data_[Nd20In8Ga4]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Nd  1.1400  1.8500  1.2765
  In  1.7800  1.5500  0.9400
  Ga  1.8100  1.3000  0.7600
]
_symmetry_space_group_name_H-M [I4/mcm]
_cell_length_a [8.1953]
_cell_length_b [8.1953]
_cell_length_c [14.6638]
_cell_angle_alpha [90.0000]
_cell_angle_beta [90.0000]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [140]
_chemical_formula_structural [Nd5In2Ga]
_chemical_formula_sum '[Nd20 In8 Ga4]'
_cell_volume [984.8507]
_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
[
  Nd  Nd0  16  0.1717  0.3283  0.3452  1.0
  Nd  Nd1  4  0.0000  0.0000  0.0000  1.0
  In  In2  8  0.1245  0.3755  0.0000  1.0
  Ga  Ga3  4  0.0000  0.0000  0.2500  1.0
]