data_[Ac6Sn10Au12]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Ac  1.1000  1.9500  1.2600
  Sn  1.9600  1.4500  0.8300
  Au  2.5400  1.3500  1.0700
]
_symmetry_space_group_name_H-M [Pmmn]
_cell_length_a [4.8266]
_cell_length_b [14.2076]
_cell_length_c [10.3745]
_cell_angle_alpha [90.0000]
_cell_angle_beta [90.0000]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [59]
_chemical_formula_structural [Ac3Sn5Au6]
_chemical_formula_sum '[Ac6 Sn10 Au12]'
_cell_volume [711.4284]
_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  0.0000  0.3145  0.7535  1
  Ac  Ac1  2  0.0000  0.0000  0.7623  1
  Sn  Sn2  4  0.0000  0.1345  0.4781  1
  Sn  Sn3  4  0.0000  0.3398  0.1208  1
  Sn  Sn4  2  0.0000  0.0000  0.2098  1
  Au  Au5  4  0.0000  0.1526  0.0181  1
  Au  Au6  4  0.0000  0.3299  0.3855  1
  Au  Au7  2  0.0000  0.5000  0.5404  1
  Au  Au8  2  0.0000  0.5000  0.9572  1
]