data_[Ba4In12Pt4]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Ba  0.8900  2.1500  1.4900
  In  1.7800  1.5500  0.9400
  Pt  2.2800  1.3500  0.8050
]
_symmetry_space_group_name_H-M [Pnma]
_cell_length_a [9.2004]
_cell_length_b [4.7542]
_cell_length_c [12.3838]
_cell_angle_alpha [90.0000]
_cell_angle_beta [90.0000]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [62]
_chemical_formula_structural [BaIn3Pt]
_chemical_formula_sum '[Ba4 In12 Pt4]'
_cell_volume [541.6755]
_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
[
  Ba  Ba0  4  0.1885  0.2500  0.9930  1.0
  In  In1  4  0.0587  0.2500  0.4162  1.0
  In  In2  4  0.1190  0.7500  0.2109  1.0
  In  In3  4  0.1350  0.7500  0.7831  1.0
  Pt  Pt4  4  0.0994  0.2500  0.6418  1.0
]