data_[B4H4Pd4Pt16]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  B  2.0400  0.8500  0.4100
  H  2.2000  0.2500  0.0000
  Pd  2.2000  1.4000  0.8462
  Pt  2.2800  1.3500  0.8050
]
_symmetry_space_group_name_H-M [C2/m]
_cell_length_a [10.1192]
_cell_length_b [5.6169]
_cell_length_c [7.0796]
_cell_angle_alpha [90.0000]
_cell_angle_beta [113.0438]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [12]
_chemical_formula_structural [BHPdPt4]
_chemical_formula_sum '[B4 H4 Pd4 Pt16]'
_cell_volume [370.2847]
_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
[
  B  B0  4  0.2486  0.0000  0.9973  1.0
  Pd  Pd1  4  0.0627  0.0000  0.7219  1.0
  H  H2  4  0.1018  0.5000  0.5264  1.0
  Pt  Pt3  8  0.1477  0.2480  0.1319  1.0
  Pt  Pt4  4  0.0544  0.5000  0.7441  1.0
  Pt  Pt5  4  0.2373  0.0000  0.4977  1.0
]