# generated using pymatgen
data_Ti13Al9Ir8
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   8.71336137
_cell_length_b   8.71336099
_cell_length_c   8.71336162
_cell_angle_alpha   59.77486916
_cell_angle_beta   59.77487280
_cell_angle_gamma   59.77487774
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Ti13Al9Ir8
_chemical_formula_sum   'Ti13 Al9 Ir8'
_cell_volume   465.38956630
_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  0.21134382  0.21134382  0.78945336  1.0
  Ti  Ti1  1  0.78945336  0.21134382  0.21134382  1.0
  Ti  Ti2  1  0.21134382  0.78945336  0.21134382  1.0
  Ti  Ti3  1  0.79498384  0.79498384  0.19636937  1.0
  Ti  Ti4  1  0.19636937  0.79498384  0.79498384  1.0
  Ti  Ti5  1  0.79498384  0.19636937  0.79498384  1.0
  Ti  Ti6  1  0.37788641  0.37788641  0.37788641  1.0
  Ti  Ti7  1  0.37870677  0.86761649  0.37870677  1.0
  Ti  Ti8  1  0.86761649  0.37870677  0.37870677  1.0
  Ti  Ti9  1  0.37870677  0.37870677  0.86761649  1.0
  Ti  Ti10  1  0.84411498  0.46864100  0.84411498  1.0
  Ti  Ti11  1  0.46864100  0.84411498  0.84411498  1.0
  Ti  Ti12  1  0.84411498  0.84411498  0.46864100  1.0
  Al  Al13  1  0.15450497  0.15450497  0.15450497  1.0
  Al  Al14  1  0.15644052  0.53273286  0.15644052  1.0
  Al  Al15  1  0.53273286  0.15644052  0.15644052  1.0
  Al  Al16  1  0.15644052  0.15644052  0.53273286  1.0
  Al  Al17  1  0.62001589  0.62001589  0.62001589  1.0
  Al  Al18  1  0.62105927  0.14064355  0.62105927  1.0
  Al  Al19  1  0.14064355  0.62105927  0.62105927  1.0
  Al  Al20  1  0.62105927  0.62105927  0.14064355  1.0
  Al  Al21  1  0.82996956  0.82996956  0.82996956  1.0
  Ir  Ir22  1  0.00355293  0.00355293  0.49791833  1.0
  Ir  Ir23  1  0.49791833  0.00355293  0.00355293  1.0
  Ir  Ir24  1  0.00355293  0.49791833  0.00355293  1.0
  Ir  Ir25  1  0.49793084  0.49793084  0.00342331  1.0
  Ir  Ir26  1  0.00342331  0.49793084  0.49793084  1.0
  Ir  Ir27  1  0.49793084  0.00342331  0.49793084  1.0
  Ir  Ir28  1  0.50063146  0.50063146  0.50063146  1.0
  Ir  Ir29  1  0.00392454  0.00392454  0.00392454  1.0