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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/1/52/11/1521123.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_1521123
loop_
_publ_author_name
'Hasegawa, K.'
'Nishibori, E.'
'Yu, J.'
'Sakata, M.'
'Takata, M.'
'Togashi, N.'
'Terasaki, O.'
_publ_section_title
;
 A synchrotron powder diffraction study of Na-LTA
;
_journal_name_full               'Japanese Journal of Applied Physics, Part 1'
_journal_page_first              65
_journal_page_last               68
_journal_volume                  38
_journal_year                    1999
_chemical_formula_sum            'Al96 H78.34 Na94.75 O423.17 Si96'
_chemical_name_systematic        'Na94.75 (Al96 Si96 O384) (H2 O)39.17'
_space_group_IT_number           226
_symmetry_space_group_name_Hall  '-F 4a 2 3'
_symmetry_space_group_name_H-M   'F m -3 c'
_cell_angle_alpha                90
_cell_angle_beta                 90
_cell_angle_gamma                90
_cell_formula_units_Z            1
_cell_length_a                   24.5528
_cell_length_b                   24.5528
_cell_length_c                   24.5528
_cell_volume                     14801.410
_citation_journal_id_ASTM        JAPNDE
_cod_data_source_file            Hasegawa_JAPNDE_1999_60.cif
_cod_data_source_block           H78.34Al96Na94.75O423.17Si96
_cod_original_cell_volume        14801.41
_cod_original_formula_sum        'H78.34 Al96 Na94.75 O423.17 Si96'
_cod_database_code               1521123
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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
H1 H+1 0.175 0.22597 0.22597 0.102 0.0
O4 O-2 0.154 0.25 0.25 0.204 0.0
Na3 Na+1 0.129 0.129 0.25 0.072 0.0
Na2 Na+1 0 0.226 0.213 0.25 0.0
O1 O-2 0 0.1122 0.2444 1 0.0
O5 O-2 0.047 0.269 0.287 0.153 0.0
H2 H+1 0.047 0.269 0.287 0.306 0.0
Si1 Si+4 0 0.0931 0.1851 1 0.0
Al1 Al+3 0 0.1874 0.0903 1 0.0
O2 O-2 0 0.1493 0.1419 1 0.0
O3 O-2 0.0511 0.0616 0.1711 1 0.0
Na1 Na+1 0.1014 0.1014 0.1014 0.9975 0.0
