#------------------------------------------------------------------------------
#$Date: 2016-02-13 20:28:24 +0100 (Sat 13 de Feb de 2016) $
#$Revision: 176429 $
#$URL: svn://www.crystallography.net/cod/cif/1/53/64/1536415.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_1536415
loop_
_publ_author_name
'Palkina, K.K.'
'Maksimova, S.I.'
'Chudinova, N.N.'
'Chibiskova, N.T.'
'Karmanovskaya, N.B.'
_publ_section_title
;
 Double ultraphosphates Na3 M(III) P8 O23 (M(III)= Ga, Al)
;
_journal_name_full
'Izvestiya Akademii Nauk SSSR, Neorganicheskie Materialy'
_journal_page_first              119
_journal_page_last               120
_journal_volume                  29
_journal_year                    1993
_chemical_formula_sum            'Al Na3 O23 P8'
_chemical_name_systematic        'Na3 Al (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                   11.87
_cell_length_b                   11.87
_cell_length_c                   11.87
_cell_volume                     1672.446
_citation_journal_id_ASTM        IVNMAW
_cod_data_source_file            Palkina_IVNMAW_1993_1444.cif
_cod_data_source_block           Al1Na3O23P8
_cod_original_formula_sum        'Al1 Na3 O23 P8'
_cod_database_code               1536415
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
Al1 Al+3 0.625 0.875 0.125 1 0.0
O4 O-2 0.3138 0.0712 0.2372 1 0.0
O1 O-2 0.0341 0.1219 0.635 1 0.0
P1 P+5 0.1371 0.1456 0.5695 1 0.0
O2 O-2 0.4209 0.0121 0.4076 1 0.0
Na1 Na+1 0.875 0.542 0.208 1 0.0
O5 O-2 0.0891 0.0891 0.0891 1 0.0
O3 O-2 0.875 0.765 -0.015 1 0.0
P2 P+5 0.0191 0.0191 0.0191 1 0.0
