data_[Ge4H4Pd16]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Ge  2.0100  1.2500  0.7700
  H  2.2000  0.2500  0.0000
  Pd  2.2000  1.4000  0.8462
]
_symmetry_space_group_name_H-M [C2/c]
_cell_length_a [11.2555]
_cell_length_b [5.4332]
_cell_length_c [5.6169]
_cell_angle_alpha [90.0000]
_cell_angle_beta [106.4897]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [15]
_chemical_formula_structural [GeHPd4]
_chemical_formula_sum '[Ge4 H4 Pd16]'
_cell_volume [329.3625]
_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
[
  Ge  Ge0  4  0.0000  0.1932  0.7500  1.0
  Pd  Pd1  8  0.1113  0.4215  0.4658  1.0
  Pd  Pd2  8  0.1637  0.0712  0.1359  1.0
  H  H3  4  0.2500  0.2500  0.5000  1.0
]