data_[Ac3Hg1Pd8Pb2]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Ac  1.1000  1.9500  1.2600
  Hg  2.0000  1.5000  1.2450
  Pd  2.2000  1.4000  0.8462
  Pb  2.3300  1.8000  1.1225
]
_symmetry_space_group_name_H-M [P-3m1]
_cell_length_a [5.7050]
_cell_length_b [5.7050]
_cell_length_c [11.2371]
_cell_angle_alpha [90.0000]
_cell_angle_beta [90.0000]
_cell_angle_gamma [120.0000]
_symmetry_Int_Tables_number [164]
_chemical_formula_structural [Ac3Hg(Pd4Pb)2]
_chemical_formula_sum '[Ac3 Hg1 Pd8 Pb2]'
_cell_volume [316.7359]
_cell_formula_units_Z [1]
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  0.3333  0.6667  0.5916  1
  Ac  Ac1  1  0.0000  0.0000  0.0000  1
  Hg  Hg2  1  0.0000  0.0000  0.5000  1
  Pd  Pd3  6  0.1638  0.3276  0.2933  1
  Pd  Pd4  2  0.3333  0.6667  0.8540  1
  Pb  Pb5  2  0.3333  0.6667  0.1009  1
]