# generated using pymatgen
data_Pu2Al3Ir
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   5.35447705
_cell_length_b   5.35447715
_cell_length_c   5.35447789
_cell_angle_alpha   61.39271966
_cell_angle_beta   61.39271771
_cell_angle_gamma   61.39272117
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Pu2Al3Ir
_chemical_formula_sum   'Pu2 Al3 Ir1'
_cell_volume   111.94779812
_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  0.24754608  0.24754608  0.24754608  1.0
  Pu  Pu1  1  0.00245392  0.00245392  0.00245392  1.0
  Al  Al2  1  0.62500000  0.12500000  0.62500000  1.0
  Al  Al3  1  0.62500000  0.62500000  0.12500000  1.0
  Al  Al4  1  0.12500000  0.62500000  0.62500000  1.0
  Ir  Ir5  1  0.62500000  0.62500000  0.62500000  1.0