data_[Dy18Bi6Te36]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Dy  1.2200  1.7500  1.1310
  Bi  2.0200  1.6000  1.0350
  Te  2.1000  1.4000  1.2933
]
_symmetry_space_group_name_H-M [R-3]
_cell_length_a [12.8757]
_cell_length_b [12.8757]
_cell_length_c [15.6899]
_cell_angle_alpha [90.0000]
_cell_angle_beta [90.0000]
_cell_angle_gamma [120.0000]
_symmetry_Int_Tables_number [148]
_chemical_formula_structural [Dy3BiTe6]
_chemical_formula_sum '[Dy18 Bi6 Te36]'
_cell_volume [2252.6424]
_cell_formula_units_Z [6]
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  18  0.0549  0.2722  0.7042  1.0
  Bi  Bi1  3  0.0000  0.0000  0.0000  1.0
  Bi  Bi2  3  0.0000  0.0000  0.5000  1.0
  Te  Te3  18  0.0144  0.2154  0.8969  1.0
  Te  Te4  18  0.0342  0.1951  0.3706  1.0
]