data_[Tb2Pu10Ge12]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Tb  1.1000  1.7500  0.9815
  Pu  1.2800  1.7500  0.9675
  Ge  2.0100  1.2500  0.7700
]
_symmetry_space_group_name_H-M [Cmmm]
_cell_length_a [4.6624]
_cell_length_b [13.9241]
_cell_length_c [8.1492]
_cell_angle_alpha [90.0000]
_cell_angle_beta [90.0000]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [65]
_chemical_formula_structural [TbPu5Ge6]
_chemical_formula_sum '[Tb2 Pu10 Ge12]'
_cell_volume [529.0419]
_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
[
  Tb  Tb0  2  0.0000  0.0000  0.0000  1
  Pu  Pu1  4  0.0000  0.3290  0.0000  1
  Pu  Pu2  4  0.0000  0.3300  0.5000  1
  Pu  Pu3  2  0.0000  0.0000  0.5000  1
  Ge  Ge4  8  0.0000  0.1661  0.2508  1
  Ge  Ge5  4  0.0000  0.5000  0.2505  1
]