data_[Nd24Y8In4]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Nd  1.1400  1.8500  1.2765
  Y  1.2200  1.8000  1.0400
  In  1.7800  1.5500  0.9400
]
_symmetry_space_group_name_H-M [Ibam]
_cell_length_a [6.4392]
_cell_length_b [9.2752]
_cell_length_c [19.9464]
_cell_angle_alpha [90.0000]
_cell_angle_beta [90.0000]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [72]
_chemical_formula_structural [Nd6Y2In]
_chemical_formula_sum '[Nd24 Y8 In4]'
_cell_volume [1191.2880]
_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  0.1124  0.3220  0.1711  1
  Nd  Nd1  8  0.0000  0.0000  0.0820  1
  Y  Y2  8  0.0821  0.6731  0.0000  1
  In  In3  4  0.0000  0.0000  0.2500  1
]