data_[Na4In12Ge4]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Na  0.9300  1.8000  1.1600
  In  1.7800  1.5500  0.9400
  Ge  2.0100  1.2500  0.7700
]
_symmetry_space_group_name_H-M [Pnma]
_cell_length_a [9.1519]
_cell_length_b [4.5309]
_cell_length_c [13.2412]
_cell_angle_alpha [90.0000]
_cell_angle_beta [90.0000]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [62]
_chemical_formula_structural [NaIn3Ge]
_chemical_formula_sum '[Na4 In12 Ge4]'
_cell_volume [549.0673]
_cell_formula_units_Z [4]
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  4  0.1789  0.2500  0.9903  1
  In  In1  4  0.0645  0.2500  0.5860  1
  In  In2  4  0.0739  0.7500  0.8174  1
  In  In3  4  0.1601  0.7500  0.2092  1
  Ge  Ge4  4  0.1198  0.2500  0.3606  1
]