data_[Pu2Ge2Te6Au2]
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
  Te  2.1000  1.4000  1.2933
  Au  2.5400  1.3500  1.0700
]
_symmetry_space_group_name_H-M [P2_1/m]
_cell_length_a [8.0032]
_cell_length_b [4.1608]
_cell_length_c [10.2092]
_cell_angle_alpha [90.0000]
_cell_angle_beta [100.5111]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [11]
_chemical_formula_structural [PuGeTe3Au]
_chemical_formula_sum '[Pu2 Ge2 Te6 Au2]'
_cell_volume [334.2562]
_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  2  0.2094  0.7500  0.3007  1
  Ge  Ge1  2  0.3297  0.2500  0.8536  1
  Te  Te2  2  0.0572  0.7500  0.8500  1
  Te  Te3  2  0.3243  0.2500  0.5371  1
  Te  Te4  2  0.4058  0.2500  0.1406  1
  Au  Au5  2  0.0904  0.7500  0.5846  1
]