data_[La2Tb12Sm5]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  La  1.1000  1.9500  1.1720
  Tb  1.1000  1.7500  0.9815
  Sm  1.1700  1.8500  1.2290
]
_symmetry_space_group_name_H-M [P-1]
_cell_length_a [6.8671]
_cell_length_b [6.8712]
_cell_length_c [15.1217]
_cell_angle_alpha [79.8712]
_cell_angle_beta [87.3630]
_cell_angle_gamma [64.6406]
_symmetry_Int_Tables_number [2]
_chemical_formula_structural [La2Tb12Sm5]
_chemical_formula_sum '[La2 Tb12 Sm5]'
_cell_volume [634.3735]
_cell_formula_units_Z [1]
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
[
  La  La0  2  0.0112  0.7379  0.0329  1
  Tb  Tb1  2  0.0170  0.1159  0.3871  1
  Tb  Tb2  2  0.0675  0.6103  0.4193  1
  Tb  Tb3  2  0.2355  0.5670  0.8237  1
  Tb  Tb4  2  0.2498  0.0839  0.7537  1
  Tb  Tb5  2  0.2595  0.9152  0.1884  1
  Tb  Tb6  2  0.2809  0.3771  0.2462  1
  Sm  Sm7  2  0.4441  0.4250  0.6140  1
  Sm  Sm8  2  0.4959  0.2350  0.0355  1
  Sm  Sm9  1  0.5000  0.0000  0.5000  1
]