data_[Ac3Hg1P2Pt9]
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
  P  2.1900  1.0000  0.5500
  Pt  2.2800  1.3500  0.8050
]
_symmetry_space_group_name_H-M [P-3m1]
_cell_length_a [7.3350]
_cell_length_b [7.3350]
_cell_length_c [7.1242]
_cell_angle_alpha [90.0000]
_cell_angle_beta [90.0000]
_cell_angle_gamma [120.0000]
_symmetry_Int_Tables_number [164]
_chemical_formula_structural [Ac3HgP2Pt9]
_chemical_formula_sum '[Ac3 Hg1 P2 Pt9]'
_cell_volume [331.9489]
_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  0.6646  1
  Ac  Ac1  1  0.0000  0.0000  0.0000  1
  Hg  Hg2  1  0.0000  0.0000  0.5000  1
  P  P3  2  0.3333  0.6667  0.1287  1
  Pt  Pt4  6  0.1858  0.3716  0.3186  1
  Pt  Pt5  3  0.0000  0.5000  0.0000  1
]