data_[Pu8Ge2H2]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Pu  1.2800  1.7500  0.9675
  Ge  2.0100  1.2500  0.7700
  H  2.2000  0.2500  0.0000
]
_symmetry_space_group_name_H-M [C2/m]
_cell_length_a [9.6666]
_cell_length_b [3.6236]
_cell_length_c [7.7395]
_cell_angle_alpha [90.0000]
_cell_angle_beta [127.9870]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [12]
_chemical_formula_structural [Pu4GeH]
_chemical_formula_sum '[Pu8 Ge2 H2]'
_cell_volume [213.6638]
_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
[
  Pu  Pu0  4  0.1004  0.0000  0.2770  1
  Pu  Pu1  4  0.2093  0.0000  0.8791  1
  Ge  Ge2  2  0.0000  0.5000  0.5000  1
  H  H3  2  0.0000  0.5000  0.0000  1
]