data_[In12Sn4Pt12]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  In  1.7800  1.5500  0.9400
  Sn  1.9600  1.4500  0.8300
  Pt  2.2800  1.3500  0.8050
]
_symmetry_space_group_name_H-M [P2_13]
_cell_length_a [8.2419]
_cell_length_b [8.2419]
_cell_length_c [8.2419]
_cell_angle_alpha [90.0000]
_cell_angle_beta [90.0000]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [198]
_chemical_formula_structural [In3SnPt3]
_chemical_formula_sum '[In12 Sn4 Pt12]'
_cell_volume [559.8721]
_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
[
  In  In0  4  0.0491  0.4509  0.5491  1
  In  In1  4  0.1407  0.8593  0.3593  1
  In  In2  4  0.1917  0.1917  0.1917  1
  Sn  Sn3  4  0.0828  0.5828  0.9172  1
  Pt  Pt4  12  0.0342  0.2595  0.8499  1
]