data_[Li6Ge8Pd4]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Li  0.9800  1.4500  0.9000
  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 [9.6004]
_cell_length_b [4.3409]
_cell_length_c [8.1010]
_cell_angle_alpha [90.0000]
_cell_angle_beta [117.5431]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [12]
_chemical_formula_structural [Li3(Ge2Pd)2]
_chemical_formula_sum '[Li6 Ge8 Pd4]'
_cell_volume [299.3376]
_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  4  0.1463  0.5000  0.6694  1.0
  Li  Li1  2  0.0000  0.0000  0.0000  1.0
  Ge  Ge2  4  0.0480  0.0000  0.3718  1.0
  Ge  Ge3  4  0.2485  0.5000  0.0913  1.0
  Pd  Pd4  4  0.1700  0.5000  0.3489  1.0
]