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#$Date: 2016-01-23 21:04:01 +0100 (Sat 23 de Jan de 2016) $
#$Revision: 174859 $
#$URL: svn://www.crystallography.net/cod/cif/1/53/39/1533900.cif $
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#
# 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_1533900
loop_
_publ_author_name
'Olson, D. H.'
'Mikovsky, R. J.'
'Dempsey, E.'
'Shipman, G. F.'
_publ_section_title
;
 Tellurium-loaded zeolites. III. The structure of Te/Na X
;
_journal_issue                   1
_journal_name_full               'Journal of Catalysis'
_journal_page_first              161
_journal_page_last               169
_journal_paper_doi               10.1016/0021-9517(72)90020-6
_journal_volume                  24
_journal_year                    1972
_chemical_formula_sum            'Al54 Na64 O384 Si138 Te5'
_chemical_name_systematic        'Na64 Al54 Si138 O384 Te5'
_space_group_IT_number           227
_symmetry_space_group_name_Hall  '-F 4vw 2vw 3'
_symmetry_space_group_name_H-M   'F d -3 m :2'
_cell_angle_alpha                90
_cell_angle_beta                 90
_cell_angle_gamma                90
_cell_formula_units_Z            1
_cell_length_a                   24.76
_cell_length_b                   24.76
_cell_length_c                   24.76
_cell_volume                     15179.306
_citation_journal_id_ASTM        JCTLA5
_cod_data_source_file            Olson_JCTLA5_1972_550.cif
_cod_data_source_block           Al54Na64O384Si138Te5
_cod_original_cell_volume        15179.31
_cod_database_code               1533900
loop_
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x,y,z
-y,x+1/4,z+1/4
-x+3/4,-y+1/4,z+1/2
y+3/4,-x,z+3/4
x,-y+1/4,-z+1/4
y+3/4,x+1/4,-z+1/2
-x+3/4,y,-z+3/4
-y,-x,-z
z,x,y
-x,z+1/4,y+1/4
-z+3/4,-x+1/4,y+1/2
x+3/4,-z,y+3/4
z,-x+1/4,-y+1/4
x+3/4,z+1/4,-y+1/2
-z+3/4,x,-y+3/4
-x,-z,-y
y,z,x
y+1/2,-z+3/4,-x+1/4
z+1/4,y+3/4,-x+1/2
-y+1/4,z+1/2,-x+3/4
-z,-y+1/2,-x+1/2
-y+1/4,-z+1/4,x
z+1/4,-y,x+1/4
-z+1/2,y+1/4,x+3/4
-x,-y,-z
y,-x-1/4,-z-1/4
x-3/4,y-1/4,-z-1/2
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-x,y-1/4,z-1/4
-y-3/4,-x-1/4,z-1/2
x-3/4,-y,z-3/4
y,x,z
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z-3/4,-x,y-3/4
x,z,y
-y,-z,-x
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y-1/4,-z-1/2,x-3/4
z,y-1/2,x-1/2
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x+3/4,z+3/4,-y+1
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-x,-z+1/2,-y+1/2
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-z+1/2,y+3/4,x+5/4
-x,-y+1/2,-z+1/2
y,-x+1/4,-z+1/4
x-3/4,y+1/4,-z
-y-3/4,x+1/2,-z-1/4
-x,y+1/4,z+1/4
-y-3/4,-x+1/4,z
x-3/4,-y+1/2,z-1/4
y,x+1/2,z+1/2
-z,-x+1/2,-y+1/2
x,-z+1/4,-y+1/4
z-3/4,x+1/4,-y
-x-3/4,z+1/2,-y-1/4
-z,x+1/4,y+1/4
-x-3/4,-z+1/4,y
z-3/4,-x+1/2,y-1/4
x,z+1/2,y+1/2
-y,-z+1/2,-x+1/2
-y-1/2,z-1/4,x+1/4
-z-1/4,-y-1/4,x
y-1/4,-z,x-1/4
z,y,x
y-1/4,z+1/4,-x+1/2
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z-1/2,-y+1/4,-x-1/4
x+1/2,y,z+1/2
-y+1/2,x+1/4,z+3/4
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z+1/2,-x+1/4,-y+3/4
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-z+5/4,x,-y+5/4
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z+3/4,-y,x+3/4
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z+1/2,y-1/2,x
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z,-y-1/4,-x-1/4
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-x+5/4,y+1/2,-z+3/4
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z+1/2,x+1/2,y
-x+1/2,z+3/4,y+1/4
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z+3/4,y+5/4,-x+1/2
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z+3/4,-y+1/2,x+1/4
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y+1/2,-x+1/4,-z-1/4
x-1/4,y+1/4,-z-1/2
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-x+1/2,y+1/4,z-1/4
-y-1/4,-x+1/4,z-1/2
x-1/4,-y+1/2,z-3/4
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z-1/4,x+1/4,-y-1/2
-x-1/4,z+1/2,-y-3/4
-z+1/2,x+1/4,y-1/4
-x-1/4,-z+1/4,y-1/2
z-1/4,-x+1/2,y-3/4
x+1/2,z+1/2,y
-y+1/2,-z+1/2,-x
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-z+1/4,-y-1/4,x-1/2
y+1/4,-z,x-3/4
z+1/2,y,x-1/2
y+1/4,z+1/4,-x
-z+1/4,y+1/2,-x-1/4
z,-y+1/4,-x-3/4
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
Na3 Na+1 0.2447 0.2447 0.2447 0.73 0.0
O2 O-2 -0.0046 -0.0046 0.1429 1 0.0
O4 O-2 0.18 0.18 0.3233 1 0.0
Na1 Na+1 0.0646 0.0646 0.0646 1 0.0
O1 O-2 -0.1085 0.1085 0 1 0.0
Si1 Si+4 -0.0537 0.0351 0.126 0.72 0.0
Te1 Te-2 0.336 0.336 0.24 0.039 0.0
Al1 Al+3 -0.0537 0.0351 0.126 0.28 0.0
O3 O-2 0.1746 0.1746 -0.0312 1 0.0
Na2 Na+1 0.202 0.202 0.202 0.28 0.0
Te2 Te-2 0.125 0.125 0.125 0.16 0.0
