data_[Nd20Zn8In8]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Nd  1.1400  1.8500  1.2765
  Zn  1.6500  1.3500  0.8800
  In  1.7800  1.5500  0.9400
]
_symmetry_space_group_name_H-M [Cmce]
_cell_length_a [16.8366]
_cell_length_b [8.5060]
_cell_length_c [7.3864]
_cell_angle_alpha [90.0000]
_cell_angle_beta [90.0000]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [64]
_chemical_formula_structural [Nd5(ZnIn)2]
_chemical_formula_sum '[Nd20 Zn8 In8]'
_cell_volume [1057.8187]
_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  0.1341  0.1946  0.3227  1
  Nd  Nd1  4  0.0000  0.0000  0.0000  1
  Zn  Zn2  8  0.0000  0.1181  0.6087  1
  In  In3  8  0.2213  0.0000  0.0000  1
]