data_[Pr2Sm6Sc3]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Pr  1.1300  1.8500  1.0600
  Sm  1.1700  1.8500  1.2290
  Sc  1.3600  1.6000  0.8850
]
_symmetry_space_group_name_H-M [P-1]
_cell_length_a [5.9703]
_cell_length_b [8.3652]
_cell_length_c [8.4464]
_cell_angle_alpha [106.3078]
_cell_angle_beta [107.6189]
_cell_angle_gamma [107.6703]
_symmetry_Int_Tables_number [2]
_chemical_formula_structural [Pr2(Sm2Sc)3]
_chemical_formula_sum '[Pr2 Sm6 Sc3]'
_cell_volume [349.3375]
_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  2  0.0431  0.8175  0.3578  1
  Sm  Sm1  2  0.0803  0.6444  0.7105  1
  Sm  Sm2  2  0.3438  0.4512  0.1208  1
  Sm  Sm3  2  0.4878  0.0940  0.8342  1
  Sc  Sc4  2  0.4370  0.2714  0.4394  1
  Sc  Sc5  1  0.0000  0.0000  0.0000  1
]