data_[Pr1Zn2Pd5Au1]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Pr  1.1300  1.8500  1.0600
  Zn  1.6500  1.3500  0.8800
  Pd  2.2000  1.4000  0.8462
  Au  2.5400  1.3500  1.0700
]
_symmetry_space_group_name_H-M [P4/mmm]
_cell_length_a [4.6584]
_cell_length_b [4.6584]
_cell_length_c [7.5468]
_cell_angle_alpha [90.0000]
_cell_angle_beta [90.0000]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [123]
_chemical_formula_structural [PrZn2Pd5Au]
_chemical_formula_sum '[Pr1 Zn2 Pd5 Au1]'
_cell_volume [163.7693]
_cell_formula_units_Z [1]
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  1  0.0000  0.0000  0.5000  1
  Zn  Zn1  2  0.5000  0.5000  0.1558  1
  Pd  Pd2  4  0.0000  0.5000  0.2477  1
  Pd  Pd3  1  0.5000  0.5000  0.5000  1
  Au  Au4  1  0.0000  0.0000  0.0000  1
]