data_[La20Ir4Pt8N4]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  La  1.1000  1.9500  1.1720
  Ir  2.2000  1.3500  0.7650
  Pt  2.2800  1.3500  0.8050
  N  3.0400  0.6500  0.6300
]
_symmetry_space_group_name_H-M [Cmc2_1]
_cell_length_a [4.2259]
_cell_length_b [17.8095]
_cell_length_c [12.6576]
_cell_angle_alpha [90.0000]
_cell_angle_beta [90.0000]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [36]
_chemical_formula_structural [La5IrPt2N]
_chemical_formula_sum '[La20 Ir4 Pt8 N4]'
_cell_volume [952.6156]
_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  0.0000  0.0297  0.0075  1.0
  La  La1  4  0.0000  0.2834  0.6900  1.0
  La  La2  4  0.0000  0.3236  0.3857  1.0
  La  La3  4  0.0000  0.3515  0.0089  1.0
  La  La4  4  0.0000  0.4914  0.7623  1.0
  Ir  Ir5  4  0.0000  0.1937  0.0401  1.0
  Pt  Pt6  4  0.0000  0.1070  0.6789  1.0
  Pt  Pt7  4  0.0000  0.1318  0.3255  1.0
  N  N8  4  0.0000  0.4588  0.4251  1.0
]