data_[Pr4Be2Al2Au12]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Pr  1.1300  1.8500  1.0600
  Be  1.5700  1.0500  0.5900
  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 [11.2199]
_cell_length_b [6.4505]
_cell_length_c [7.0742]
_cell_angle_alpha [90.0000]
_cell_angle_beta [123.7902]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [12]
_chemical_formula_structural [Pr2BeAlAu6]
_chemical_formula_sum '[Pr4 Be2 Al2 Au12]'
_cell_volume [425.5062]
_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  0.2165  0.0000  0.6611  1.0
  Be  Be1  2  0.0000  0.0000  0.0000  1.0
  Al  Al2  2  0.0000  0.5000  0.5000  1.0
  Au  Au3  8  0.0133  0.2686  0.8012  1.0
  Au  Au4  4  0.2420  0.0000  0.1528  1.0
]