#------------------------------------------------------------------------------
#$Date: 2016-02-13 21:28:24 +0200 (Sat, 13 Feb 2016) $
#$Revision: 176429 $
#$URL: svn://www.crystallography.net/cod/cif/1/52/98/1529824.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_1529824
loop_
_publ_author_name
'Ducourant, M.B.'
'Fourcade, R.'
'Mascherpa, G.'
_publ_section_title
;
 Sur les compsoes chlorofluores de l'antimoine III: etude structurale de
 Cs Sb Cl F3
;
_journal_name_full               'Journal of Fluorine Chemistry'
_journal_page_first              149
_journal_page_last               157
_journal_volume                  11
_journal_year                    1978
_chemical_formula_sum            'Cl Cs F3 Sb'
_chemical_name_systematic        'Cs Sb Cl F3'
_space_group_IT_number           121
_symmetry_space_group_name_Hall  'I -4 2'
_symmetry_space_group_name_H-M   'I -4 2 m'
_cell_angle_alpha                90
_cell_angle_beta                 90
_cell_angle_gamma                90
_cell_formula_units_Z            8
_cell_length_a                   9.92
_cell_length_b                   9.92
_cell_length_c                   11.606
_cell_volume                     1142.105
_citation_journal_id_ASTM        JFLCAR
_cod_data_source_file            Ducourant_JFLCAR_1978_295.cif
_cod_data_source_block           Cl1Cs1F3Sb1
_cod_original_formula_sum        'Cl1 Cs1 F3 Sb1'
_cod_database_code               1529824
loop_
_symmetry_equiv_pos_as_xyz
x,y,z
y,-x,-z
-x,-y,z
-y,x,-z
x,-y,-z
-y,-x,z
-x,y,-z
y,x,z
x+1/2,y+1/2,z+1/2
y+1/2,-x+1/2,-z+1/2
-x+1/2,-y+1/2,z+1/2
-y+1/2,x+1/2,-z+1/2
x+1/2,-y+1/2,-z+1/2
-y+1/2,-x+1/2,z+1/2
-x+1/2,y+1/2,-z+1/2
y+1/2,x+1/2,z+1/2
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
F1 F-1 0.277 0.277 0.187 1 0.0
Cs1 Cs+1 0 0 0.692 1 0.0
F2 F-1 0.223 0.03 0.117 1 0.0
Sb1 Sb+3 0.2047 0.2047 0.0423 1 0.0
Cl1 Cl-1 0.288 0 0.5 1 0.0
Cs2 Cs+1 0 0.5 0.25 1 0.0
