data_[Ac16Al24Pt8]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Ac  1.1000  1.9500  1.2600
  Al  1.6100  1.2500  0.6750
  Pt  2.2800  1.3500  0.8050
]
_symmetry_space_group_name_H-M [Fmmm]
_cell_length_a [8.9773]
_cell_length_b [9.2334]
_cell_length_c [15.4499]
_cell_angle_alpha [90.0000]
_cell_angle_beta [90.0000]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [69]
_chemical_formula_structural [Ac2Al3Pt]
_chemical_formula_sum '[Ac16 Al24 Pt8]'
_cell_volume [1280.6535]
_cell_formula_units_Z [8]
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  8  0.0000  0.2400  0.5000  1
  Ac  Ac1  8  0.2500  0.2500  0.2500  1
  Al  Al2  16  0.2475  0.0000  0.4147  1
  Al  Al3  8  0.0000  0.0000  0.1697  1
  Pt  Pt4  8  0.0000  0.0000  0.3337  1
]