data_[Pr4Ag8Au4]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Pr  1.1300  1.8500  1.0600
  Ag  1.9300  1.6000  1.0867
  Au  2.5400  1.3500  1.0700
]
_symmetry_space_group_name_H-M [C2/c]
_cell_length_a [5.3331]
_cell_length_b [14.2330]
_cell_length_c [5.3971]
_cell_angle_alpha [90.0000]
_cell_angle_beta [117.6068]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [15]
_chemical_formula_structural [PrAg2Au]
_chemical_formula_sum '[Pr4 Ag8 Au4]'
_cell_volume [363.0289]
_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  0.1302  0.2500  1.0
  Ag  Ag1  8  0.1802  0.4255  0.1045  1.0
  Au  Au2  4  0.0000  0.2500  0.7500  1.0
]