data_[Pr4Nd8Sc8]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Pr  1.1300  1.8500  1.0600
  Nd  1.1400  1.8500  1.2765
  Sc  1.3600  1.6000  0.8850
]
_symmetry_space_group_name_H-M [C2/m]
_cell_length_a [18.0609]
_cell_length_b [4.9040]
_cell_length_c [7.0968]
_cell_angle_alpha [90.0000]
_cell_angle_beta [101.4574]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [12]
_chemical_formula_structural [Pr(NdSc)2]
_chemical_formula_sum '[Pr4 Nd8 Sc8]'
_cell_volume [616.0465]
_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  0.1938  0.0000  0.8420  1.0
  Nd  Nd1  4  0.0954  0.5000  0.0503  1.0
  Nd  Nd2  4  0.1961  0.0000  0.3525  1.0
  Sc  Sc3  4  0.0008  0.0000  0.2668  1.0
  Sc  Sc4  4  0.0901  0.5000  0.5424  1.0
]