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#$Date: 2016-01-24 01:37:48 +0200 (Sun, 24 Jan 2016) $
#$Revision: 174874 $
#$URL: svn://www.crystallography.net/cod/cif/1/52/96/1529627.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_1529627
loop_
_publ_author_name
'Bennett, B. A.'
'Shahbandeh, M. R.'
'Streat, M.'
_publ_section_title
;
 Sorption of cesium by complex hexacyanoferrates: II. X-ray
 crystallography and Mössbauer spectroscopy of sodium-copper
 cyanoferrates (II)
;
_journal_issue                   5
_journal_name_full
'Journal of Chemical Technology and Biotechnology'
_journal_page_first              586
_journal_page_last               593
_journal_paper_doi               10.1002/jctb.5030320506
_journal_volume                  32
_journal_year                    1982
_chemical_formula_sum            'C12 Cu3.52 Fe2 N12 Na0.95'
_chemical_name_systematic        'Na.95 Cu3.52 (Fe (C N)6)2'
_space_group_IT_number           225
_symmetry_space_group_name_Hall  '-F 4 2 3'
_symmetry_space_group_name_H-M   'F m -3 m'
_cell_angle_alpha                90
_cell_angle_beta                 90
_cell_angle_gamma                90
_cell_formula_units_Z            2
_cell_length_a                   9.5
_cell_length_b                   9.5
_cell_length_c                   9.5
_cell_volume                     857.375
_citation_journal_id_ASTM        JCTBDC
_cod_data_source_file            Bennett_JCTBDC_1982_806.cif
_cod_data_source_block           C12Cu3.52Fe2N12Na0.95
_cod_database_code               1529627
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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
C1 C+2 0.201 0 0 1 0.0
Cu1 Cu+2 0 0.5 0 1 0.0
Na1 Na+1 0.25 0.25 0.25 0.235 0.0
Cu2 Cu+2 0.25 0.25 0.25 0.38 0.0
N1 N-3 0.317 0 0 1 0.0
Fe1 Fe+2 0 0 0 1 0.0
