#------------------------------------------------------------------------------
#$Date: 2018-09-27 07:13:35 +0300 (Thu, 27 Sep 2018) $
#$Revision: 211196 $
#$URL: file:///home/coder/svn-repositories/cod/cif/1/52/52/1525280.cif $
#------------------------------------------------------------------------------
#
# This file is available in the Crystallography Open Database (COD),
# http://www.crystallography.net/
#
# All data on this site have been placed in the public domain by the
# contributors.
#
data_1525280
loop_
_publ_author_name
'Siebert, G.'
'Hoppe, R.'
_publ_section_title
;
 Ternaere Fluoride mit vierwertigem Chrom: M(II) Cr F6 mit M(II)= Ba, Sr,
 Ca, Mg, Zn, Cd, Hg, Ni
;
_journal_name_full
'Zeitschrift fuer Anorganische und Allgemeine Chemie'
_journal_page_first              126
_journal_page_last               136
_journal_volume                  391
_journal_year                    1972
_chemical_formula_sum            'Ca Cr F6'
_space_group_IT_number           148
_symmetry_space_group_name_Hall  '-R 3'
_symmetry_space_group_name_H-M   'R -3 :H'
_cell_angle_alpha                90
_cell_angle_beta                 90
_cell_angle_gamma                120
_cell_formula_units_Z            3
_cell_length_a                   5.336
_cell_length_b                   5.336
_cell_length_c                   14.153
_cell_volume                     348.988
_citation_journal_id_ASTM        ZAACAB
_cod_data_source_file            Siebert_ZAACAB_1972_1885.cif
_cod_data_source_block           Ca1Cr1F6
_cod_original_cell_volume        348.9882
_cod_original_formula_sum        'Ca1 Cr1 F6'
_cod_database_code               1525280
loop_
_symmetry_equiv_pos_as_xyz
x,y,z
-y,x-y,z
-x+y,-x,z
-x,-y,-z
y,-x+y,-z
x-y,x,-z
x+2/3,y+1/3,z+1/3
-y+2/3,x-y+1/3,z+1/3
-x+y+2/3,-x+1/3,z+1/3
-x+2/3,-y+1/3,-z+1/3
y+2/3,-x+y+1/3,-z+1/3
x-y+2/3,x+1/3,-z+1/3
x+1/3,y+2/3,z+2/3
-y+1/3,x-y+2/3,z+2/3
-x+y+1/3,-x+2/3,z+2/3
-x+1/3,-y+2/3,-z+2/3
y+1/3,-x+y+2/3,-z+2/3
x-y+1/3,x+2/3,-z+2/3
loop_
_atom_site_label
_atom_site_type_symbol
_atom_site_fract_x
_atom_site_fract_y
_atom_site_fract_z
_atom_site_occupancy
_atom_site_U_iso_or_equiv
Cr1 Cr+4 0 0 0 1 0.0
Ca1 Ca+2 0 0 0.5 1 0.0
F1 F-1 0.295 0 -0.075 1 0.0
