data_[Nd24Sn2Ru10]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Nd  1.1400  1.8500  1.2765
  Sn  1.9600  1.4500  0.8300
  Ru  2.2000  1.3000  0.6610
]
_symmetry_space_group_name_H-M [Immm]
_cell_length_a [9.6283]
_cell_length_b [9.8982]
_cell_length_c [10.5258]
_cell_angle_alpha [90.0000]
_cell_angle_beta [90.0000]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [71]
_chemical_formula_structural [Nd12SnRu5]
_chemical_formula_sum '[Nd24 Sn2 Ru10]'
_cell_volume [1003.1489]
_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  0.0000  0.1892  0.2262  1
  Nd  Nd1  8  0.1857  0.5000  0.1726  1
  Nd  Nd2  8  0.2201  0.3203  0.5000  1
  Sn  Sn3  2  0.0000  0.0000  0.5000  1
  Ru  Ru4  4  0.0000  0.3341  0.0000  1
  Ru  Ru5  4  0.0000  0.5000  0.3790  1
  Ru  Ru6  2  0.0000  0.0000  0.0000  1
]