data_[Li1La2In3]
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
  In  1.7800  1.5500  0.9400
]
_symmetry_space_group_name_H-M [Pmm2]
_cell_length_a [3.8199]
_cell_length_b [5.0464]
_cell_length_c [8.7374]
_cell_angle_alpha [90.0000]
_cell_angle_beta [90.0000]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [25]
_chemical_formula_structural [LiLa2In3]
_chemical_formula_sum '[Li1 La2 In3]'
_cell_volume [168.4294]
_cell_formula_units_Z [1]
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  1  0.5000  0.5000  0.3284  1.0
  La  La1  1  0.0000  0.0000  0.5065  1.0
  La  La2  1  0.0000  0.5000  0.9936  1.0
  In  In3  1  0.5000  0.0000  0.1810  1.0
  In  In4  1  0.5000  0.0000  0.8389  1.0
  In  In5  1  0.5000  0.5000  0.6515  1.0
]