data_[La8Sm2Tm6]
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 [Pmn2_1]
_cell_length_a [11.7398]
_cell_length_b [7.3281]
_cell_length_c [6.3879]
_cell_angle_alpha [90.0000]
_cell_angle_beta [90.0000]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [31]
_chemical_formula_structural [La4SmTm3]
_chemical_formula_sum '[La8 Sm2 Tm6]'
_cell_volume [549.5526]
_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  0.2418  0.8752  0.4784  1.0
  La  La1  2  0.0000  0.1316  0.6617  1.0
  La  La2  2  0.0000  0.8701  0.1383  1.0
  Sm  Sm3  2  0.0000  0.3750  0.1524  1.0
  Tm  Tm4  4  0.2499  0.6179  0.9788  1.0
  Tm  Tm5  2  0.0000  0.6163  0.6487  1.0
]