data_global
_amcsd_formula_title 'La2.25 Li2 Nb1.25 O13 Ti2.75'
loop_
_publ_author_name
'Crosnier-Lopez M'
'Bhuvanesh N'
'Duroy H'
'Fourquet J'
_journal_name_full 'Journal of Solid State Chemistry'
_journal_volume 145 
_journal_year 1999
_journal_page_first 136
_journal_page_last 149
_publ_section_title
;
 Irreversible electron-induced structural change during HREM imaging in
 lithium Ruddlesden-Popper phases in the series Li2 La(x) (Nb(2n-3x)
 Ti(3x-n) O(3n-1)) (n = 2,3,4) and Li2 Sr1.5 (Nb(3-x) Fe(x)) O(10-x)
 _cod_database_code 1000503
;
_database_code_amcsd 0013974
_chemical_formula_sum '(Nb1.25 Ti2.75) La2.25 O13 Li2'
_cell_length_a 3.88
_cell_length_b 3.88
_cell_length_c 32.39999
_cell_angle_alpha 90
_cell_angle_beta 90
_cell_angle_gamma 90
_cell_volume 487.762
_exptl_crystal_density_diffrn      5.326
_symmetry_space_group_name_H-M 'I 4/m m m'
loop_
_space_group_symop_operation_xyz
  'x,y,z'
  '1/2+x,1/2+y,1/2+z'
  '-y,-x,z'
  '1/2-y,1/2-x,1/2+z'
  'y,x,-z'
  '1/2+y,1/2+x,1/2-z'
  'y,-x,-z'
  '1/2+y,1/2-x,1/2-z'
  '-y,x,z'
  '1/2-y,1/2+x,1/2+z'
  'x,-y,z'
  '1/2+x,1/2-y,1/2+z'
  '-x,y,-z'
  '1/2-x,1/2+y,1/2-z'
  'x,y,-z'
  '1/2+x,1/2+y,1/2-z'
  '-x,-y,z'
  '1/2-x,1/2-y,1/2+z'
  'y,x,z'
  '1/2+y,1/2+x,1/2+z'
  '-y,-x,-z'
  '1/2-y,1/2-x,1/2-z'
  '-y,x,-z'
  '1/2-y,1/2+x,1/2-z'
  'y,-x,z'
  '1/2+y,1/2-x,1/2+z'
  '-x,y,z'
  '1/2-x,1/2+y,1/2+z'
  'x,-y,-z'
  '1/2+x,1/2-y,1/2-z'
  '-x,-y,-z'
  '1/2-x,1/2-y,1/2-z'
loop_
_atom_site_label
_atom_site_fract_x
_atom_site_fract_y
_atom_site_fract_z
_atom_site_occupancy
Nb1   0.00000   0.00000   0.18800   0.31250
Ti1   0.00000   0.00000   0.18800   0.68750
Nb2   0.00000   0.00000   0.05800   0.31250
Ti2   0.00000   0.00000   0.05800   0.68750
La1   0.50000   0.50000   0.00000   0.75000
La2   0.50000   0.50000   0.12300   0.75000
O1   0.00000   0.00000   0.24400   1.00000
O2   0.50000   0.00000   0.18800   1.00000
O3   0.00000   0.00000   0.12000   1.00000
O4   0.50000   0.00000   0.05800   1.00000
O5   0.00000   0.00000   0.00000   1.00000
Li1   0.50000   0.00000   0.25000   1.00000