data_[Tb4Dy2Sc2Tl4]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Tb  1.1000  1.7500  0.9815
  Dy  1.2200  1.7500  1.1310
  Sc  1.3600  1.6000  0.8850
  Tl  1.6200  1.9000  1.3325
]
_symmetry_space_group_name_H-M [Pmc2_1]
_cell_length_a [4.9889]
_cell_length_b [9.7591]
_cell_length_c [6.9054]
_cell_angle_alpha [90.0000]
_cell_angle_beta [90.0000]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [26]
_chemical_formula_structural [Tb2DyScTl2]
_chemical_formula_sum '[Tb4 Dy2 Sc2 Tl4]'
_cell_volume [336.2076]
_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  0.1891  0.3429  1.0
  Tb  Tb1  2  0.5000  0.0481  0.0547  1.0
  Dy  Dy2  2  0.0000  0.4534  0.9565  1.0
  Sc  Sc3  2  0.5000  0.3066  0.6674  1.0
  Tl  Tl4  2  0.0000  0.1404  0.7960  1.0
  Tl  Tl5  2  0.5000  0.3815  0.2281  1.0
]