data_[Pr4Sb8Au8]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Pr  1.1300  1.8500  1.0600
  Sb  2.0500  1.4500  0.8300
  Au  2.5400  1.3500  1.0700
]
_symmetry_space_group_name_H-M [Cmcm]
_cell_length_a [4.5340]
_cell_length_b [23.8518]
_cell_length_c [4.5368]
_cell_angle_alpha [90.0000]
_cell_angle_beta [90.0000]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [63]
_chemical_formula_structural [Pr(SbAu)2]
_chemical_formula_sum '[Pr4 Sb8 Au8]'
_cell_volume [490.6279]
_cell_formula_units_Z [4]
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  0.0000  0.3544  0.7500  1.0
  Sb  Sb1  4  0.0000  0.1124  0.7500  1.0
  Sb  Sb2  4  0.0000  0.2502  0.2500  1.0
  Au  Au3  4  0.0000  0.0395  0.2500  1.0
  Au  Au4  4  0.0000  0.4610  0.2500  1.0
]