data_[Dy6Tl6Bi1]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Dy  1.2200  1.7500  1.1310
  Tl  1.6200  1.9000  1.3325
  Bi  2.0200  1.6000  1.0350
]
_symmetry_space_group_name_H-M [P6/mmm]
_cell_length_a [6.5300]
_cell_length_b [6.5300]
_cell_length_c [10.3399]
_cell_angle_alpha [90.0000]
_cell_angle_beta [90.0000]
_cell_angle_gamma [120.0000]
_symmetry_Int_Tables_number [191]
_chemical_formula_structural [Dy6Tl6Bi]
_chemical_formula_sum '[Dy6 Tl6 Bi1]'
_cell_volume [381.8344]
_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
[
  Dy  Dy0  2  0.0000  0.0000  0.3049  1
  Dy  Dy1  2  0.3333  0.6667  0.0000  1
  Dy  Dy2  2  0.3333  0.6667  0.5000  1
  Tl  Tl3  6  0.0000  0.5000  0.2522  1
  Bi  Bi4  1  0.0000  0.0000  0.0000  1
]