#------------------------------------------------------------------------------
#$Date: 2024-05-16 09:36:09 +0300 (Thu, 16 May 2024) $
#$Revision: 291877 $
#$URL: file:///home/coder/svn-repositories/cod/cif/9/01/25/9012588.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_9012588
loop_
_publ_author_name
'Ownby, P. D.'
'Yang, X.'
'Liu, J.'
_publ_section_title
;
 Calculated X-ray diffraction data for diamond polytypes
 Note: cubic, 3C structure
 Note: theoretically calculated structure values
;
_journal_name_full               'Journal of the American Ceramic Society'
_journal_page_first              1876
_journal_page_last               1883
_journal_paper_doi               10.1111/j.1151-2916.1992.tb07211.x
_journal_volume                  75
_journal_year                    1992
_chemical_formula_sum            C
_chemical_name_common            Carbon
_chemical_name_mineral           Carbon
_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_length_a                   3.5667
_cell_length_b                   3.5667
_cell_length_c                   3.5667
_cell_formula_units_Z            8
_cell_volume                     45.373
_database_code_amcsd             0014065
_exptl_crystal_density_diffrn    3.517
_cod_original_sg_symbol_H-M      'F d 3 m'
_cod_database_code               9012588
loop_
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1/4+z,1/4-x,1/4+y
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1/4+x,3/4-y,3/4+z
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loop_
_atom_site_label
_atom_site_fract_x
_atom_site_fract_y
_atom_site_fract_z
C 0.50000 0.50000 0.50000
loop_
_cod_related_entry_id
_cod_related_entry_database
_cod_related_entry_code
1 AMCSD 0014065
