data_[Sm6In6Ru4]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Sm  1.1700  1.8500  1.2290
  In  1.7800  1.5500  0.9400
  Ru  2.2000  1.3000  0.6610
]
_symmetry_space_group_name_H-M [C2/m]
_cell_length_a [16.5588]
_cell_length_b [4.7010]
_cell_length_c [5.1929]
_cell_angle_alpha [90.0000]
_cell_angle_beta [99.9082]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [12]
_chemical_formula_structural [Sm3In3Ru2]
_chemical_formula_sum '[Sm6 In6 Ru4]'
_cell_volume [398.2043]
_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  0.1666  0.0000  0.5762  1.0
  Sm  Sm1  2  0.0000  0.0000  0.0000  1.0
  In  In2  4  0.1305  0.5000  0.0696  1.0
  In  In3  2  0.0000  0.5000  0.5000  1.0
  Ru  Ru4  4  0.2144  0.0000  0.0904  1.0
]