#------------------------------------------------------------------------------
#$Date: 2015-10-14 13:56:12 +0200 (Wed, 14 Oct 2015) $
#$Revision: 168571 $
#$URL: svn://saulius.grazulis.lt/cod-secondary/cif/1/53/96/1539612.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_1539612
loop_
_publ_author_name
'Averdunk, F.'
'Hoppe, R.'
_publ_section_title
;
 Zur Kenntnis von Cs4 Fe3 F10 sowie Cs3 Tl Ni3 F10
;
_journal_name_full
'Zeitschrift fuer Anorganische und Allgemeine Chemie'
_journal_page_first              115
_journal_page_last               122
_journal_volume                  562
_journal_year                    1988
_chemical_formula_sum            'Cs4 F10 Fe3'
_chemical_name_systematic        'Cs4 Fe3 F10'
_space_group_IT_number           64
_symmetry_space_group_name_Hall  '-C 2ac 2'
_symmetry_space_group_name_H-M   'C m c a'
_cell_angle_alpha                90
_cell_angle_beta                 90
_cell_angle_gamma                90
_cell_formula_units_Z            4
_cell_length_a                   6.298
_cell_length_b                   14.613
_cell_length_c                   14.114
_cell_volume                     1298.949
_citation_journal_id_ASTM        ZAACAB
_cod_data_source_file            Averdunk_ZAACAB_1988_8.cif
_cod_data_source_block           Cs4F10Fe3
_cod_database_code               1539612
loop_
_symmetry_equiv_pos_as_xyz
x,y,z
-x+1/2,-y,z+1/2
x,-y,-z
-x+1/2,y,-z+1/2
-x,-y,-z
x-1/2,y,-z-1/2
-x,y,z
x-1/2,-y,z-1/2
x+1/2,y+1/2,z
-x+1,-y+1/2,z+1/2
x+1/2,-y+1/2,-z
-x+1,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+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
Cs1 Cs+1 0 0.25669 0.39329 1 0.0
Cs2 Cs+1 0 0.45805 0.13885 1 0.0
F3 F-1 0 0.4779 0.3537 1 0.0
Fe1 Fe+2 0 0.12421 0.15532 1 0.0
F2 F-1 0.25 0.1179 0.25 1 0.0
Fe2 Fe+2 0 0 0 1 0.0
F4 F-1 0 0.2578 0.1434 1 0.0
F1 F-1 0.2159 0.1002 0.0363 1 0.0
