data_[Pr1Nd7Sc4]
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 [P-1]
_cell_length_a [6.1907]
_cell_length_b [7.1571]
_cell_length_c [8.7752]
_cell_angle_alpha [89.9066]
_cell_angle_beta [76.3859]
_cell_angle_gamma [89.9608]
_symmetry_Int_Tables_number [2]
_chemical_formula_structural [PrNd7Sc4]
_chemical_formula_sum '[Pr1 Nd7 Sc4]'
_cell_volume [377.8823]
_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  1  0.0000  0.0000  0.0000  1
  Nd  Nd1  2  0.2262  0.0009  0.3371  1
  Nd  Nd2  2  0.2885  0.7421  0.6586  1
  Nd  Nd3  2  0.4991  0.2588  0.9898  1
  Nd  Nd4  1  0.0000  0.5000  0.0000  1
  Sc  Sc5  2  0.2122  0.4988  0.3417  1
  Sc  Sc6  2  0.2709  0.2616  0.6623  1
]