data_[Ba20Ag8H4Pt4]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Ba  0.8900  2.1500  1.4900
  Ag  1.9300  1.6000  1.0867
  H  2.2000  0.2500  0.0000
  Pt  2.2800  1.3500  0.8050
]
_symmetry_space_group_name_H-M [Cmc2_1]
_cell_length_a [4.6483]
_cell_length_b [20.2066]
_cell_length_c [14.5826]
_cell_angle_alpha [90.0000]
_cell_angle_beta [90.0000]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [36]
_chemical_formula_structural [Ba5Ag2HPt]
_chemical_formula_sum '[Ba20 Ag8 H4 Pt4]'
_cell_volume [1369.7092]
_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  0.0000  0.0442  0.0045  1.0
  Ba  Ba1  4  0.0000  0.2974  0.6713  1.0
  Ba  Ba2  4  0.0000  0.3103  0.3756  1.0
  Ba  Ba3  4  0.0000  0.3499  0.0189  1.0
  Ba  Ba4  4  0.0000  0.4999  0.7687  1.0
  Ag  Ag5  4  0.0000  0.1185  0.7013  1.0
  Ag  Ag6  4  0.0000  0.1220  0.3348  1.0
  H  H7  4  0.0000  0.4414  0.4248  1.0
  Pt  Pt8  4  0.0000  0.1975  0.0241  1.0
]