data_[Ce12Pu2H2Au4]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Ce  1.1200  1.8500  1.0800
  Pu  1.2800  1.7500  0.9675
  H  2.2000  0.2500  0.0000
  Au  2.5400  1.3500  1.0700
]
_symmetry_space_group_name_H-M [C2/m]
_cell_length_a [12.0424]
_cell_length_b [6.9959]
_cell_length_c [6.9922]
_cell_angle_alpha [90.0000]
_cell_angle_beta [124.0890]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [12]
_chemical_formula_structural [Ce6PuHAu2]
_chemical_formula_sum '[Ce12 Pu2 H2 Au4]'
_cell_volume [487.8546]
_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
[
  Ce  Ce0  8  0.0403  0.2555  0.2809  1
  Ce  Ce1  4  0.2389  0.5000  0.1542  1
  Pu  Pu2  2  0.0000  0.5000  0.0000  1
  H  H3  2  0.0000  0.0000  0.5000  1
  Au  Au4  4  0.2425  0.5000  0.7295  1
]