#------------------------------------------------------------------------------
#$Date: 2024-05-23 12:45:01 +0300 (Thu, 23 May 2024) $
#$Revision: 292002 $
#$URL: file:///home/coder/svn-repositories/cod/cif/9/01/49/9014958.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_9014958
loop_
_publ_author_name
'Dehlinger, U.'
'Glocker, R.'
_publ_section_title
;
 Die Kristallstruktur des Calciumcarbides.
 _cod_database_code 1010500
;
_journal_name_full               'Zeitschrift fur Kristallographie'
_journal_page_first              296
_journal_page_last               302
_journal_volume                  64
_journal_year                    1926
_chemical_formula_sum            'C2 Ca'
_space_group_IT_number           201
_symmetry_space_group_name_Hall  'P 2 2 3 -1n'
_symmetry_space_group_name_H-M   'P n -3 :1'
_cell_angle_alpha                90
_cell_angle_beta                 90
_cell_angle_gamma                90
_cell_length_a                   5.73
_cell_length_b                   5.73
_cell_length_c                   5.73
_cell_formula_units_Z            4
_cell_volume                     188.133
_database_code_amcsd             0017416
_exptl_crystal_density_diffrn    2.263
_cod_duplicate_entry             1010500
_cod_original_sg_symbol_H-M      'P n 3'
_cod_original_formula_sum        'Ca C2'
_cod_database_code               9014958
_amcsd_formula_title             CaC2
loop_
_space_group_symop_operation_xyz
x,y,z
1/2+z,1/2+x,1/2-y
1/2+z,1/2-x,1/2+y
1/2-z,1/2+x,1/2+y
1/2-z,1/2-x,1/2-y
y,-z,-x
-y,-z,x
-y,z,-x
y,z,x
1/2+x,1/2-y,1/2+z
1/2-x,1/2+y,1/2+z
1/2+x,1/2+y,1/2-z
1/2-x,1/2-y,1/2-z
-z,-x,y
-z,x,-y
z,-x,-y
z,x,y
1/2-y,1/2+z,1/2+x
1/2+y,1/2+z,1/2-x
1/2+y,1/2-z,1/2+x
1/2-y,1/2-z,1/2-x
-x,y,-z
x,-y,-z
-x,-y,z
loop_
_atom_site_label
_atom_site_fract_x
_atom_site_fract_y
_atom_site_fract_z
Ca1 0.25000 0.25000 0.25000
C1 -0.10000 -0.10000 -0.10000
loop_
_cod_related_entry_id
_cod_related_entry_database
_cod_related_entry_code
1 AMCSD 0017416
