data_Hf2BiTe
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   11.26
_cell_length_b   11.26
_cell_length_c   11.26
_cell_angle_alpha   17.31
_cell_angle_beta   17.31
_cell_angle_gamma   17.31
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Hf2BiTe
_chemical_formula_sum   'Hf2 Bi1 Te1'
_cell_volume   110.3
_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
  Hf  Hf1  1  0.0  0.0  0.98  1.0
  Hf  Hf2  1  0.0  0.0  0.43  1.0
  Bi  Bi0  1  0.0  0.0  0.48  1.0
  Te  Te3  1  0.0  0.0  0.29  1.0

data_Hf2BiTe
_symmetry_space_group_name_H-M   Cm
_cell_length_a   5.87
_cell_length_b   3.39
_cell_length_c   11.26
_cell_angle_alpha   90.0
_cell_angle_beta   100.0
_cell_angle_gamma   90.0
_symmetry_Int_Tables_number   8
_chemical_formula_structural   Hf2BiTe
_chemical_formula_sum   'Hf4 Bi2 Te2'
_cell_volume   220.61
_cell_formula_units_Z   2
loop_
 _symmetry_equiv_pos_site_id
 _symmetry_equiv_pos_as_xyz
  1  'x, y, z'
  2  'x, -y, z'
  3  'x+1/2, y+1/2, z'
  4  'x+1/2, -y+1/2, 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  2  0.0  0.0  0.02  1.0
  Hf  Hf1  2  0.0  0.0  0.57  1.0
  Bi  Bi2  2  0.0  0.0  0.52  1.0
  Te  Te3  2  0.0  0.0  0.71  1.0

Hf Hf Bi Te