#------------------------------------------------------------------------------
#$Date: 2024-05-29 17:00:33 +0300 (Wed, 29 May 2024) $
#$Revision: 292100 $
#$URL: file:///home/coder/svn-repositories/cod/cif/9/01/57/9015781.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_9015781
loop_
_publ_author_name
'Brasseur, H.'
'de Rassenfosse, A.'
_publ_section_title
;
Structure cristalline des cyanures doubles de baryum a base de platine,
de palladium et de nickel
;
_journal_coden_ASTM              BSFMAU
_journal_name_full
;
 Bulletin de la Societe Francaise de Mineralogie
;
_journal_page_first              129
_journal_page_last               136
_journal_volume                  61
_journal_year                    1938
_chemical_formula_sum            'C4 H8 Ba N4 Ni O4'
_space_group_IT_number           15
_symmetry_space_group_name_Hall  '-C 2yc'
_symmetry_space_group_name_H-M   'C 1 2/c 1'
_cell_angle_alpha                90
_cell_angle_beta                 104.83
_cell_angle_gamma                90
_cell_length_a                   11.71
_cell_length_b                   13.48
_cell_length_c                   6.63
_cell_formula_units_Z            4
_cell_volume                     1011.690
_exptl_crystal_density_diffrn    2.023
_cod_duplicate_entry             1010320
_cod_original_formula_sum        'Ba Ni C4 O4'
_cod_database_code               9015781
loop_
_space_group_symop_operation_xyz
x,y,z
1/2+x,1/2+y,z
x,-y,1/2+z
1/2+x,1/2-y,1/2+z
-x,y,1/2-z
1/2-x,1/2+y,1/2-z
-x,-y,-z
1/2-x,1/2-y,-z
loop_
_atom_site_label
_atom_site_fract_x
_atom_site_fract_y
_atom_site_fract_z
Ba1 0.00000 0.36700 0.25000
Ni1 0.00000 0.00000 0.00000
C1 0.09300 0.17800 0.54400
C2 0.21300 0.07800 0.09400
O1 0.14600 0.30800 0.98800
O2 0.44200 0.05800 0.83700
loop_
_cod_related_entry_id
_cod_related_entry_database
_cod_related_entry_code
1 AMCSD 0017246
