data_[La8Pr2In2]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  La  1.1000  1.9500  1.1720
  Pr  1.1300  1.8500  1.0600
  In  1.7800  1.5500  0.9400
]
_symmetry_space_group_name_H-M [P2_1/m]
_cell_length_a [6.2521]
_cell_length_b [7.2077]
_cell_length_c [8.9179]
_cell_angle_alpha [90.0000]
_cell_angle_beta [90.8135]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [11]
_chemical_formula_structural [La4PrIn]
_chemical_formula_sum '[La8 Pr2 In2]'
_cell_volume [401.8265]
_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
[
  La  La0  4  0.1586  0.0085  0.6568  1.0
  La  La1  2  0.0232  0.7500  0.0110  1.0
  La  La2  2  0.3384  0.2500  0.3271  1.0
  Pr  Pr3  2  0.5000  0.0000  0.0000  1.0
  In  In4  2  0.3418  0.7500  0.3404  1.0
]