#------------------------------------------------------------------------------
#$Date: 2024-04-18 18:56:43 +0300 (Thu, 18 Apr 2024) $
#$Revision: 291269 $
#$URL: file:///home/coder/svn-repositories/cod/cif/9/00/08/9000816.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_9000816
loop_
_publ_author_name
'Weiss, Z.'
'Bailey, S. W.'
'Rieder, M.'
_publ_section_title
;
 Refinement of the crystal structure of kanonaite, (Mn,Al)(Al,Mn)O[SiO4]
;
_journal_name_full               'American Mineralogist'
_journal_page_first              561
_journal_page_last               567
_journal_volume                  66
_journal_year                    1981
_chemical_formula_sum            'Al1.14 Mn0.86 O5 Si'
_chemical_name_mineral           Kanonaite
_space_group_IT_number           58
_symmetry_space_group_name_Hall  '-P 2 2n'
_symmetry_space_group_name_H-M   'P n n m'
_cell_angle_alpha                90
_cell_angle_beta                 90
_cell_angle_gamma                90
_cell_length_a                   7.959
_cell_length_b                   8.047
_cell_length_c                   5.616
_cell_formula_units_Z            4
_cell_volume                     359.683
_database_code_amcsd             0000833
_exptl_crystal_density_diffrn    3.436
_cod_original_formula_sum        '(Mn.86 Al1.14) Si O5'
_cod_database_code               9000816
loop_
_space_group_symop_operation_xyz
x,y,z
1/2+x,1/2-y,1/2+z
1/2-x,1/2+y,1/2-z
1/2-x,1/2+y,1/2+z
1/2+x,1/2-y,1/2-z
x,y,-z
-x,-y,z
-x,-y,-z
loop_
_atom_site_label
_atom_site_fract_x
_atom_site_fract_y
_atom_site_fract_z
_atom_site_occupancy
Mn1 0.00000 0.00000 0.24290 0.74000
Al1 0.00000 0.00000 0.24290 0.26000
Mn2 -0.12520 0.36300 0.00000 0.12000
Al2 -0.12520 0.36300 0.00000 0.88000
Si1 0.24920 0.25490 0.00000 1.00000
O1 0.07430 -0.13690 0.00000 1.00000
O2 0.42430 0.36260 0.00000 1.00000
O3 0.10420 0.39890 0.00000 1.00000
O4 0.24300 0.14130 0.23830 1.00000
loop_
_cod_related_entry_id
_cod_related_entry_database
_cod_related_entry_code
1 AMCSD 0000833
