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#$Date: 2016-02-13 20:28:24 +0100 (Sat 13 de Feb de 2016) $
#$Revision: 176429 $
#$URL: svn://www.crystallography.net/cod/cif/1/53/03/1530372.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_1530372
loop_
_publ_author_name
'Matvienko, E.N.'
'Yakubovich, O.V.'
'Simonov, M.A.'
'Ivashchenko, A.N.'
'Belov, N.V.'
'Mel'nikov, O.K.'
_publ_section_title
;
 The crystal structure of the synthetic Fe-cryolite Na3 Fe F6
;
_journal_name_full               'Doklady Akademii Nauk SSSR'
_journal_page_first              105
_journal_page_last               108
_journal_volume                  257
_journal_year                    1981
_chemical_formula_sum            'F6 Fe Na3'
_chemical_name_systematic        'Na3 (Fe F6)'
_space_group_IT_number           4
_symmetry_space_group_name_Hall  'P 2yb'
_symmetry_space_group_name_H-M   'P 1 21 1'
_cell_angle_alpha                90
_cell_angle_beta                 90.42
_cell_angle_gamma                90
_cell_formula_units_Z            2
_cell_length_a                   5.514
_cell_length_b                   5.734
_cell_length_c                   7.973
_cell_volume                     252.078
_citation_journal_id_ASTM        DANKAS
_cod_data_source_file            Matvienko_DANKAS_1981_1042.cif
_cod_data_source_block           F6Fe1Na3
_cod_original_cell_volume        252.0778
_cod_original_formula_sum        'F6 Fe1 Na3'
_cod_database_code               1530372
loop_
_symmetry_equiv_pos_as_xyz
x,y,z
-x,y+1/2,-z
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
Fe1 Fe+3 0.2495 0.492 0.2508 1 0.0
Na3 Na+1 0.769 0.43 0.4981 1 0.0
F1 F-1 0.371 0.545 0.4767 1 0.0
F6 F-1 0.417 0.767 0.174 1 0.0
Na1 Na+1 0.753 0 0.2512 1 0.0
F3 F-1 0.086 0.206 0.3146 1 0.0
F4 F-1 0.14 0.432 0.0237 1 0.0
F5 F-1 0.955 0.657 0.2967 1 0.0
F2 F-1 0.529 0.305 0.1938 1 0.0
Na2 Na+1 0.739 0.544 0.0007 1 0.0
