data_[Tb7Dy4Tl1]
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
  Tl  1.6200  1.9000  1.3325
]
_symmetry_space_group_name_H-M [P-3m1]
_cell_length_a [3.5583]
_cell_length_b [3.5583]
_cell_length_c [34.3546]
_cell_angle_alpha [90.0000]
_cell_angle_beta [90.0000]
_cell_angle_gamma [120.0000]
_symmetry_Int_Tables_number [164]
_chemical_formula_structural [Tb7Dy4Tl]
_chemical_formula_sum '[Tb7 Dy4 Tl1]'
_cell_volume [376.7041]
_cell_formula_units_Z [1]
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  0.0000  0.2537  1.0
  Tb  Tb1  2  0.3333  0.6667  0.5779  1.0
  Tb  Tb2  2  0.3333  0.6667  0.8312  1.0
  Tb  Tb3  1  0.0000  0.0000  0.0000  1.0
  Dy  Dy4  2  0.3333  0.6667  0.0844  1.0
  Dy  Dy5  2  0.3333  0.6667  0.3382  1.0
  Tl  Tl6  1  0.0000  0.0000  0.5000  1.0
]