data_[Ac12La8Pt12]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Ac  1.1000  1.9500  1.2600
  La  1.1000  1.9500  1.1720
  Pt  2.2800  1.3500  0.8050
]
_symmetry_space_group_name_H-M [Cm]
_cell_length_a [13.5154]
_cell_length_b [5.9648]
_cell_length_c [14.8644]
_cell_angle_alpha [90.0000]
_cell_angle_beta [91.3885]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [8]
_chemical_formula_structural [Ac3La2Pt3]
_chemical_formula_sum '[Ac12 La8 Pt12]'
_cell_volume [1197.9613]
_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
[
  Ac  Ac0  2  0.0491  0.0000  0.6186  1
  Ac  Ac1  2  0.0555  0.0000  0.8802  1
  Ac  Ac2  2  0.1478  0.5000  0.4263  1
  La  La3  2  0.1708  0.5000  0.0637  1
  Ac  Ac4  2  0.2504  0.5000  0.7508  1
  Ac  Ac5  2  0.2527  0.0000  0.2522  1
  La  La6  2  0.3275  0.0000  0.5649  1
  La  La7  2  0.3393  0.0000  0.9347  1
  La  La8  2  0.4327  0.5000  0.3855  1
  Ac  Ac9  2  0.4543  0.5000  0.1243  1
  Pt  Pt10  2  0.1442  0.0000  0.4395  1
  Pt  Pt11  2  0.1632  0.0000  0.0561  1
  Pt  Pt12  2  0.2265  0.0000  0.7499  1
  Pt  Pt13  2  0.2763  0.5000  0.2477  1
  Pt  Pt14  2  0.3359  0.5000  0.5553  1
  Pt  Pt15  2  0.3472  0.5000  0.9460  1
]