data_Na2HfIn
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   6.84
_cell_length_b   6.84
_cell_length_c   6.84
_cell_angle_alpha   153.93
_cell_angle_beta   133.43
_cell_angle_gamma   54.15
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Na2HfIn
_chemical_formula_sum   'Na2 Hf1 In1'
_cell_volume   101.75
_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
  Na  Na2  1  0.0  0.71  0.22  1.0
  Na  Na3  1  0.54  0.0  0.88  1.0
  Hf  Hf0  1  0.0  0.0  0.09  1.0
  In  In1  1  0.0  0.0  0.0  1.0

data_Na2HfIn
_symmetry_space_group_name_H-M   P1
_cell_length_a   3.09
_cell_length_b   5.41
_cell_length_c   6.84
_cell_angle_alpha   113.29
_cell_angle_beta   103.03
_cell_angle_gamma   90.0
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Na2HfIn
_chemical_formula_sum   'Na2 Hf1 In1'
_cell_volume   101.75
_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
  Na  Na0  1  0.67  0.12  0.67  1.0
  Na  Na1  1  0.78  0.49  0.49  1.0
  Hf  Hf2  1  0.91  0.91  0.91  1.0
  In  In3  1  0.0  0.0  0.0  1.0

Na Na Hf In