data_[Pr3Nd9Ru24]
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
  Ru  2.2000  1.3000  0.6610
]
_symmetry_space_group_name_H-M [R3m]
_cell_length_a [5.4282]
_cell_length_b [5.4282]
_cell_length_c [26.7049]
_cell_angle_alpha [90.0000]
_cell_angle_beta [90.0000]
_cell_angle_gamma [120.0000]
_symmetry_Int_Tables_number [160]
_chemical_formula_structural [PrNd3Ru8]
_chemical_formula_sum '[Pr3 Nd9 Ru24]'
_cell_volume [681.4548]
_cell_formula_units_Z [3]
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  3  0.0000  0.0000  0.8737  1
  Nd  Nd1  3  0.0000  0.0000  0.3738  1
  Nd  Nd2  3  0.0000  0.0000  0.4985  1
  Nd  Nd3  3  0.0000  0.0000  0.9985  1
  Ru  Ru4  9  0.1711  0.3422  0.2706  1
  Ru  Ru5  9  0.1716  0.3432  0.7701  1
  Ru  Ru6  3  0.0000  0.0000  0.1916  1
  Ru  Ru7  3  0.0000  0.0000  0.6917  1
]