data_[Tb12Sm4Y6In2]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Tb  1.1000  1.7500  0.9815
  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 [6.1328]
_cell_length_b [10.6314]
_cell_length_c [11.7553]
_cell_angle_alpha [90.0000]
_cell_angle_beta [100.0110]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [12]
_chemical_formula_structural [Tb6Sm2Y3In]
_chemical_formula_sum '[Tb12 Sm4 Y6 In2]'
_cell_volume [754.7704]
_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
[
  Tb  Tb0  8  0.2462  0.8363  0.2479  1.0
  Tb  Tb1  4  0.2450  0.0000  0.7509  1.0
  Sm  Sm2  4  0.0000  0.3338  0.0000  1.0
  Y  Y3  4  0.0000  0.1667  0.5000  1.0
  Y  Y4  2  0.0000  0.5000  0.5000  1.0
  In  In5  2  0.0000  0.0000  0.0000  1.0
]