data_[Pr6Pt45Pb6]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Pr  1.1300  1.8500  1.0600
  Pt  2.2800  1.3500  0.8050
  Pb  2.3300  1.8000  1.1225
]
_symmetry_space_group_name_H-M [R-3m]
_cell_length_a [9.5663]
_cell_length_b [9.5663]
_cell_length_c [13.4780]
_cell_angle_alpha [90.0000]
_cell_angle_beta [90.0000]
_cell_angle_gamma [120.0000]
_symmetry_Int_Tables_number [166]
_chemical_formula_structural [Pr2Pt15Pb2]
_chemical_formula_sum '[Pr6 Pt45 Pb6]'
_cell_volume [1068.1682]
_cell_formula_units_Z [3]
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  6  0.0000  0.0000  0.3559  1.0
  Pt  Pt1  18  0.0000  0.3299  0.0000  1.0
  Pt  Pt2  18  0.0098  0.5049  0.1642  1.0
  Pt  Pt3  9  0.0000  0.5000  0.5000  1.0
  Pb  Pb4  6  0.0000  0.0000  0.1068  1.0
]