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#$Date: 2016-02-13 21:28:24 +0200 (Sat, 13 Feb 2016) $
#$Revision: 176429 $
#$URL: svn://www.crystallography.net/cod/cif/1/52/72/1527271.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_1527271
loop_
_publ_author_name
'Dance, J.M.'
'Tressaud, A.'
'Massa, W.'
'Babel, D.'
_publ_section_title
;
 Crystal structure of sodium iron tetrafluoride, Na Fe F4
;
_journal_name_full               'Journal of Chemical Research (Synopsis)'
_journal_page_first              202
_journal_page_last               203
_journal_volume                  1981
_journal_year                    1981
_chemical_formula_sum            'F4 Fe Na'
_chemical_name_systematic        'Na Fe F4'
_space_group_IT_number           14
_symmetry_space_group_name_Hall  '-P 2ybc'
_symmetry_space_group_name_H-M   'P 1 21/c 1'
_cell_angle_alpha                90
_cell_angle_beta                 101.92
_cell_angle_gamma                90
_cell_formula_units_Z            4
_cell_length_a                   7.908
_cell_length_b                   5.351
_cell_length_c                   7.531
_cell_volume                     311.808
_citation_journal_id_ASTM        JRPSDC
_cod_data_source_file            Dance_JRPSDC_1981_1489.cif
_cod_data_source_block           F4Fe1Na1
_cod_original_cell_volume        311.8079
_cod_original_formula_sum        'F4 Fe1 Na1'
_cod_database_code               1527271
loop_
_symmetry_equiv_pos_as_xyz
x,y,z
-x,y+1/2,-z+1/2
-x,-y,-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
F1 F-1 0.1679 0.15181 0.04813 1 0.0
F4 F-1 0.31903 0.98551 0.37104 1 0.0
F3 F-1 0.367 0.46479 0.314 1 0.0
Fe1 Fe+3 0.17253 0.25566 0.29853 1 0.0
F2 F-1 0.0319 0.54923 0.20916 1 0.0
Na1 Na+1 0.37109 0.77706 0.10648 1 0.0
