data_[Nd4Cu36Sn16]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Nd  1.1400  1.8500  1.2765
  Cu  1.9000  1.3500  0.8200
  Sn  1.9600  1.4500  0.8300
]
_symmetry_space_group_name_H-M [I4/mcm]
_cell_length_a [8.6202]
_cell_length_b [8.6202]
_cell_length_c [12.3761]
_cell_angle_alpha [90.0000]
_cell_angle_beta [90.0000]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [140]
_chemical_formula_structural [NdCu9Sn4]
_chemical_formula_sum '[Nd4 Cu36 Sn16]'
_cell_volume [919.6283]
_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  4  0.0000  0.0000  0.2500  1
  Cu  Cu1  16  0.0547  0.1993  0.0000  1
  Cu  Cu2  16  0.1084  0.3916  0.8268  1
  Cu  Cu3  4  0.0000  0.5000  0.0000  1
  Sn  Sn4  16  0.1858  0.3142  0.3722  1
]