data_[Sm16Ru4Rh8]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Sm  1.1700  1.8500  1.2290
  Ru  2.2000  1.3000  0.6610
  Rh  2.2800  1.3500  0.7450
]
_symmetry_space_group_name_H-M [I2_12_12_1]
_cell_length_a [8.7281]
_cell_length_b [8.7455]
_cell_length_c [8.7716]
_cell_angle_alpha [90.0000]
_cell_angle_beta [90.0000]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [24]
_chemical_formula_structural [Sm4RuRh2]
_chemical_formula_sum '[Sm16 Ru4 Rh8]'
_cell_volume [669.5492]
_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
[
  Sm  Sm0  8  0.0546  0.4460  0.9410  1.0
  Sm  Sm1  8  0.1871  0.1875  0.3150  1.0
  Ru  Ru2  4  0.0000  0.2500  0.6550  1.0
  Rh  Rh3  4  0.1436  0.5000  0.2500  1.0
  Rh  Rh4  4  0.2500  0.1533  0.0000  1.0
]