data_Na2HfIn
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   6.03
_cell_length_b   6.03
_cell_length_c   5.58
_cell_angle_alpha   95.07
_cell_angle_beta   95.07
_cell_angle_gamma   29.33
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Na2HfIn
_chemical_formula_sum   'Na2 Hf1 In1'
_cell_volume   99.14
_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  0.57  0.0  0.17  1.0
  Na  Na3  1  0.59  0.0  0.39  1.0
  Hf  Hf0  1  0.58  0.0  0.78  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   3.06
_cell_length_b   5.58
_cell_length_c   6.03
_cell_angle_alpha   95.07
_cell_angle_beta   104.67
_cell_angle_gamma   90.0
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Na2HfIn
_chemical_formula_sum   'Na2 Hf1 In1'
_cell_volume   99.14
_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  0.0  0.17  0.57  1.0
  Na  Na1  1  0.0  0.39  0.59  1.0
  Hf  Hf2  1  0.0  0.78  0.58  1.0
  In  In3  1  0.0  0.0  0.0  1.0

Na Na Hf In