data_[La3Tb6Tm3Tl12]
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
  Tm  1.2500  1.7500  1.0950
  Tl  1.6200  1.9000  1.3325
]
_symmetry_space_group_name_H-M [R-3m]
_cell_length_a [5.4267]
_cell_length_b [5.4267]
_cell_length_c [26.8013]
_cell_angle_alpha [90.0000]
_cell_angle_beta [90.0000]
_cell_angle_gamma [120.0000]
_symmetry_Int_Tables_number [166]
_chemical_formula_structural [LaTb2TmTl4]
_chemical_formula_sum '[La3 Tb6 Tm3 Tl12]'
_cell_volume [683.5268]
_cell_formula_units_Z [3]
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  6  0.0000  0.0000  0.2487  1
  La  La1  3  0.0000  0.0000  0.0000  1
  Tm  Tm2  3  -0.0000  -0.0000  0.5000  1
  Tl  Tl3  6  0.0000  0.0000  0.1275  1
  Tl  Tl4  6  0.0000  0.0000  0.3780  1
]