data_[Cs6Ge72Pt18]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Cs  0.7900  2.6000  1.8100
  Ge  2.0100  1.2500  0.7700
  Pt  2.2800  1.3500  0.8050
]
_symmetry_space_group_name_H-M [R3c]
_cell_length_a [8.5089]
_cell_length_b [8.5089]
_cell_length_c [34.4340]
_cell_angle_alpha [90.0000]
_cell_angle_beta [90.0000]
_cell_angle_gamma [120.0000]
_symmetry_Int_Tables_number [161]
_chemical_formula_structural [Cs(Ge4Pt)3]
_chemical_formula_sum '[Cs6 Ge72 Pt18]'
_cell_volume [2159.0503]
_cell_formula_units_Z [6]
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
[
  Cs  Cs0  6  0.0000  0.0000  0.0696  1
  Ge  Ge1  18  0.0318  0.1966  0.2663  1
  Ge  Ge2  18  0.0764  0.3785  0.6551  1
  Ge  Ge3  18  0.1203  0.7741  0.3656  1
  Ge  Ge4  18  0.1905  0.7231  0.5743  1
  Pt  Pt5  18  0.0144  0.3797  0.1364  1
]