#------------------------------------------------------------------------------
#$Date: 2024-05-09 11:47:05 +0300 (Thu, 09 May 2024) $
#$Revision: 291792 $
#$URL: file:///home/coder/svn-repositories/cod/cif/9/01/04/9010480.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_9010480
loop_
_publ_author_name
'Vulic, P.'
'Kahlenberg, V.'
'Konzett, J.'
_publ_section_title
;
 On the existence of a Na-deficient monoclinic trinepheline with composition
 Na7.85Al7.85Si8.15O32
;
_journal_name_full               'American Mineralogist'
_journal_page_first              1072
_journal_page_last               1079
_journal_paper_doi               10.2138/am.2008.2702
_journal_volume                  93
_journal_year                    2008
_chemical_compound_source        Synthetic
_chemical_formula_sum            'Al Na0.981 O4 Si'
_chemical_name_mineral           Nepheline
_space_group_IT_number           4
_symmetry_space_group_name_Hall  'P 2c'
_symmetry_space_group_name_H-M   'P 1 1 21'
_cell_angle_alpha                90
_cell_angle_beta                 90
_cell_angle_gamma                119.788
_cell_length_a                   9.9897
_cell_length_b                   9.9622
_cell_length_c                   24.979
_cell_formula_units_Z            24
_cell_volume                     2157.432
_database_code_amcsd             0004612
_exptl_crystal_density_diffrn    2.616
_cod_original_cell_volume        2157.433
_cod_original_formula_sum        'Na.981 Al Si O4'
_cod_database_code               9010480
loop_
_space_group_symop_operation_xyz
x,y,z
-x,-y,1/2+z
loop_
_atom_site_label
_atom_site_fract_x
_atom_site_fract_y
_atom_site_fract_z
_atom_site_occupancy
_atom_site_U_iso_or_equiv
Na1a 0.99210 0.43660 0.97170 1.00000 0.02300
Na1b 0.56170 0.55000 0.63000 1.00000 0.02300
Na1c 0.54590 0.97630 0.80330 1.00000 0.02600
Na2a 0.53020 0.54970 0.97300 1.00000 0.02400
Na2b 0.45110 0.01470 0.64100 1.00000 0.02500
Na2c 0.95940 0.52730 0.80310 1.00000 0.02600
Na3a 0.44110 0.45270 0.81490 1.00000 0.02200
Na3b 0.42980 0.99310 0.97220 1.00000 0.02100
Na3c 0.03530 0.47020 0.64010 1.00000 0.02700
Na4a 0.96370 0.95960 0.97230 0.85200 0.05700
Na4b 0.98280 0.98420 0.64330 1.00000 0.09100
Na4c 0.04310 0.03550 0.79740 0.92300 0.05400
Al1a 0.65390 0.90270 0.91060 1.00000 0.01000
Al1b 0.11370 0.77670 0.58220 1.00000 0.01100
Al1c 0.76310 0.68090 0.74560 1.00000 0.01000
Al2a 0.08460 0.75360 0.90800 1.00000 0.01000
Al2b 0.24580 0.33010 0.57490 1.00000 0.01100
Al2c 0.37040 0.12900 0.74400 1.00000 0.01000
Al3a 0.20820 0.30540 0.91060 1.00000 0.01200
Al3b 0.67020 0.90540 0.57410 1.00000 0.01000
Al3c 0.90000 0.19920 0.73660 1.00000 0.01000
Al4a 0.67080 0.34240 0.90920 1.00000 0.01100
Al4b 0.68740 0.35750 0.57070 1.00000 0.01100
Al4c 0.29700 0.65500 0.74350 1.00000 0.01200
