data_[Ge64H1]
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
]
_symmetry_space_group_name_H-M [P-43m]
_cell_length_a [11.4830]
_cell_length_b [11.4830]
_cell_length_c [11.4830]
_cell_angle_alpha [90.0000]
_cell_angle_beta [90.0000]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [215]
_chemical_formula_structural [Ge64H]
_chemical_formula_sum '[Ge64 H1]'
_cell_volume [1514.1336]
_cell_formula_units_Z [1]
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  12  0.0000  0.2513  0.5000  1
  Ge  Ge1  12  0.1253  0.1253  0.3764  1
  Ge  Ge2  12  0.1263  0.3741  0.6259  1
  Ge  Ge3  6  0.0000  0.0000  0.2527  1
  Ge  Ge4  6  0.2497  0.5000  0.5000  1
  Ge  Ge5  4  0.1192  0.1192  0.8808  1
  Ge  Ge6  4  0.2464  0.2464  0.7536  1
  Ge  Ge7  4  0.2498  0.2498  0.2498  1
  Ge  Ge8  4  0.3750  0.3750  0.3750  1
  H  H9  1  0.0000  0.0000  0.0000  1
]