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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/1/53/60/1536051.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_1536051
loop_
_publ_author_name
'Chudinova, N.N.'
'Murashova, E.V.'
'Karmanovskaya, N.B.'
_publ_section_title
;
 Double ultraphosphates Na3 M P8 O23(M=Cr, V, Mn, Al, Ga). Synthesis and
 crystal structure
;
_journal_name_full               'Zhurnal Neorganicheskoi Khimii'
_journal_page_first              1769
_journal_page_last               1772
_journal_volume                  39
_journal_year                    1994
_chemical_formula_sum            'Cr Na3 O23 P8'
_chemical_name_systematic        'Na3 (Cr P8 O23)'
_space_group_IT_number           213
_symmetry_space_group_name_Hall  'P 4bd 2ab 3'
_symmetry_space_group_name_H-M   'P 41 3 2'
_cell_angle_alpha                90
_cell_angle_beta                 90
_cell_angle_gamma                90
_cell_formula_units_Z            4
_cell_length_a                   11.905
_cell_length_b                   11.905
_cell_length_c                   11.905
_cell_volume                     1687.284
_citation_journal_id_ASTM        ZNOKAQ
_cod_data_source_file            Chudinova_ZNOKAQ_1994_1460.cif
_cod_data_source_block           Cr1Na3O23P8
_cod_original_formula_sum        'Cr1 Na3 O23 P8'
_cod_database_code               1536051
loop_
_symmetry_equiv_pos_as_xyz
x,y,z
-y+1/4,x+3/4,z+1/4
-x+1/2,-y,z+1/2
y+1/4,-x+1/4,z+3/4
x+1/2,-y+1/2,-z
y+3/4,x+1/4,-z+1/4
-x,y+1/2,-z+1/2
-y+3/4,-x+3/4,-z+3/4
z,x,y
-x+1/4,z+3/4,y+1/4
-z+1/2,-x,y+1/2
x+1/4,-z+1/4,y+3/4
z+1/2,-x+1/2,-y
x+3/4,z+1/4,-y+1/4
-z,x+1/2,-y+1/2
-x+3/4,-z+3/4,-y+3/4
y,z,x
y+1/2,-z+1/2,-x
z+3/4,y+1/4,-x+1/4
-y,z+1/2,-x+1/2
-z+3/4,-y+3/4,-x+3/4
-y+1/2,-z,x+1/2
z+1/4,-y+1/4,x+3/4
-z+1/4,y+3/4,x+1/4
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
O2 O-2 0.4225 0.008 0.4053 1 0.0
Na1 Na+1 0.125 0.0431 0.2931 1 0.0
O1 O-2 0.0394 0.1204 0.6376 1 0.0
Cr1 Cr+3 0.375 0.375 0.375 1 0.0
O4 O-2 0.3127 0.0691 0.2373 1 0.0
O3 O-2 0.125 0.2676 0.5176 1 0.0
P2 P+5 0.0192 0.0192 0.0192 1 0.0
O5 O-2 0.09 0.09 0.09 1 0.0
P1 P+5 0.1402 0.1456 0.5692 1 0.0
