data_[Ac12Pd2Pb4]
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
  Pb  2.3300  1.8000  1.1225
]
_symmetry_space_group_name_H-M [P2_1/c]
_cell_length_a [7.1213]
_cell_length_b [9.0283]
_cell_length_c [13.0048]
_cell_angle_alpha [90.0000]
_cell_angle_beta [122.2554]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [14]
_chemical_formula_structural [Ac6PdPb2]
_chemical_formula_sum '[Ac12 Pd2 Pb4]'
_cell_volume [707.0935]
_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  4  0.0762  0.6815  0.9461  1
  Ac  Ac1  4  0.3196  0.1803  0.9466  1
  Ac  Ac2  4  0.3690  0.5293  0.7421  1
  Pd  Pd3  2  0.5000  0.0000  0.5000  1
  Pb  Pb4  4  0.1657  0.6198  0.2490  1
]