data_[Pr12Dy4Y2Sc2]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Pr  1.1300  1.8500  1.0600
  Dy  1.2200  1.7500  1.1310
  Y  1.2200  1.8000  1.0400
  Sc  1.3600  1.6000  0.8850
]
_symmetry_space_group_name_H-M [C2/m]
_cell_length_a [11.5314]
_cell_length_b [7.0256]
_cell_length_c [8.7985]
_cell_angle_alpha [90.0000]
_cell_angle_beta [102.3586]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [12]
_chemical_formula_structural [Pr6Dy2YSc]
_chemical_formula_sum '[Pr12 Dy4 Y2 Sc2]'
_cell_volume [696.2876]
_cell_formula_units_Z [2]
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  0.1612  0.2445  0.7974  1
  Pr  Pr1  4  0.1239  0.5000  0.3998  1
  Dy  Dy2  4  0.0935  0.0000  0.1606  1
  Y  Y3  2  0.0000  0.0000  0.5000  1
  Sc  Sc4  2  0.0000  0.5000  0.0000  1
]