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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/1/53/58/1535859.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_1535859
loop_
_publ_author_name
'Nagornyi, P.G.'
'Tret'yak, S.M.'
'Kornienko, Z.I.'
'Kapshuk, A.A.'
'Mitkevich, V.V.'
_publ_section_title
;
 Synthesis and structure of new fluorophosphate Na5Cr(PO4)2F2
;
_journal_name_full               'Zhurnal Neorganicheskoi Khimii'
_journal_page_first              839
_journal_page_last               842
_journal_volume                  35
_journal_year                    1990
_chemical_formula_sum            'Cr F2 Na5 O8 P2'
_chemical_name_systematic        'Na5 Cr (P O4)2 F2'
_space_group_IT_number           143
_symmetry_space_group_name_Hall  'P 3'
_symmetry_space_group_name_H-M   'P 3'
_cell_angle_alpha                90
_cell_angle_beta                 90
_cell_angle_gamma                120
_cell_formula_units_Z            3
_cell_length_a                   10.576
_cell_length_b                   10.576
_cell_length_c                   6.669
_cell_volume                     646.003
_citation_journal_id_ASTM        ZNOKAQ
_cod_data_source_file            Nagornyi_ZNOKAQ_1990_986.cif
_cod_data_source_block           Cr1F2Na5O8P2
_cod_original_cell_volume        646.0026
_cod_original_formula_sum        'Cr1 F2 Na5 O8 P2'
_cod_database_code               1535859
loop_
_symmetry_equiv_pos_as_xyz
x,y,z
-y,x-y,z
-x+y,-x,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
Na2 Na+1 0.352 0.1651 0.2385 1 0.0
Na4 Na+1 0 0 0.4387 1 0.0
O7 O-2 0.2342 0.0707 -0.4401 1 0.0
Na5 Na+1 0.3333 0.6667 0.581 1 0.0
Na9 Na+1 0.3333 0.6667 0.0283 1 0.0
P2 P+5 0.2948 0.1458 -0.2502 1 0.0
O1 O-2 0.4124 0.5043 0.4598 1 0.0
Cr1 Cr+3 0.1675 0.3343 0 1 0.0
P1 P+5 0.4823 0.5163 0.2502 1 0.0
Na6 Na+1 0.6667 0.3333 0.5076 1 0.0
F1 F-1 0.1827 0.4717 -0.1985 1 0.0
Na3 Na+1 0.1692 0.3339 0.4994 1 0.0
O8 O-2 0.4632 0.2334 -0.2342 1 0.0
O5 O-2 0.2502 0.2601 -0.2061 1 0.0
O4 O-2 0.3694 0.4634 0.0807 1 0.0
F2 F-1 0.1438 0.1908 0.2014 1 0.0
Na1 Na+1 0.4932 0.477 0.7598 1 0.0
Na8 Na+1 0 0 -0.0039 1 0.0
O6 O-2 0.2296 0.0354 -0.0707 1 0.0
O2 O-2 0.5561 0.4241 0.2551 1 0.0
Na7 Na+1 0.6667 0.3333 -0.0068 1 0.0
O3 O-2 0.5856 0.6844 0.2118 1 0.0
