data_[Pr8Si8Pd4]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Pr  1.1300  1.8500  1.0600
  Si  1.9000  1.1000  0.5400
  Pd  2.2000  1.4000  0.8462
]
_symmetry_space_group_name_H-M [C2/m]
_cell_length_a [11.0001]
_cell_length_b [4.3513]
_cell_length_c [11.0297]
_cell_angle_alpha [90.0000]
_cell_angle_beta [117.7511]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [12]
_chemical_formula_structural [Pr2Si2Pd]
_chemical_formula_sum '[Pr8 Si8 Pd4]'
_cell_volume [467.2131]
_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  0.1006  0.0000  0.8987  1.0
  Pr  Pr1  4  0.2076  0.5000  0.6478  1.0
  Si  Si2  4  0.0342  0.0000  0.4128  1.0
  Si  Si3  4  0.1112  0.5000  0.1090  1.0
  Pd  Pd4  4  0.0639  0.5000  0.3163  1.0
]