#------------------------------------------------------------------------------
#$Date: 2023-03-27 08:00:38 +0100 (Mon, 27 Mar 2023) $
#$Revision: 282074 $
#$URL: svn://www.crystallography.net/cod/cif/9/01/77/9017798.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_9017798
loop_
_publ_author_name
'Onorato, E.'
'Penta, M.'
'Sgarlata, F.'
_publ_section_title
;
 Struttura del Sanidino
 Note: Occupancies not provided, estimated using Kroll & Ribbe, 1983
;
_journal_name_full               'Periodico di Mineralogia'
_journal_page_first              1
_journal_page_last               34
_journal_volume                  32
_journal_year                    1963
_chemical_compound_source        'Alban Hills, Rome Province, Latium, Italy'
_chemical_formula_sum            'Al K O8 Si3'
_chemical_name_mineral           Sanidine
_space_group_IT_number           12
_space_group_name_Hall           '-C 2y'
_space_group_name_H-M_alt        'C 1 2/m 1'
_symmetry_space_group_name_H-M   'C 1 2/m 1'
_cell_angle_alpha                90
_cell_angle_beta                 115.98
_cell_angle_gamma                90
_cell_length_a                   8.48
_cell_length_b                   12.97
_cell_length_c                   7.18
_cell_volume                     709.895
_database_code_amcsd             0020562
_exptl_crystal_density_diffrn    2.604
_cod_data_source_file            inputs/fixed/downloads/19/19190.cif
_cod_data_source_block           19190
_cod_original_formula_sum        'K (Si3 Al) O8'
_cod_database_code               9017798
loop_
_space_group_symop_operation_xyz
x,y,z
1/2+x,1/2+y,z
x,-y,z
1/2+x,1/2-y,z
-x,y,-z
1/2-x,1/2+y,-z
-x,-y,-z
1/2-x,1/2-y,-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
K 0.28290 0.00000 0.13660 1.00000 0.02660
SiR1 0.00890 0.18420 0.22350 0.74400 0.01089
AlR1 0.00890 0.18420 0.22350 0.25600 0.01089
SiR2 0.70730 0.11780 0.34400 0.75600 0.01077
AlR2 0.70730 0.11780 0.34400 0.24400 0.01077
O1 0.63030 0.00000 0.28330 1.00000 0.01849
O2 0.00000 0.14550 0.00000 1.00000 0.01849
O3 0.82730 0.14470 0.22720 1.00000 0.02064
O4 0.03350 0.30940 0.25610 1.00000 0.01938
O5 0.18040 0.12560 0.40550 1.00000 0.01900
loop_
_cod_related_entry_id
_cod_related_entry_database
_cod_related_entry_code
1 AMCSD 0020562