data_[Gd4Al8In4]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Gd  1.2000  1.8000  1.0750
  Al  1.6100  1.2500  0.6750
  In  1.7800  1.5500  0.9400
]
_symmetry_space_group_name_H-M [Amm2]
_cell_length_a [4.7621]
_cell_length_b [6.4185]
_cell_length_c [11.3992]
_cell_angle_alpha [90.0000]
_cell_angle_beta [90.0000]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [38]
_chemical_formula_structural [GdAl2In]
_chemical_formula_sum '[Gd4 Al8 In4]'
_cell_volume [348.4213]
_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
[
  Gd  Gd0  2  0.0000  0.0000  0.3283  1
  Gd  Gd1  2  0.5000  0.0000  0.6776  1
  Al  Al2  4  0.5000  0.2177  0.9242  1
  Al  Al3  2  0.0000  0.0000  0.8531  1
  Al  Al4  2  0.5000  0.0000  0.1438  1
  In  In5  4  0.0000  0.2390  0.0744  1
]