data_[Na2Hf1Ti1Ge2Rh2]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Na  0.9300  1.8000  1.1600
  Hf  1.3000  1.5500  0.8500
  Ti  1.5400  1.4000  0.8517
  Ge  2.0100  1.2500  0.7700
  Rh  2.2800  1.3500  0.7450
]
_symmetry_space_group_name_H-M [P-4m2]
_cell_length_a [4.4825]
_cell_length_b [4.4825]
_cell_length_c [6.3632]
_cell_angle_alpha [90.0000]
_cell_angle_beta [90.0000]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [115]
_chemical_formula_structural [Na2HfTi(GeRh)2]
_chemical_formula_sum '[Na2 Hf1 Ti1 Ge2 Rh2]'
_cell_volume [127.8542]
_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  2  0.0000  0.5000  0.2622  1
  Hf  Hf1  1  0.5000  0.5000  0.0000  1
  Ti  Ti2  1  0.0000  0.0000  0.5000  1
  Ge  Ge3  1  0.0000  0.0000  0.0000  1
  Ge  Ge4  1  0.5000  0.5000  0.5000  1
  Rh  Rh5  2  0.0000  0.5000  0.7446  1
]