data_[Pu4Tc12Ge8]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Pu  1.2800  1.7500  0.9675
  Tc  1.9000  1.3500  0.7417
  Ge  2.0100  1.2500  0.7700
]
_symmetry_space_group_name_H-M [C2/m]
_cell_length_a [15.3562]
_cell_length_b [4.1872]
_cell_length_c [7.5216]
_cell_angle_alpha [90.0000]
_cell_angle_beta [118.7073]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [12]
_chemical_formula_structural [PuTc3Ge2]
_chemical_formula_sum '[Pu4 Tc12 Ge8]'
_cell_volume [424.1819]
_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
[
  Pu  Pu0  4  0.1383  0.0000  0.0600  1
  Tc  Tc1  4  0.0484  0.0000  0.4018  1
  Tc  Tc2  4  0.0881  0.5000  0.6536  1
  Tc  Tc3  4  0.2050  0.5000  0.4862  1
  Ge  Ge4  4  0.0244  0.5000  0.1857  1
  Ge  Ge5  4  0.2056  0.0000  0.7429  1
]