data_[Ba8Sb8Pt4]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Ba  0.8900  2.1500  1.4900
  Sb  2.0500  1.4500  0.8300
  Pt  2.2800  1.3500  0.8050
]
_symmetry_space_group_name_H-M [C2/m]
_cell_length_a [12.8695]
_cell_length_b [4.5392]
_cell_length_c [12.5575]
_cell_angle_alpha [90.0000]
_cell_angle_beta [109.6200]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [12]
_chemical_formula_structural [Ba2Sb2Pt]
_chemical_formula_sum '[Ba8 Sb8 Pt4]'
_cell_volume [690.9728]
_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  0.0790  0.0000  0.8939  1
  Ba  Ba1  4  0.1924  0.5000  0.6370  1
  Sb  Sb2  4  0.0486  0.0000  0.4080  1
  Sb  Sb3  4  0.1571  0.5000  0.1446  1
  Pt  Pt4  4  0.0728  0.5000  0.3097  1
]