data_[Pr24Er8Sc4]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Pr  1.1300  1.8500  1.0600
  Er  1.2400  1.7500  1.0300
  Sc  1.3600  1.6000  0.8850
]
_symmetry_space_group_name_H-M [C2/c]
_cell_length_a [16.3349]
_cell_length_b [11.8813]
_cell_length_c [6.2469]
_cell_angle_alpha [90.0000]
_cell_angle_beta [96.6145]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [15]
_chemical_formula_structural [Pr6Er2Sc]
_chemical_formula_sum '[Pr24 Er8 Sc4]'
_cell_volume [1204.3161]
_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  0.0501  0.3595  0.5123  1
  Pr  Pr1  8  0.1106  0.1352  0.8243  1
  Pr  Pr2  8  0.2114  0.1395  0.3521  1
  Er  Er3  8  0.1701  0.3957  0.0761  1
  Sc  Sc4  4  0.0000  0.1087  0.2500  1
]