data_[Sm8Y8In4]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Sm  1.1700  1.8500  1.2290
  Y  1.2200  1.8000  1.0400
  In  1.7800  1.5500  0.9400
]
_symmetry_space_group_name_H-M [C2/m]
_cell_length_a [12.2210]
_cell_length_b [5.5144]
_cell_length_c [9.5393]
_cell_angle_alpha [90.0000]
_cell_angle_beta [105.2427]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [12]
_chemical_formula_structural [Sm2Y2In]
_chemical_formula_sum '[Sm8 Y8 In4]'
_cell_volume [620.2606]
_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  4  0.0217  0.5000  0.8399  1.0
  Sm  Sm1  4  0.1581  0.5000  0.5534  1.0
  Y  Y2  4  0.0246  0.0000  0.3423  1.0
  Y  Y3  4  0.1543  0.0000  0.0510  1.0
  In  In4  4  0.2473  0.0000  0.7553  1.0
]