data_[Li4Nd8Rh8]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Li  0.9800  1.4500  0.9000
  Nd  1.1400  1.8500  1.2765
  Rh  2.2800  1.3500  0.7450
]
_symmetry_space_group_name_H-M [C2/c]
_cell_length_a [10.3782]
_cell_length_b [5.5151]
_cell_length_c [7.8960]
_cell_angle_alpha [90.0000]
_cell_angle_beta [107.0043]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [15]
_chemical_formula_structural [Li(NdRh)2]
_chemical_formula_sum '[Li4 Nd8 Rh8]'
_cell_volume [432.1823]
_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
[
  Li  Li0  4  0.0000  0.1323  0.7500  1.0
  Nd  Nd1  8  0.1475  0.3498  0.1498  1.0
  Rh  Rh2  8  0.1326  0.1453  0.5102  1.0
]