#------------------------------------------------------------------------------
#$Date: 2024-04-18 18:56:43 +0300 (Thu, 18 Apr 2024) $
#$Revision: 291269 $
#$URL: file:///home/coder/svn-repositories/cod/cif/9/00/22/9002264.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_9002264
loop_
_publ_author_name
'Gnos, E.'
'Armbruster, T.'
_publ_section_title
;
 Kinoshitalite, Ba(Mg)3(Al2Si2)O10(OH,F)2, a brittle mica from a manganese
 deposit in Oman: Paragenesis and crystal chemistry
;
_journal_name_full               'American Mineralogist'
_journal_page_first              242
_journal_page_last               250
_journal_volume                  85
_journal_year                    2000
_chemical_formula_sum            'Al2 Ba0.94 H2 K0.06 Mg2.744 Mn0.256 O12 Si2'
_chemical_name_mineral           Kinoshitalite
_space_group_IT_number           12
_symmetry_space_group_name_Hall  '-C 2y'
_symmetry_space_group_name_H-M   'C 1 2/m 1'
_cell_angle_alpha                90
_cell_angle_beta                 100.06
_cell_angle_gamma                90
_cell_length_a                   5.316
_cell_length_b                   9.230
_cell_length_c                   10.197
_cell_formula_units_Z            2
_cell_volume                     492.641
_database_code_amcsd             0002348
_exptl_crystal_density_diffrn    3.481
_cod_original_cell_volume        492.640
_cod_original_formula_sum
'(Ba.94 K.06) (Mg2.744 Mn.256) (Si2 Al2) H2 O12'
_cod_database_code               9002264
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
Ba 0.50000 0.50000 0.50000 0.94000 0.01926
K 0.50000 0.50000 0.50000 0.06000 0.01926
Mg1 0.00000 0.50000 0.00000 0.92000 0.01064
Mn1 0.00000 0.50000 0.00000 0.08000 0.01064
Mg2 0.00000 0.16937 0.00000 0.91200 0.01115
Mn2 0.00000 0.16937 0.00000 0.08800 0.01115
SiT 0.07500 0.33339 -0.27599 0.50000 0.01144
AlT 0.07500 0.33339 -0.27599 0.50000 0.01144
H4 0.09000 0.00000 -0.19200 1.00000 0.02786
O1 0.00810 0.50000 0.33950 1.00000 0.01887
O2 0.16560 0.21930 0.33930 1.00000 0.01887
O3 0.13020 0.33370 -0.11060 1.00000 0.01469
O4 0.13150 0.00000 -0.10250 1.00000 0.01444
loop_
_cod_related_entry_id
_cod_related_entry_database
_cod_related_entry_code
1 AMCSD 0002348
