data_[Ac6H9Pd36Pt3]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Ac  1.1000  1.9500  1.2600
  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 [R-3m]
_cell_length_a [7.2792]
_cell_length_b [7.2792]
_cell_length_c [18.9811]
_cell_angle_alpha [90.0000]
_cell_angle_beta [90.0000]
_cell_angle_gamma [120.0000]
_symmetry_Int_Tables_number [166]
_chemical_formula_structural [Ac2H3Pd12Pt]
_chemical_formula_sum '[Ac6 H9 Pd36 Pt3]'
_cell_volume [870.9929]
_cell_formula_units_Z [3]
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
[
  Ac  Ac0  6  0.0000  0.0000  0.4010  1
  Pd  Pd1  18  0.0625  0.5312  0.3886  1
  Pd  Pd2  18  0.0818  0.5409  0.8154  1
  H  H3  9  0.0000  0.5000  0.5000  1
  Pt  Pt4  3  0.0000  0.0000  0.0000  1
]