data_[La12Pm4In12]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  La  1.1000  1.9500  1.1720
  Pm  1.1300  1.8500  1.1100
  In  1.7800  1.5500  0.9400
]
_symmetry_space_group_name_H-M [P2_13]
_cell_length_a [9.7315]
_cell_length_b [9.7315]
_cell_length_c [9.7315]
_cell_angle_alpha [90.0000]
_cell_angle_beta [90.0000]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [198]
_chemical_formula_structural [La3PmIn3]
_chemical_formula_sum '[La12 Pm4 In12]'
_cell_volume [921.5815]
_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  4  0.0714  0.4286  0.5714  1
  La  La1  4  0.1713  0.8287  0.3287  1
  La  La2  4  0.1742  0.1742  0.1742  1
  Pm  Pm3  4  0.0768  0.5768  0.9232  1
  In  In4  12  0.0023  0.2550  0.8700  1
]