data_[Pr9Zn24Pd3]
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
]
_symmetry_space_group_name_H-M [R3m]
_cell_length_a [5.4422]
_cell_length_b [5.4422]
_cell_length_c [27.3460]
_cell_angle_alpha [90.0000]
_cell_angle_beta [90.0000]
_cell_angle_gamma [120.0000]
_symmetry_Int_Tables_number [160]
_chemical_formula_structural [Pr3Zn8Pd]
_chemical_formula_sum '[Pr9 Zn24 Pd3]'
_cell_volume [701.4162]
_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  3  0.0000  0.0000  0.0079  1.0
  Pr  Pr1  3  0.0000  0.0000  0.4954  1.0
  Pr  Pr2  3  0.0000  0.0000  0.6235  1.0
  Zn  Zn3  9  0.0006  0.5003  0.0648  1.0
  Zn  Zn4  9  0.1683  0.3367  0.8936  1.0
  Zn  Zn5  3  0.0000  0.0000  0.3148  1.0
  Zn  Zn6  3  0.0000  0.0000  0.8110  1.0
  Pd  Pd7  3  0.0000  0.0000  0.1224  1.0
]