# generated using pymatgen
data_Pr5Th3(Si3Ir)4
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   8.18915787
_cell_length_b   8.23885018
_cell_length_c   8.54863621
_cell_angle_alpha   90.00000000
_cell_angle_beta   90.00000000
_cell_angle_gamma   119.43611402
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Pr5Th3(Si3Ir)4
_chemical_formula_sum   'Pr5 Th3 Si12 Ir4'
_cell_volume   502.31145078
_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
  Pr  Pr0  1  0.99988423  0.49990794  0.25000000  1.0
  Pr  Pr1  1  0.49990548  0.99982997  0.75000000  1.0
  Pr  Pr2  1  0.50011952  0.00020677  0.25000000  1.0
  Pr  Pr3  1  0.00001351  0.99996574  0.75000000  1.0
  Pr  Pr4  1  0.00001709  0.00003857  0.25000000  1.0
  Th  Th5  1  0.50000403  0.50002207  0.75000000  1.0
  Th  Th6  1  0.49997577  0.50001869  0.25000000  1.0
  Th  Th7  1  0.00006321  0.50004790  0.75000000  1.0
  Si  Si8  1  0.82945123  0.16804450  0.99961489  1.0
  Si  Si9  1  0.17055408  0.83194583  0.99989686  1.0
  Si  Si10  1  0.33360602  0.16443863  0.99975374  1.0
  Si  Si11  1  0.17055408  0.83194583  0.50010314  1.0
  Si  Si12  1  0.66639747  0.83556538  0.99987434  1.0
  Si  Si13  1  0.82945123  0.16804450  0.50038511  1.0
  Si  Si14  1  0.83704174  0.67182207  0.00025173  1.0
  Si  Si15  1  0.66639747  0.83556538  0.50012566  1.0
  Si  Si16  1  0.16295550  0.32817273  0.00025264  1.0
  Si  Si17  1  0.33360602  0.16443863  0.50024626  1.0
  Si  Si18  1  0.16295550  0.32817273  0.49974736  1.0
  Si  Si19  1  0.83704174  0.67182207  0.49974827  1.0
  Ir  Ir20  1  0.66679276  0.34268467  0.99558277  1.0
  Ir  Ir21  1  0.33321028  0.65730835  0.99571867  1.0
  Ir  Ir22  1  0.33321028  0.65730835  0.50428133  1.0
  Ir  Ir23  1  0.66679276  0.34268467  0.50441723  1.0