data_[Nd24Er8In4]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Nd  1.1400  1.8500  1.2765
  Er  1.2400  1.7500  1.0300
  In  1.7800  1.5500  0.9400
]
_symmetry_space_group_name_H-M [C2/c]
_cell_length_a [16.0888]
_cell_length_b [11.8775]
_cell_length_c [6.1825]
_cell_angle_alpha [90.0000]
_cell_angle_beta [97.1144]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [15]
_chemical_formula_structural [Nd6Er2In]
_chemical_formula_sum '[Nd24 Er8 In4]'
_cell_volume [1172.3478]
_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  8  0.0509  0.3604  0.5147  1.0
  Nd  Nd1  8  0.1052  0.1238  0.8275  1.0
  Nd  Nd2  8  0.2157  0.1462  0.3513  1.0
  Er  Er3  8  0.1736  0.3978  0.0814  1.0
  In  In4  4  0.0000  0.1237  0.2500  1.0
]