data_[Nd16Sb2Ru4]
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/m]
_cell_length_a [8.8392]
_cell_length_b [13.5979]
_cell_length_c [5.7269]
_cell_angle_alpha [90.0000]
_cell_angle_beta [104.8194]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [12]
_chemical_formula_structural [Nd8SbRu2]
_chemical_formula_sum '[Nd16 Sb2 Ru4]'
_cell_volume [665.4405]
_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
[
  Nd  Nd0  8  0.2008  0.1269  0.0644  1
  Nd  Nd1  4  0.0000  0.2459  0.5000  1
  Nd  Nd2  4  0.1079  0.5000  0.3008  1
  Sb  Sb3  2  0.0000  0.0000  0.5000  1
  Ru  Ru4  4  0.0000  0.2990  0.0000  1
]