data_[Cs12Pt2Cl4]
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
  Cl  3.1600  1.0000  0.7800
]
_symmetry_space_group_name_H-M [Pnnm]
_cell_length_a [8.6629]
_cell_length_b [8.8184]
_cell_length_c [14.6515]
_cell_angle_alpha [90.0000]
_cell_angle_beta [90.0000]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [58]
_chemical_formula_structural [Cs6PtCl2]
_chemical_formula_sum '[Cs12 Pt2 Cl4]'
_cell_volume [1119.2729]
_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  8  0.2226  0.1657  0.3352  1
  Cs  Cs1  4  0.2034  0.6724  0.5000  1
  Pt  Pt2  2  0.0000  0.0000  0.5000  1
  Cl  Cl3  4  0.0000  0.5000  0.3162  1
]