data_[La16Sm2Tm6]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  La  1.1000  1.9500  1.1720
  Sm  1.1700  1.8500  1.2290
  Tm  1.2500  1.7500  1.0950
]
_symmetry_space_group_name_H-M [C2]
_cell_length_a [15.8636]
_cell_length_b [8.9257]
_cell_length_c [6.4180]
_cell_angle_alpha [90.0000]
_cell_angle_beta [113.2914]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [5]
_chemical_formula_structural [La8SmTm3]
_chemical_formula_sum '[La16 Sm2 Tm6]'
_cell_volume [834.6972]
_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
[
  La  La0  4  0.0702  0.8273  0.8190  1
  La  La1  4  0.1277  0.1974  0.1363  1
  La  La2  4  0.1750  0.8359  0.4290  1
  La  La3  4  0.2490  0.5868  0.1422  1
  Sm  Sm4  2  0.0000  0.1419  0.5000  1
  Tm  Tm5  4  0.1198  0.4733  0.5961  1
  Tm  Tm6  2  0.0000  0.5167  0.0000  1
]