# generated using pymatgen
data_Th3Al12Ru3Rh
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   8.93494624
_cell_length_b   8.93494499
_cell_length_c   9.53280678
_cell_angle_alpha   89.91596358
_cell_angle_beta   89.91595376
_cell_angle_gamma   120.13698087
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Th3Al12Ru3Rh
_chemical_formula_sum   'Th6 Al24 Ru6 Rh2'
_cell_volume   658.16116734
_cell_formula_units_Z   2
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
  Th  Th0  1  0.80369795  0.61136941  0.74972014  1.0
  Th  Th1  1  0.19406547  0.80593453  0.25000000  1.0
  Th  Th2  1  0.61136941  0.80369795  0.24972014  1.0
  Th  Th3  1  0.38863059  0.19630205  0.75027986  1.0
  Th  Th4  1  0.80593453  0.19406547  0.75000000  1.0
  Th  Th5  1  0.19630205  0.38863059  0.25027986  1.0
  Al  Al6  1  0.33254351  0.66525291  0.48950508  1.0
  Al  Al7  1  0.66525291  0.33254351  0.98950508  1.0
  Al  Al8  1  0.66745649  0.33474709  0.51049492  1.0
  Al  Al9  1  0.33474709  0.66745649  0.01049492  1.0
  Al  Al10  1  0.16267437  0.32650029  0.57829132  1.0
  Al  Al11  1  0.67384040  0.83574739  0.57795131  1.0
  Al  Al12  1  0.16073715  0.83546242  0.57815963  1.0
  Al  Al13  1  0.83546242  0.16073715  0.07815963  1.0
  Al  Al14  1  0.83926285  0.16453758  0.42184037  1.0
  Al  Al15  1  0.83574739  0.67384040  0.07795131  1.0
  Al  Al16  1  0.32650029  0.16267437  0.07829132  1.0
  Al  Al17  1  0.67349971  0.83732563  0.92170868  1.0
  Al  Al18  1  0.16425261  0.32615960  0.92204869  1.0
  Al  Al19  1  0.83732563  0.67349971  0.42170868  1.0
  Al  Al20  1  0.00048542  0.99951458  0.25000000  1.0
  Al  Al21  1  0.99951458  0.00048542  0.75000000  1.0
  Al  Al22  1  0.56415059  0.12710847  0.24919106  1.0
  Al  Al23  1  0.43557994  0.56442006  0.75000000  1.0
  Al  Al24  1  0.12710847  0.56415059  0.74919106  1.0
  Al  Al25  1  0.87289153  0.43584941  0.25080894  1.0
  Al  Al26  1  0.56442006  0.43557994  0.25000000  1.0
  Al  Al27  1  0.43584941  0.87289153  0.75080894  1.0
  Al  Al28  1  0.16453758  0.83926285  0.92184037  1.0
  Al  Al29  1  0.32615960  0.16425261  0.42204869  1.0
  Ru  Ru30  1  0.00000000  0.00000000  0.50000000  1.0
  Ru  Ru31  1  0.00000000  0.00000000  0.00000000  1.0
  Ru  Ru32  1  0.50000000  0.50000000  0.00000000  1.0
  Ru  Ru33  1  0.00000000  0.50000000  0.50000000  1.0
  Ru  Ru34  1  0.50000000  0.50000000  0.50000000  1.0
  Ru  Ru35  1  0.50000000  0.00000000  0.00000000  1.0
  Rh  Rh36  1  0.50000000  0.00000000  0.50000000  1.0
  Rh  Rh37  1  0.00000000  0.50000000  0.00000000  1.0