data_[Li2Nd4Ge2Pd12]
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
  Ge  2.0100  1.2500  0.7700
  Pd  2.2000  1.4000  0.8462
]
_symmetry_space_group_name_H-M [C2/m]
_cell_length_a [11.6522]
_cell_length_b [5.5544]
_cell_length_c [7.7616]
_cell_angle_alpha [90.0000]
_cell_angle_beta [130.9107]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [12]
_chemical_formula_structural [LiNd2GePd6]
_chemical_formula_sum '[Li2 Nd4 Ge2 Pd12]'
_cell_volume [379.6320]
_cell_formula_units_Z [2]
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  2  0.0000  0.0000  0.5000  1
  Nd  Nd1  4  0.0027  0.5000  0.7495  1
  Ge  Ge2  2  0.0000  0.0000  0.0000  1
  Pd  Pd3  8  0.2426  0.2494  0.2945  1
  Pd  Pd4  4  0.1704  0.0000  0.9140  1
]