#------------------------------------------------------------------------------
#$Date: 2024-05-29 17:00:33 +0300 (Wed, 29 May 2024) $
#$Revision: 292100 $
#$URL: file:///home/coder/svn-repositories/cod/cif/9/01/75/9017516.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_9017516
loop_
_publ_author_name
'Brandao, P.'
'Rocha, J.'
'Reis, M. S.'
'dos Santos, A. M.'
'Jin, R.'
_publ_section_title
;
 Magnetic properties of KNaMSi4O10 compounds (M=Mn,Fe,Cu)
;
_journal_name_full               'Journal of Solid State Chemistry'
_journal_page_first              253
_journal_page_last               258
_journal_volume                  182
_journal_year                    2009
_chemical_compound_source        Synthetic
_chemical_formula_sum            'Fe K Na O10 Si4'
_chemical_name_mineral           Fenaksite
_space_group_IT_number           2
_space_group_name_Hall           '-P 1'
_space_group_name_H-M_alt        'P -1'
_symmetry_space_group_name_H-M   'P -1'
_cell_angle_alpha                105.778
_cell_angle_beta                 100.60
_cell_angle_gamma                114.262
_cell_length_a                   6.9742
_cell_length_b                   8.1326
_cell_length_c                   9.9301
_cell_formula_units_Z            2
_cell_volume                     465.218
_database_code_amcsd             0019813
_exptl_crystal_density_diffrn    2.786
_cod_data_source_file            inputs/fixed/downloads/17/17424.cif
_cod_data_source_block           17424
_cod_original_formula_sum        'K Na Fe Si4 O10'
_cod_database_code               9017516
loop_
_space_group_symop_operation_xyz
x,y,z
-x,-y,-z
loop_
_atom_site_label
_atom_site_fract_x
_atom_site_fract_y
_atom_site_fract_z
_atom_site_U_iso_or_equiv
K 0.15803 0.79726 -0.01004 0.02063
Na 0.16344 1.13769 0.40979 0.02261
Fe 0.65650 1.10800 0.40652 0.00959
Si1 0.46815 1.30243 0.21398 0.00694
Si2 0.37394 0.64107 0.27093 0.00757
Si3 0.70690 0.82667 0.13186 0.00794
Si4 0.94245 0.64143 0.27235 0.00819
O1 0.42910 1.14250 0.28292 0.01173
O2 0.80044 1.04432 0.23933 0.01443
O3 0.50591 0.83013 0.41928 0.01162
O4 0.67453 0.81029 -0.03836 0.01695
O5 0.72649 1.43266 0.23103 0.01698
O6 1.11246 0.57942 0.20749 0.01328
O7 0.88130 0.74610 0.16579 0.01709
O8 1.04219 0.78277 0.44056 0.01758
O9 0.46703 0.67452 0.13524 0.01323
O10 0.37814 1.44909 0.28854 0.01688
loop_
_cod_related_entry_id
_cod_related_entry_database
_cod_related_entry_code
1 AMCSD 0019813
