data_[Nd24Sb4Ru8]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Nd  1.1400  1.8500  1.2765
  Sb  2.0500  1.4500  0.8300
  Ru  2.2000  1.3000  0.6610
]
_symmetry_space_group_name_H-M [C2/c]
_cell_length_a [16.1184]
_cell_length_b [10.5797]
_cell_length_c [6.4506]
_cell_angle_alpha [90.0000]
_cell_angle_beta [104.4542]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [15]
_chemical_formula_structural [Nd6SbRu2]
_chemical_formula_sum '[Nd24 Sb4 Ru8]'
_cell_volume [1065.1843]
_cell_formula_units_Z [4]
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
[
  Nd  Nd0  8  0.1035  0.4160  0.1404  1.0
  Nd  Nd1  8  0.1145  0.0673  0.1883  1.0
  Nd  Nd2  8  0.1908  0.2534  0.7117  1.0
  Sb  Sb3  4  0.0000  0.2014  0.7500  1.0
  Ru  Ru4  8  0.2413  0.4981  0.9785  1.0
]