data_[Li4La4Te8]
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
  Te  2.1000  1.4000  1.2933
]
_symmetry_space_group_name_H-M [C2/m]
_cell_length_a [15.9504]
_cell_length_b [4.3147]
_cell_length_c [8.1011]
_cell_angle_alpha [90.0000]
_cell_angle_beta [111.3661]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [12]
_chemical_formula_structural [LiLaTe2]
_chemical_formula_sum '[Li4 La4 Te8]'
_cell_volume [519.2096]
_cell_formula_units_Z [4]
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  4  0.1081  0.5000  0.0981  1.0
  La  La1  4  0.1297  0.0000  0.5624  1.0
  Te  Te2  4  0.0169  0.5000  0.7319  1.0
  Te  Te3  4  0.2165  0.0000  0.2547  1.0
]