# generated using pymatgen
data_PuRe2
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   5.60829180
_cell_length_b   5.60829180
_cell_length_c   7.95704100
_cell_angle_alpha   90.00000000
_cell_angle_beta   90.00000000
_cell_angle_gamma   120.57851767
_symmetry_Int_Tables_number   1
_chemical_formula_structural   PuRe2
_chemical_formula_sum   'Pu4 Re8'
_cell_volume   215.46764576
_cell_formula_units_Z   4
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  0.66666000  0.33334000  0.60335200  1.0
  Pu  Pu1  1  0.33334000  0.66666000  0.39664800  1.0
  Pu  Pu2  1  0.33334000  0.66666000  0.10335200  1.0
  Pu  Pu3  1  0.66666000  0.33334000  0.89664800  1.0
  Re  Re4  1  0.00000000  0.00000000  0.50000000  1.0
  Re  Re5  1  0.00000000  0.00000000  0.00000000  1.0
  Re  Re6  1  0.17346600  0.34683100  0.75000000  1.0
  Re  Re7  1  0.17247900  0.82752100  0.75000000  1.0
  Re  Re8  1  0.65316900  0.82653400  0.75000000  1.0
  Re  Re9  1  0.82653400  0.65316900  0.25000000  1.0
  Re  Re10  1  0.82752100  0.17247900  0.25000000  1.0
  Re  Re11  1  0.34683100  0.17346600  0.25000000  1.0