data_[Pr16Ni4Rh2]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Pr  1.1300  1.8500  1.0600
  Ni  1.9100  1.3500  0.7400
  Rh  2.2800  1.3500  0.7450
]
_symmetry_space_group_name_H-M [C2/m]
_cell_length_a [18.5927]
_cell_length_b [5.2296]
_cell_length_c [6.7242]
_cell_angle_alpha [90.0000]
_cell_angle_beta [107.7354]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [12]
_chemical_formula_structural [Pr8Ni2Rh]
_chemical_formula_sum '[Pr16 Ni4 Rh2]'
_cell_volume [622.7366]
_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  0.0346  0.0000  0.7979  1.0
  Pr  Pr1  4  0.0900  0.5000  0.4563  1.0
  Pr  Pr2  4  0.1770  0.5000  0.9985  1.0
  Pr  Pr3  4  0.1976  0.0000  0.3519  1.0
  Ni  Ni4  4  0.1738  0.0000  0.7448  1.0
  Rh  Rh5  2  0.0000  0.5000  0.0000  1.0
]