data_[Pr24Nd8Sc4]
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/c]
_cell_length_a [16.7011]
_cell_length_b [11.9295]
_cell_length_c [6.2743]
_cell_angle_alpha [90.0000]
_cell_angle_beta [97.0855]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [15]
_chemical_formula_structural [Pr6Nd2Sc]
_chemical_formula_sum '[Pr24 Nd8 Sc4]'
_cell_volume [1240.5128]
_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  8  0.0510  0.3609  0.5122  1
  Pr  Pr1  8  0.1057  0.1339  0.8262  1
  Pr  Pr2  8  0.2069  0.1335  0.3606  1
  Nd  Nd3  8  0.1725  0.3912  0.0679  1
  Sc  Sc4  4  0.0000  0.1100  0.2500  1
]