#------------------------------------------------------------------------------
#$Date: 2008-01-26 15:05:32 +0200 (Sat, 26 Jan 2008) $
#$Revision: 19 $
#$URL: file:///home/coder/svn-repositories/cod/cif/9/9009937.cif $
#------------------------------------------------------------------------------
#
# This file is available in the Crystallography Open Database (COD),
# http://www.crystallography.net/
#
# All data on this site have been placed in the public domain by the
# contributors.
#
data_9009937
_chemical_name 'Diaoyudaoite'
loop_
_publ_author_name
'Felsche J'
_journal_name_full "Naturwissenschaften"
_journal_volume 54
_journal_year 1967
_journal_page_first 612
_journal_page_last 613
_publ_section_title
;
 Zur kristallstruktur von beta-aluminiumoxid
 Note: x,y coordinates of O3 altered to produce a more reasonable structure
 Locality: synthetic
;
_chemical_formula_sum 'Na Al11 O17'
_cell_length_a 5.5962
_cell_length_b 5.5962
_cell_length_c 22.526
_cell_angle_alpha 90
_cell_angle_beta 90
_cell_angle_gamma 120
_cell_volume 610.944
_symmetry_space_group_name_H-M 'P 63/m m c'
loop_
_symmetry_equiv_pos_as_xyz
  'x,y,z'
  '-x,-x+y,1/2+z'
  'x,x-y,1/2-z'
  '-x+y,-x,1/2-z'
  'x-y,x,1/2+z'
  '-y,-x,z'
  'y,x,-z'
  'y,-x+y,-z'
  '-y,x-y,z'
  'x-y,-y,1/2+z'
  '-x+y,y,1/2-z'
  'x,y,1/2-z'
  '-x,-y,1/2+z'
  'x,x-y,z'
  '-x,-x+y,-z'
  'x-y,x,-z'
  '-x+y,-x,z'
  'y,x,1/2+z'
  '-y,-x,1/2-z'
  '-y,x-y,1/2-z'
  'y,-x+y,1/2+z'
  '-x+y,y,z'
  'x-y,-y,-z'
  '-x,-y,-z'
loop_
_atom_site_label
_atom_site_fract_x
_atom_site_fract_y
_atom_site_fract_z
Na   0.66667   0.33333   0.25000
Al1   0.16667   0.33333   0.60601
Al2   0.33333   0.66667   0.02480
Al3   0.33333   0.66667   0.17580
Al4   0.00000   0.00000   0.00000
O1   0.16667   0.33333   0.04950
O2   0.50000   0.00000   0.14630
O3   0.33333   0.66667   0.55400
O4   0.00000   0.00000   0.14210
O5   0.33333   0.66667   0.25000