data_[Pu6Zn48Co3]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Pu  1.2800  1.7500  0.9675
  Zn  1.6500  1.3500  0.8800
  Co  1.8800  1.3500  0.7683
]
_symmetry_space_group_name_H-M [R3m]
_cell_length_a [8.9734]
_cell_length_b [8.9734]
_cell_length_c [13.1083]
_cell_angle_alpha [90.0000]
_cell_angle_beta [90.0000]
_cell_angle_gamma [120.0000]
_symmetry_Int_Tables_number [160]
_chemical_formula_structural [Pu2Zn16Co]
_chemical_formula_sum '[Pu6 Zn48 Co3]'
_cell_volume [914.0869]
_cell_formula_units_Z [3]
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  3  0.0000  0.0000  0.3403  1
  Pu  Pu1  3  0.0000  0.0000  0.6722  1
  Zn  Zn2  18  0.0002  0.2883  0.9989  1
  Zn  Zn3  9  0.0008  0.5004  0.1508  1
  Zn  Zn4  9  0.0083  0.5042  0.4998  1
  Zn  Zn5  9  0.1712  0.3424  0.1846  1
  Zn  Zn6  3  0.0000  0.0000  0.0957  1
  Co  Co7  3  0.0000  0.0000  0.8924  1
]