data_[La2Tb4Sm2Tl4]
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
  Tl  1.6200  1.9000  1.3325
]
_symmetry_space_group_name_H-M [Pmc2_1]
_cell_length_a [5.2289]
_cell_length_b [10.2233]
_cell_length_c [6.8628]
_cell_angle_alpha [90.0000]
_cell_angle_beta [90.0000]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [26]
_chemical_formula_structural [LaTb2SmTl2]
_chemical_formula_sum '[La2 Tb4 Sm2 Tl4]'
_cell_volume [366.8598]
_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  2  0.0000  0.1814  0.3335  1.0
  La  La1  2  0.0000  0.4570  0.9522  1.0
  Tb  Tb2  2  0.5000  0.0428  0.0534  1.0
  Sm  Sm3  2  0.5000  0.3076  0.6869  1.0
  Tl  Tl4  2  0.0000  0.1284  0.7995  1.0
  Tl  Tl5  2  0.5000  0.3560  0.2201  1.0
]