data_[Pr2Pd10Au14]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Pr  1.1300  1.8500  1.0600
  Pd  2.2000  1.4000  0.8462
  Au  2.5400  1.3500  1.0700
]
_symmetry_space_group_name_H-M [Imm2]
_cell_length_a [5.5339]
_cell_length_b [9.3728]
_cell_length_c [9.3052]
_cell_angle_alpha [90.0000]
_cell_angle_beta [90.0000]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [44]
_chemical_formula_structural [PrPd5Au7]
_chemical_formula_sum '[Pr2 Pd10 Au14]'
_cell_volume [482.6452]
_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  2  0.0000  0.0000  0.9935  1.0
  Pd  Pd1  8  0.2497  0.2485  0.7512  1.0
  Pd  Pd2  2  0.0000  0.5000  0.2754  1.0
  Au  Au3  4  0.0000  0.2925  0.4998  1.0
  Au  Au4  4  0.0000  0.3433  0.0033  1.0
  Au  Au5  2  0.0000  0.0000  0.3372  1.0
  Au  Au6  2  0.0000  0.0000  0.6578  1.0
  Au  Au7  2  0.0000  0.5000  0.7249  1.0
]