# generated using pymatgen
data_Ti13Al9(FeRh3)2
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   8.64192744
_cell_length_b   8.64192644
_cell_length_c   8.64192630
_cell_angle_alpha   59.74263405
_cell_angle_beta   59.74263674
_cell_angle_gamma   59.74264444
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Ti13Al9(FeRh3)2
_chemical_formula_sum   'Ti13 Al9 Fe2 Rh6'
_cell_volume   453.70242680
_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
  Ti  Ti0  1  0.20580218  0.20580218  0.79427196  1.0
  Ti  Ti1  1  0.79427196  0.20580218  0.20580218  1.0
  Ti  Ti2  1  0.20580218  0.79427196  0.20580218  1.0
  Ti  Ti3  1  0.80499344  0.80499344  0.17864719  1.0
  Ti  Ti4  1  0.17864719  0.80499344  0.80499344  1.0
  Ti  Ti5  1  0.80499344  0.17864719  0.80499344  1.0
  Ti  Ti6  1  0.38218131  0.38218131  0.38218131  1.0
  Ti  Ti7  1  0.38325093  0.85482761  0.38325093  1.0
  Ti  Ti8  1  0.85482761  0.38325093  0.38325093  1.0
  Ti  Ti9  1  0.38325093  0.38325093  0.85482761  1.0
  Ti  Ti10  1  0.84484352  0.46892261  0.84484352  1.0
  Ti  Ti11  1  0.46892261  0.84484352  0.84484352  1.0
  Ti  Ti12  1  0.84484352  0.84484352  0.46892261  1.0
  Al  Al13  1  0.15625385  0.15625385  0.15625385  1.0
  Al  Al14  1  0.16201072  0.52022773  0.16201072  1.0
  Al  Al15  1  0.52022773  0.16201072  0.16201072  1.0
  Al  Al16  1  0.16201072  0.16201072  0.52022773  1.0
  Al  Al17  1  0.61751008  0.61751008  0.61751008  1.0
  Al  Al18  1  0.61851292  0.14840771  0.61851292  1.0
  Al  Al19  1  0.14840771  0.61851292  0.61851292  1.0
  Al  Al20  1  0.61851292  0.61851292  0.14840771  1.0
  Al  Al21  1  0.82778422  0.82778422  0.82778422  1.0
  Fe  Fe22  1  0.50039808  0.50039808  0.50039808  1.0
  Fe  Fe23  1  0.00363215  0.00363215  0.00363215  1.0
  Rh  Rh24  1  0.00380093  0.00380093  0.49935997  1.0
  Rh  Rh25  1  0.49935997  0.00380093  0.00380093  1.0
  Rh  Rh26  1  0.00380093  0.49935997  0.00380093  1.0
  Rh  Rh27  1  0.50051431  0.50051431  0.00011563  1.0
  Rh  Rh28  1  0.00011563  0.50051431  0.50051431  1.0
  Rh  Rh29  1  0.50051431  0.00011563  0.50051431  1.0