data_[Cs6Pt4Pb8]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Cs  0.7900  2.6000  1.8100
  Pt  2.2800  1.3500  0.8050
  Pb  2.3300  1.8000  1.1225
]
_symmetry_space_group_name_H-M [C2/m]
_cell_length_a [16.1048]
_cell_length_b [4.6981]
_cell_length_c [10.1858]
_cell_angle_alpha [90.0000]
_cell_angle_beta [112.8850]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [12]
_chemical_formula_structural [Cs3(PtPb2)2]
_chemical_formula_sum '[Cs6 Pt4 Pb8]'
_cell_volume [710.0089]
_cell_formula_units_Z [2]
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  4  0.1337  0.5000  0.4159  1.0
  Cs  Cs1  2  0.0000  0.0000  0.0000  1.0
  Pt  Pt2  4  0.1642  0.5000  0.7951  1.0
  Pb  Pb3  4  0.0715  0.0000  0.6804  1.0
  Pb  Pb4  4  0.2188  0.5000  0.0968  1.0
]