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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/1/52/65/1526589.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_1526589
loop_
_publ_author_name
'Seryotkin, Yu.V.'
'Bakakin, V.V.'
'Bazhan, I.S.'
_publ_section_title
;
 Crystal structure of lithium-sodium (Li0.7 Na0.3)-analcime
;
_journal_name_full
'Zhurnal Strukturnoi Khimii (Issue-No. from 1981)'
_journal_page_first              607
_journal_page_last               611
_journal_volume                  42
_journal_year                    2001
_chemical_formula_sum            'Al1.84 H4 Li1.29 Na0.518 O14 Si4.16'
_chemical_name_systematic        'Li1.29 Na0.518 (Al1.84 Si4.16 O12) (H2 O)2'
_space_group_IT_number           73
_symmetry_space_group_name_Hall  '-I 2b 2c'
_symmetry_space_group_name_H-M   'I b c a'
_cell_angle_alpha                90
_cell_angle_beta                 90
_cell_angle_gamma                90
_cell_formula_units_Z            8
_cell_length_a                   13.546
_cell_length_b                   13.546
_cell_length_c                   13.557
_cell_volume                     2487.630
_citation_journal_id_ASTM        ZSTKAI
_cod_data_source_file            Seryotkin_ZSTKAI_2001_1746.cif
_cod_data_source_block           H4Al1.84Li1.29Na0.518O14Si4.16
_cod_original_cell_volume        2487.63
_cod_original_formula_sum        'H4 Al1.84 Li1.29 Na0.518 O14 Si4.16'
_cod_database_code               1526589
loop_
_symmetry_equiv_pos_as_xyz
x,y,z
-x,-y+1/2,z
x,-y,-z+1/2
-x,y+1/2,-z+1/2
-x,-y,-z
x,y-1/2,-z
-x,y,z-1/2
x,-y-1/2,z-1/2
x+1/2,y+1/2,z+1/2
-x+1/2,-y+1,z+1/2
x+1/2,-y+1/2,-z+1
-x+1/2,y+1,-z+1
-x+1/2,-y+1/2,-z+1/2
x+1/2,y,-z+1/2
-x+1/2,y+1/2,z
x+1/2,-y,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
O6 O-2 0.4699 0.3833 0.145 1 0.0
O1 O-2 0.104 0.3642 0.2204 1 0.0
O4 O-2 0.147 0.4681 0.384 1 0.0
O5 O-2 0.3663 0.2207 0.1055 1 0.0
Na1 Na+1 0.1268 0 0.25 0.143 0.0
Li3 Li+1 0 0.25 0.1259 0.43 0.0
Li1 Li+1 0.1268 0 0.25 0.43 0.0
Na3 Na+1 0 0.25 0.1259 0.207 0.0
Al3 Al+3 0.16224 0.41225 0.12493 0.42 0.0
Li2 Li+1 0.25 0.1247 0 0.43 0.0
O7 O-2 0.1243 0.1263 0.1252 1 0.0
Na2 Na+1 0.25 0.1247 0 0.168 0.0
Al1 Al+3 0.12468 0.16169 0.41184 0.23 0.0
O2 O-2 0.3855 0.1459 0.4708 1 0.0
Si3 Si+4 0.16224 0.41225 0.12493 0.58 0.0
Si1 Si+4 0.12468 0.16169 0.41184 0.77 0.0
Si2 Si+4 0.41163 0.12583 0.16225 0.73 0.0
Al2 Al+3 0.41163 0.12583 0.16225 0.27 0.0
O3 O-2 0.2188 0.1043 0.3663 1 0.0
