data_[Nd16Ga4Sb4]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Nd  1.1400  1.8500  1.2765
  Ga  1.8100  1.3000  0.7600
  Sb  2.0500  1.4500  0.8300
]
_symmetry_space_group_name_H-M [C2/c]
_cell_length_a [8.9227]
_cell_length_b [14.1254]
_cell_length_c [6.2219]
_cell_angle_alpha [90.0000]
_cell_angle_beta [113.0473]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [15]
_chemical_formula_structural [Nd4GaSb]
_chemical_formula_sum '[Nd16 Ga4 Sb4]'
_cell_volume [721.5978]
_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  0.1076  0.1842  0.5637  1.0
  Nd  Nd1  8  0.1993  0.4182  0.8416  1.0
  Ga  Ga2  4  0.0000  0.0005  0.2500  1.0
  Sb  Sb3  4  0.0000  0.3809  0.2500  1.0
]