
 The temperature factor parameters of some transition metal carbides and
 nitrides by single crystal X-ray and neutron diffraction
;
_journal_name_full               'Acta Chemica Scandinavica A'
_journal_page_first              89
_journal_page_last               90
_journal_volume                  32
_journal_year                    1978
_chemical_compound_source        Synthetic
_chemical_formula_sum            'C Ti'
_chemical_name_mineral           Khamrabaevite
_space_group_IT_number           225
_symmetry_space_group_name_Hall  '-F 4 2 3'
_symmetry_space_group_name_H-M   'F m -3 m'
_cell_angle_alpha                90
_cell_angle_beta                 90
_cell_angle_gamma                90
_cell_length_a                   4.328
_cell_length_b                   4.328
_cell_length_c                   4.328
_cell_formula_units_Z            4
_cell_volume                     81.070
_database_code_amcsd             0011949
_exptl_crystal_density_diffrn    4.907
_cod_original_sg_symbol_H-M      'F m 3 m'
_cod_original_formula_sum        'Ti C'
_cod_database_code               9012564
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loop_
_atom_site_label
_atom_site_fract_x
_atom_site_fract_y
_atom_site_fract_z
_atom_site_U_iso_or_equiv
Ti 0.00000 0.00000 0.00000 0.00329
C 0.50000 0.50000 0.50000 0.00557
loop_
_cod_related_entry_id
_cod_related_entry_database
_cod_related_entry_code
1 AMCSD 0011949
