data_[Pr4Cd5Pd2]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Pr  1.1300  1.8500  1.0600
  Cd  1.6900  1.5500  1.0900
  Pd  2.2000  1.4000  0.8462
]
_symmetry_space_group_name_H-M [P2/m]
_cell_length_a [7.8006]
_cell_length_b [3.8572]
_cell_length_c [9.7877]
_cell_angle_alpha [90.0000]
_cell_angle_beta [94.2114]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [10]
_chemical_formula_structural [Pr4Cd5Pd2]
_chemical_formula_sum '[Pr4 Cd5 Pd2]'
_cell_volume [293.7014]
_cell_formula_units_Z [1]
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  0.1716  0.5000  0.8594  1
  Pr  Pr1  2  0.2375  0.5000  0.4433  1
  Cd  Cd2  2  0.1853  0.0000  0.1522  1
  Cd  Cd3  2  0.4490  0.0000  0.6881  1
  Cd  Cd4  1  0.5000  0.0000  0.0000  1
  Pd  Pd5  2  0.0681  0.0000  0.6374  1
]