# generated using pymatgen
data_PuSb12IrRu3
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   8.09748470
_cell_length_b   8.07090156
_cell_length_c   8.07090032
_cell_angle_alpha   109.40440688
_cell_angle_beta   109.53795143
_cell_angle_gamma   109.53795068
_symmetry_Int_Tables_number   1
_chemical_formula_structural   PuSb12IrRu3
_chemical_formula_sum   'Pu1 Sb12 Ir1 Ru3'
_cell_volume   405.70836407
_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  0.00000000  0.00000000  0.00000000  1.0
  Sb  Sb1  1  0.66170135  0.84299070  0.50366487  1.0
  Sb  Sb2  1  0.33829865  0.15700930  0.49633513  1.0
  Sb  Sb3  1  0.84622843  0.18470503  0.34164468  1.0
  Sb  Sb4  1  0.81871065  0.66067417  0.15700930  1.0
  Sb  Sb5  1  0.84196352  0.50366487  0.66067417  1.0
  Sb  Sb6  1  0.18128935  0.33932583  0.84299070  1.0
  Sb  Sb7  1  0.15377157  0.81529497  0.65835532  1.0
  Sb  Sb8  1  0.50458475  0.65835532  0.84306035  1.0
  Sb  Sb9  1  0.49541525  0.34164468  0.15693965  1.0
  Sb  Sb10  1  0.15803648  0.49633513  0.33932583  1.0
  Sb  Sb11  1  0.33847561  0.84306035  0.18470503  1.0
  Sb  Sb12  1  0.66152439  0.15693965  0.81529497  1.0
  Ir  Ir13  1  0.50000000  0.00000000  0.00000000  1.0
  Ru  Ru14  1  0.50000000  0.50000000  0.50000000  1.0
  Ru  Ru15  1  0.00000000  0.00000000  0.50000000  1.0
  Ru  Ru16  1  0.00000000  0.50000000  0.00000000  1.0