data_[Pu1Tl2Ag1O8]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Pu  1.2800  1.7500  0.9675
  Tl  1.6200  1.9000  1.3325
  Ag  1.9300  1.6000  1.0867
  O  3.4400  0.6000  1.2600
]
_symmetry_space_group_name_H-M [P-1]
_cell_length_a [5.0473]
_cell_length_b [5.1888]
_cell_length_c [6.9171]
_cell_angle_alpha [85.7614]
_cell_angle_beta [85.5944]
_cell_angle_gamma [84.7592]
_symmetry_Int_Tables_number [2]
_chemical_formula_structural [PuTl2AgO8]
_chemical_formula_sum '[Pu1 Tl2 Ag1 O8]'
_cell_volume [179.4566]
_cell_formula_units_Z [1]
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  1  0.0000  0.0000  0.0000  1
  Tl  Tl1  2  0.4596  0.4636  0.2604  1
  Ag  Ag2  1  0.0000  0.0000  0.5000  1
  O  O3  2  0.1807  0.1352  0.2453  1
  O  O4  2  0.2216  0.1758  0.8236  1
  O  O5  2  0.2635  0.6701  0.5098  1
  O  O6  2  0.2782  0.6793  0.9997  1
]