data_[Lu2Pu2]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Lu  1.2700  1.7500  1.0010
  Pu  1.2800  1.7500  0.9675
]
_symmetry_space_group_name_H-M [P2_1/m]
_cell_length_a [3.1760]
_cell_length_b [3.5885]
_cell_length_c [8.4936]
_cell_angle_alpha [90.0000]
_cell_angle_beta [92.3574]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [11]
_chemical_formula_structural [LuPu]
_chemical_formula_sum '[Lu2 Pu2]'
_cell_volume [96.7198]
_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
[
  Lu  Lu0  2  0.2614  0.2500  0.1519  1
  Pu  Pu1  2  0.1460  0.2500  0.5684  1
]