data_KHf2Te
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   5.81
_cell_length_b   5.81
_cell_length_c   3.4
_cell_angle_alpha   90.0
_cell_angle_beta   90.0
_cell_angle_gamma   113.78
_symmetry_Int_Tables_number   1
_chemical_formula_structural   KHf2Te
_chemical_formula_sum   'K1 Hf2 Te1'
_cell_volume   105.11
_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
  K  K2  1  0.0  0.0  0.0  1.0
  Hf  Hf0  1  0.59  0.57  0.7  1.0
  Hf  Hf1  1  0.59  0.43  0.7  1.0
  Te  Te3  1  0.18  0.0  0.0  1.0

data_KHf2Te
_symmetry_space_group_name_H-M   P1
_cell_length_a   3.4
_cell_length_b   5.81
_cell_length_c   5.81
_cell_angle_alpha   113.78
_cell_angle_beta   90.0
_cell_angle_gamma   90.0
_symmetry_Int_Tables_number   1
_chemical_formula_structural   KHf2Te
_chemical_formula_sum   'K1 Hf2 Te1'
_cell_volume   105.11
_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
  K  K0  1  0.0  0.0  0.0  1.0
  Hf  Hf1  1  0.7  0.59  0.43  1.0
  Hf  Hf2  1  0.7  0.59  0.57  1.0
  Te  Te3  1  -0.0  0.18  0.0  1.0

K Hf Hf Te