data_[Sm16In4Ru4]
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/c]
_cell_length_a [8.8966]
_cell_length_b [13.1796]
_cell_length_c [6.2874]
_cell_angle_alpha [90.0000]
_cell_angle_beta [107.4942]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [15]
_chemical_formula_structural [Sm4InRu]
_chemical_formula_sum '[Sm16 In4 Ru4]'
_cell_volume [703.1157]
_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  0.1086  0.1673  0.0476  1.0
  Sm  Sm1  8  0.2165  0.4209  0.3957  1.0
  In  In2  4  0.0000  0.3762  0.7500  1.0
  Ru  Ru3  4  0.0000  0.0003  0.2500  1.0
]