data_[Sm12Ru2Rh4]
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 [P2_1/c]
_cell_length_a [6.6877]
_cell_length_b [7.4360]
_cell_length_c [11.8737]
_cell_angle_alpha [90.0000]
_cell_angle_beta [123.1290]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [14]
_chemical_formula_structural [Sm6RuRh2]
_chemical_formula_sum '[Sm12 Ru2 Rh4]'
_cell_volume [494.4874]
_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
[
  Sm  Sm0  4  0.0865  0.5442  0.7447  1.0
  Sm  Sm1  4  0.2329  0.1710  0.5750  1.0
  Sm  Sm2  4  0.3915  0.6765  0.5680  1.0
  Ru  Ru3  2  0.5000  0.0000  0.5000  1.0
  Rh  Rh4  4  0.3144  0.6210  0.2701  1.0
]