data_[Nd24Fe52Sb4]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Nd  1.1400  1.8500  1.2765
  Fe  1.8300  1.4000  0.8525
  Sb  2.0500  1.4500  0.8300
]
_symmetry_space_group_name_H-M [I4/mcm]
_cell_length_a [8.1069]
_cell_length_b [8.1069]
_cell_length_c [23.5602]
_cell_angle_alpha [90.0000]
_cell_angle_beta [90.0000]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [140]
_chemical_formula_structural [Nd6Fe13Sb]
_chemical_formula_sum '[Nd24 Fe52 Sb4]'
_cell_volume [1548.4236]
_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  0.1624  0.3376  0.6852  1
  Nd  Nd1  8  0.0000  0.0000  0.1039  1
  Fe  Fe2  16  0.0667  0.2101  0.0000  1
  Fe  Fe3  16  0.1135  0.3865  0.9062  1
  Fe  Fe4  16  0.1787  0.3213  0.4414  1
  Fe  Fe5  4  0.0000  0.5000  0.0000  1
  Sb  Sb6  4  0.0000  0.0000  0.2500  1
]