data_[La2Y6Pu4Se12]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  La  1.1000  1.9500  1.1720
  Y  1.2200  1.8000  1.0400
  Pu  1.2800  1.7500  0.9675
  Se  2.5500  1.1500  1.0133
]
_symmetry_space_group_name_H-M [C2/m]
_cell_length_a [7.1527]
_cell_length_b [12.3967]
_cell_length_c [7.2270]
_cell_angle_alpha [90.0000]
_cell_angle_beta [109.3064]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [12]
_chemical_formula_structural [LaY3(PuSe3)2]
_chemical_formula_sum '[La2 Y6 Pu4 Se12]'
_cell_volume [604.7756]
_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
[
  La  La0  2  0.0000  0.0000  0.0000  1
  Y  Y1  4  0.0000  0.1641  0.5000  1
  Y  Y2  2  0.0000  0.5000  0.5000  1
  Pu  Pu3  4  0.0000  0.3329  0.0000  1
  Se  Se4  8  0.2431  0.3298  0.7404  1
  Se  Se5  4  0.2452  0.5000  0.2575  1
]