data_[Pr10Nd8Al2]
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
  Al  1.6100  1.2500  0.6750
]
_symmetry_space_group_name_H-M [I4mm]
_cell_length_a [10.8076]
_cell_length_b [10.8076]
_cell_length_c [6.0042]
_cell_angle_alpha [90.0000]
_cell_angle_beta [90.0000]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [107]
_chemical_formula_structural [Pr5Nd4Al]
_chemical_formula_sum '[Pr10 Nd8 Al2]'
_cell_volume [701.3174]
_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  0.1841  0.1841  0.0343  1
  Pr  Pr1  2  0.0000  0.0000  0.3488  1
  Nd  Nd2  8  0.0000  0.3116  0.5445  1
  Al  Al3  2  0.0000  0.0000  0.8255  1
]