data_[Pr6Al4Au8]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Pr  1.1300  1.8500  1.0600
  Al  1.6100  1.2500  0.6750
  Au  2.5400  1.3500  1.0700
]
_symmetry_space_group_name_H-M [C2/m]
_cell_length_a [11.1939]
_cell_length_b [4.6312]
_cell_length_c [8.8896]
_cell_angle_alpha [90.0000]
_cell_angle_beta [113.6089]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [12]
_chemical_formula_structural [Pr3(AlAu2)2]
_chemical_formula_sum '[Pr6 Al4 Au8]'
_cell_volume [422.2767]
_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
[
  Pr  Pr0  4  0.1369  0.5000  0.6904  1.0
  Pr  Pr1  2  0.0000  0.0000  0.0000  1.0
  Al  Al2  4  0.1615  0.5000  0.3338  1.0
  Au  Au3  4  0.0918  0.0000  0.4088  1.0
  Au  Au4  4  0.2151  0.5000  0.0725  1.0
]