# generated using pymatgen
data_LaTh(AlIr)2
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   4.24273303
_cell_length_b   7.20656109
_cell_length_c   16.30228202
_cell_angle_alpha   90.00000000
_cell_angle_beta   90.00000000
_cell_angle_gamma   90.00000000
_symmetry_Int_Tables_number   1
_chemical_formula_structural   LaTh(AlIr)2
_chemical_formula_sum   'La4 Th4 Al8 Ir8'
_cell_volume   498.45066421
_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
  La  La0  1  0.25000000  0.65322427  0.55961886  1.0
  La  La1  1  0.75000000  0.34677573  0.44038114  1.0
  La  La2  1  0.75000000  0.84677573  0.05961886  1.0
  La  La3  1  0.25000000  0.15322427  0.94038114  1.0
  Th  Th4  1  0.25000000  0.52100808  0.77801613  1.0
  Th  Th5  1  0.75000000  0.47899192  0.22198387  1.0
  Th  Th6  1  0.75000000  0.97899192  0.27801613  1.0
  Th  Th7  1  0.25000000  0.02100808  0.72198387  1.0
  Al  Al8  1  0.25000000  0.65819829  0.35180988  1.0
  Al  Al9  1  0.75000000  0.34180171  0.64819012  1.0
  Al  Al10  1  0.75000000  0.84180171  0.85180988  1.0
  Al  Al11  1  0.25000000  0.15819829  0.14819012  1.0
  Al  Al12  1  0.25000000  0.50719144  0.06004026  1.0
  Al  Al13  1  0.75000000  0.49280856  0.93995974  1.0
  Al  Al14  1  0.75000000  0.99280856  0.56004026  1.0
  Al  Al15  1  0.25000000  0.00719144  0.43995974  1.0
  Ir  Ir16  1  0.25000000  0.76233787  0.18793964  1.0
  Ir  Ir17  1  0.75000000  0.23766213  0.81206036  1.0
  Ir  Ir18  1  0.75000000  0.73766213  0.68793964  1.0
  Ir  Ir19  1  0.25000000  0.26233787  0.31206036  1.0
  Ir  Ir20  1  0.25000000  0.71334721  0.92584965  1.0
  Ir  Ir21  1  0.75000000  0.28665279  0.07415035  1.0
  Ir  Ir22  1  0.75000000  0.78665279  0.42584965  1.0
  Ir  Ir23  1  0.25000000  0.21334721  0.57415035  1.0