data_[Pu1Mn1Ag2O6]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Pu  1.2800  1.7500  0.9675
  Mn  1.5500  1.4000  0.6483
  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 [5.5040]
_cell_length_b [5.6304]
_cell_length_c [5.6409]
_cell_angle_alpha [61.2603]
_cell_angle_beta [89.9216]
_cell_angle_gamma [61.5099]
_symmetry_Int_Tables_number [2]
_chemical_formula_structural [PuMn(AgO3)2]
_chemical_formula_sum '[Pu1 Mn1 Ag2 O6]'
_cell_volume [128.6828]
_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  0.5000  1
  Mn  Mn1  1  0.5000  0.0000  0.0000  1
  Ag  Ag2  2  0.2611  0.5030  0.2417  1
  O  O3  2  0.1439  0.5424  0.7313  1
  O  O4  2  0.2536  0.9192  0.2368  1
  O  O5  2  0.3441  0.9178  0.7572  1
]