data_[Pu4In1Ga3]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Pu  1.2800  1.7500  0.9675
  In  1.7800  1.5500  0.9400
  Ga  1.8100  1.3000  0.7600
]
_symmetry_space_group_name_H-M [Pmmm]
_cell_length_a [3.5638]
_cell_length_b [5.1746]
_cell_length_c [10.3867]
_cell_angle_alpha [90.0000]
_cell_angle_beta [90.0000]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [47]
_chemical_formula_structural [Pu4InGa3]
_chemical_formula_sum '[Pu4 In1 Ga3]'
_cell_volume [191.5426]
_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  2  0.0000  0.5000  0.2655  1
  Pu  Pu1  1  0.0000  0.0000  0.0000  1
  Pu  Pu2  1  0.0000  0.0000  0.5000  1
  In  In3  1  0.5000  0.5000  0.0000  1
  Ga  Ga4  2  0.5000  0.0000  0.2506  1
  Ga  Ga5  1  0.5000  0.5000  0.5000  1
]