data_[Li2La8Cu2O16]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Li  0.9800  1.4500  0.9000
  La  1.1000  1.9500  1.1720
  Cu  1.9000  1.3500  0.8200
  O  3.4400  0.6000  1.2600
]
_symmetry_space_group_name_H-M [C2/m]
_cell_length_a [13.4889]
_cell_length_b [3.8010]
_cell_length_c [7.5500]
_cell_angle_alpha [90.0000]
_cell_angle_beta [106.1041]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [12]
_chemical_formula_structural [LiLa4CuO8]
_chemical_formula_sum '[Li2 La8 Cu2 O16]'
_cell_volume [371.9081]
_cell_formula_units_Z [2]
loop_
 _symmetry_equiv_pos_site_id
 _symmetry_equiv_pos_as_xyz
  1  'x, y, z'
loop_
 _atom_site_type_symbol
 _atom_site_label
 _atom_site_symmetry_multiplicity
 _atom_site_fract_x
 _atom_site_fract_y
 _atom_site_fract_z
 _atom_site_occupancy
[
  Li  Li0  2  0.0000  0.0000  0.0000  1.0
  La  La1  4  0.1363  0.5000  0.8271  1.0
  La  La2  4  0.1380  0.5000  0.3077  1.0
  Cu  Cu3  2  0.0000  0.0000  0.5000  1.0
  O  O4  4  0.0035  0.0000  0.2597  1.0
  O  O5  4  0.1814  0.0000  0.0873  1.0
  O  O6  4  0.1816  0.0000  0.5975  1.0
  O  O7  2  0.0000  0.5000  0.0000  1.0
  O  O8  2  0.0000  0.5000  0.5000  1.0
]