data_[Pr4Sb2As2Pd12]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Pr  1.1300  1.8500  1.0600
  Sb  2.0500  1.4500  0.8300
  As  2.1800  1.1500  0.6600
  Pd  2.2000  1.4000  0.8462
]
_symmetry_space_group_name_H-M [Pmmn]
_cell_length_a [5.5685]
_cell_length_b [8.8215]
_cell_length_c [8.7467]
_cell_angle_alpha [90.0000]
_cell_angle_beta [90.0000]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [59]
_chemical_formula_structural [Pr2SbAsPd6]
_chemical_formula_sum '[Pr4 Sb2 As2 Pd12]'
_cell_volume [429.6558]
_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  4  0.0000  0.2529  0.2595  1.0
  Sb  Sb1  2  0.0000  0.5000  0.7274  1.0
  As  As2  2  0.0000  0.0000  0.7535  1.0
  Pd  Pd3  4  0.0000  0.2482  0.8938  1.0
  Pd  Pd4  4  0.2469  0.0000  0.5218  1.0
  Pd  Pd5  4  0.2491  0.5000  0.9990  1.0
]