data_[Pr4Sb4Au4]
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 [Cc]
_cell_length_a [6.3187]
_cell_length_b [6.3526]
_cell_length_c [8.6612]
_cell_angle_alpha [90.0000]
_cell_angle_beta [110.2957]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [9]
_chemical_formula_structural [PrSbAu]
_chemical_formula_sum '[Pr4 Sb4 Au4]'
_cell_volume [326.0749]
_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  0.2204  0.3599  0.6665  1.0
  Sb  Sb1  4  0.1557  0.1411  0.9981  1.0
  Au  Au2  4  0.2450  0.1896  0.3274  1.0
]