#------------------------------------------------------------------------------
#$Date: 2024-04-25 17:59:02 +0300 (Thu, 25 Apr 2024) $
#$Revision: 291351 $
#$URL: file:///home/coder/svn-repositories/cod/cif/9/00/53/9005387.cif $
#------------------------------------------------------------------------------
#
# This file is available in the Crystallography Open Database (COD),
# http://www.crystallography.net/. The original data for this entry
# were provided the American Mineralogist Crystal Structure Database,
# http://rruff.geo.arizona.edu/AMS/amcsd.php
#
# The file may be used within the scientific community so long as
# proper attribution is given to the journal article from which the
# data were obtained.
#
data_9005387
loop_
_publ_author_name
'Porcher, F.'
'Souhassou, M.'
'Dusausoy, Y.'
'Lecomte, C.'
_publ_section_title
;
 The crystal structure of a low-silica dehydrated NaX zeolite
;
_journal_name_full               'European Journal of Mineralogy'
_journal_page_first              333
_journal_page_last               343
_journal_volume                  11
_journal_year                    1999
_chemical_formula_sum            'Al3 Na2.92 O12 Si3'
_chemical_name_mineral           Faujasite-Na
_space_group_IT_number           203
_symmetry_space_group_name_Hall  '-F 2uv 2vw 3'
_symmetry_space_group_name_H-M   'F d -3 :2'
_cell_angle_alpha                90
_cell_angle_beta                 90
_cell_angle_gamma                90
_cell_length_a                   25.104
_cell_length_b                   25.104
_cell_length_c                   25.104
_cell_formula_units_Z            32
_cell_volume                     15820.812
_database_code_amcsd             0006772
_exptl_crystal_density_diffrn    1.425
_cod_original_sg_symbol_H-M      'F d 3'
_cod_original_formula_sum        'Si3 Al3 O12 Na2.92'
_cod_database_code               9005387
loop_
_space_group_symop_operation_xyz
x,y,z
x,1/2+y,1/2+z
1/2+x,y,1/2+z
1/2+x,1/2+y,z
1/4+z,1/4+x,-y
1/4+z,3/4+x,1/2-y
3/4+z,1/4+x,1/2-y
3/4+z,3/4+x,-y
1/4+z,-x,1/4+y
1/4+z,1/2-x,3/4+y
3/4+z,-x,3/4+y
3/4+z,1/2-x,1/4+y
-z,1/4+x,1/4+y
-z,3/4+x,3/4+y
1/2-z,1/4+x,3/4+y
1/2-z,3/4+x,1/4+y
-z,-x,-y
-z,1/2-x,1/2-y
1/2-z,-x,1/2-y
1/2-z,1/2-x,-y
y,3/4-z,3/4-x
y,1/4-z,1/4-x
1/2+y,3/4-z,1/4-x
1/2+y,1/4-z,3/4-x
3/4-y,3/4-z,x
3/4-y,1/4-z,1/2+x
1/4-y,3/4-z,1/2+x
1/4-y,1/4-z,x
3/4-y,z,3/4-x
3/4-y,1/2+z,1/4-x
1/4-y,z,1/4-x
1/4-y,1/2+z,3/4-x
y,z,x
y,1/2+z,1/2+x
1/2+y,z,1/2+x
1/2+y,1/2+z,x
1/4+x,-y,1/4+z
1/4+x,1/2-y,3/4+z
3/4+x,-y,3/4+z
3/4+x,1/2-y,1/4+z
-x,1/4+y,1/4+z
-x,3/4+y,3/4+z
1/2-x,1/4+y,3/4+z
1/2-x,3/4+y,1/4+z
1/4+x,1/4+y,-z
1/4+x,3/4+y,1/2-z
3/4+x,1/4+y,1/2-z
3/4+x,3/4+y,-z
-x,-y,-z
-x,1/2-y,1/2-z
1/2-x,-y,1/2-z
1/2-x,1/2-y,-z
3/4-z,3/4-x,y
3/4-z,1/4-x,1/2+y
1/4-z,3/4-x,1/2+y
1/4-z,1/4-x,y
3/4-z,x,3/4-y
3/4-z,1/2+x,1/4-y
1/4-z,x,1/4-y
1/4-z,1/2+x,3/4-y
z,3/4-x,3/4-y
z,1/4-x,1/4-y
1/2+z,3/4-x,1/4-y
1/2+z,1/4-x,3/4-y
z,x,y
z,1/2+x,1/2+y
1/2+z,x,1/2+y
1/2+z,1/2+x,y
-y,1/4+z,1/4+x
-y,3/4+z,3/4+x
1/2-y,1/4+z,3/4+x
1/2-y,3/4+z,1/4+x
1/4+y,1/4+z,-x
1/4+y,3/4+z,1/2-x
3/4+y,1/4+z,1/2-x
3/4+y,3/4+z,-x
1/4+y,-z,1/4+x
1/4+y,1/2-z,3/4+x
3/4+y,-z,3/4+x
3/4+y,1/2-z,1/4+x
-y,-z,-x
-y,1/2-z,1/2-x
1/2-y,-z,1/2-x
1/2-y,1/2-z,-x
3/4-x,y,3/4-z
3/4-x,1/2+y,1/4-z
1/4-x,y,1/4-z
1/4-x,1/2+y,3/4-z
x,3/4-y,3/4-z
x,1/4-y,1/4-z
1/2+x,3/4-y,1/4-z
1/2+x,1/4-y,3/4-z
3/4-x,3/4-y,z
3/4-x,1/4-y,1/2+z
1/4-x,3/4-y,1/2+z
1/4-x,1/4-y,z
loop_
_atom_site_label
_atom_site_fract_x
_atom_site_fract_y
_atom_site_fract_z
_atom_site_occupancy
Si -0.05427 0.12553 0.03502 1.00000
Al -0.05519 0.03586 0.12401 1.00000
O1 -0.10980 -0.00020 0.10580 1.00000
O2 -0.00110 -0.00290 0.14140 1.00000
O3 -0.03450 0.07500 0.07100 1.00000
O4 -0.06930 0.07320 0.17940 1.00000
Na1 0.04750 0.04750 0.04750 0.97000
Na2 0.22830 0.22830 0.22830 0.93000
Na3 0.39440 0.10400 0.14600 0.16000
Na4 0.40420 0.06500 0.06800 0.18000
loop_
_cod_related_entry_id
_cod_related_entry_database
_cod_related_entry_code
1 AMCSD 0006772