Si1a 0.75610 0.67220 0.86870 1.00000 0.01000
Si1b 0.64970 0.89960 0.03440 1.00000 0.01100
Si1c 0.09810 0.80310 0.70770 1.00000 0.01000
Si2a 0.66910 0.33810 0.03770 1.00000 0.01100
Si2b 0.70440 0.34940 0.70060 1.00000 0.01100
Si2c 0.31730 0.64530 0.87390 1.00000 0.01300
Si3a 0.08360 0.75480 0.03420 1.00000 0.01100
Si3b 0.23490 0.32090 0.69900 1.00000 0.01000
Si3c 0.33370 0.09670 0.86910 1.00000 0.01000
Si4a 0.88530 0.22660 0.86170 1.00000 0.01000
Si4b 0.79150 0.69320 0.53330 1.00000 0.01000
Si4c 0.63180 0.87520 0.70000 1.00000 0.01000
O1a 0.64500 0.49560 0.89040 1.00000 0.02000
O1b 0.47060 0.81680 0.05240 1.00000 0.02300
O1c 0.13800 0.68190 0.73670 1.00000 0.01800
O2a 0.05090 0.27010 0.57610 1.00000 0.02000
O2b 0.32640 0.27800 0.74330 1.00000 0.01600
O2c 0.21980 0.94640 0.90380 1.00000 0.02400
O3a 0.93330 0.71260 0.86480 1.00000 0.01700
O3b 0.71220 0.77850 0.03150 1.00000 0.02000
O3c 0.24310 0.97460 0.70390 1.00000 0.01500
O4a 0.69780 0.68690 0.80960 1.00000 0.01600
O4b 0.66660 0.97230 0.97500 1.00000 0.01900
O4c 0.04080 0.74500 0.64710 1.00000 0.01800
O5a 0.96130 0.25820 0.80250 1.00000 0.01800
O5b 0.23910 0.25940 0.97410 1.00000 0.02100
O5c 0.65410 0.94800 0.64060 1.00000 0.01900
O6a 0.74090 0.78820 0.91070 1.00000 0.02200
O6b 0.25110 0.96960 0.57800 1.00000 0.01900
O6c 0.96040 0.81180 0.73930 1.00000 0.01300
O7a 0.33050 0.50290 0.90020 1.00000 0.01900
O7b 0.50860 0.17710 0.04410 1.00000 0.02000
O7c 0.85350 0.32750 0.70620 1.00000 0.02000
O8a 0.77860 0.06730 0.53670 1.00000 0.01600
O8b 0.05150 0.19490 0.70260 1.00000 0.01800
O8c 0.25630 0.20630 0.86440 1.00000 0.01900
O9a 0.01720 0.71790 0.97390 1.00000 0.02300
O9b 0.29930 0.31360 0.63990 1.00000 0.01600
O9c 0.35680 0.05640 0.80860 1.00000 0.02300
O10a 0.85650 0.36440 0.55010 1.00000 0.02500
O10b 0.25810 0.49120 0.70770 1.00000 0.02200
O10c 0.49730 0.17660 0.89950 1.00000 0.01900
O11a 0.82040 0.34370 0.87320 1.00000 0.01900
O11b 0.67260 0.50940 0.54250 1.00000 0.01800
O11c 0.45930 0.82180 0.72040 1.00000 0.02000
O12a 0.46260 0.80760 0.89200 1.00000 0.02800
O12b 0.80600 0.34230 0.07430 1.00000 0.01700
O12c 0.72850 0.49340 0.73750 1.00000 0.02200
O13a 0.74420 0.05080 0.86500 1.00000 0.01800
O13b 0.96540 0.72770 0.53630 1.00000 0.01900
O13c 0.66460 0.73010 0.69900 1.00000 0.01300
O14a 0.72320 0.35820 0.97590 1.00000 0.02200
O14b 0.68610 0.38540 0.63990 1.00000 0.02900
O14c 0.32310 0.62730 0.81060 1.00000 0.03400
O15a 0.01440 0.25270 0.90600 1.00000 0.01600
O15b 0.75800 0.79150 0.57800 1.00000 0.01600
O15c 0.75100 0.00750 0.74030 1.00000 0.01400
O16a 0.15710 0.63400 0.89170 1.00000 0.02400
O16b 0.35880 0.52000 0.55570 1.00000 0.02100
O16c 0.55360 0.19150 0.71930 1.00000 0.02000
loop_
_cod_related_entry_id
_cod_related_entry_database
_cod_related_entry_code
1 AMCSD 0004612
