data_[La4Al12Pt8]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  La  1.1000  1.9500  1.1720
  Al  1.6100  1.2500  0.6750
  Pt  2.2800  1.3500  0.8050
]
_symmetry_space_group_name_H-M [C2/m]
_cell_length_a [15.1303]
_cell_length_b [4.2622]
_cell_length_c [8.1242]
_cell_angle_alpha [90.0000]
_cell_angle_beta [113.6060]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [12]
_chemical_formula_structural [LaAl3Pt2]
_chemical_formula_sum '[La4 Al12 Pt8]'
_cell_volume [480.0803]
_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  0.1476  0.0000  0.0865  1.0
  Al  Al1  4  0.0197  0.0000  0.3481  1.0
  Al  Al2  4  0.1187  0.5000  0.7289  1.0
  Al  Al3  4  0.1787  0.5000  0.4442  1.0
  Pt  Pt4  4  0.0151  0.5000  0.1759  1.0
  Pt  Pt5  4  0.1724  0.0000  0.6351  1.0
]