data_[La12Ce4In8]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  La  1.1000  1.9500  1.1720
  Ce  1.1200  1.8500  1.0800
  In  1.7800  1.5500  0.9400
]
_symmetry_space_group_name_H-M [C2/c]
_cell_length_a [17.4322]
_cell_length_b [6.8753]
_cell_length_c [6.3304]
_cell_angle_alpha [90.0000]
_cell_angle_beta [103.5418]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [15]
_chemical_formula_structural [La3CeIn2]
_chemical_formula_sum '[La12 Ce4 In8]'
_cell_volume [737.6104]
_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
[
  La  La0  8  0.1720  0.1217  0.5684  1.0
  La  La1  4  0.0000  0.3955  0.2500  1.0
  Ce  Ce2  4  0.0000  0.1411  0.7500  1.0
  In  In3  8  0.1644  0.3732  0.0368  1.0
]