data_[Ac12Pd2Pt6]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Ac  1.1000  1.9500  1.2600
  Pd  2.2000  1.4000  0.8462
  Pt  2.2800  1.3500  0.8050
]
_symmetry_space_group_name_H-M [P2_1/m]
_cell_length_a [12.7281]
_cell_length_b [4.3934]
_cell_length_c [13.4876]
_cell_angle_alpha [90.0000]
_cell_angle_beta [112.7518]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [11]
_chemical_formula_structural [Ac6PdPt3]
_chemical_formula_sum '[Ac12 Pd2 Pt6]'
_cell_volume [695.5398]
_cell_formula_units_Z [2]
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  0.0646  0.2500  0.3981  1
  Ac  Ac1  2  0.0968  0.2500  0.9374  1
  Ac  Ac2  2  0.2541  0.7500  0.2383  1
  Ac  Ac3  2  0.2583  0.2500  0.7383  1
  Ac  Ac4  2  0.4054  0.7500  0.5705  1
  Ac  Ac5  2  0.4450  0.2500  0.0953  1
  Pd  Pd6  2  0.3061  0.7500  0.9268  1
  Pt  Pt7  2  0.0795  0.2500  0.1614  1
  Pt  Pt8  2  0.1638  0.7500  0.5654  1
  Pt  Pt9  2  0.4943  0.2500  0.7322  1
]