data_[Hf8Bi4Te4]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Hf  1.3000  1.5500  0.8500
  Bi  2.0200  1.6000  1.0350
  Te  2.1000  1.4000  1.2933
]
_symmetry_space_group_name_H-M [P2_1/c]
_cell_length_a [7.7048]
_cell_length_b [7.1704]
_cell_length_c [7.2528]
_cell_angle_alpha [90.0000]
_cell_angle_beta [90.1011]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [14]
_chemical_formula_structural [Hf2BiTe]
_chemical_formula_sum '[Hf8 Bi4 Te4]'
_cell_volume [400.6922]
_cell_formula_units_Z [4]
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
[
  Hf  Hf0  4  0.1400  0.1827  0.9955  1.0
  Hf  Hf1  4  0.3847  0.6831  0.5064  1.0
  Bi  Bi2  4  0.1213  0.5786  0.8019  1.0
  Te  Te3  4  0.3768  0.0723  0.6997  1.0
]