# generated using pymatgen
data_Ti7NbAl15Ir7
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   8.61215252
_cell_length_b   8.61706243
_cell_length_c   8.61055344
_cell_angle_alpha   120.09433676
_cell_angle_beta   119.91139052
_cell_angle_gamma   90.01490250
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Ti7NbAl15Ir7
_chemical_formula_sum   'Ti7 Nb1 Al15 Ir7'
_cell_volume   451.74335930
_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  0.21417243  0.28936124  0.49606110  1.0
  Ti  Ti1  1  0.20516109  0.70545819  0.49685891  1.0
  Ti  Ti2  1  0.21781708  0.72062139  0.93023039  1.0
  Ti  Ti3  1  0.79169902  0.71448709  0.49805249  1.0
  Ti  Ti4  1  0.78218615  0.28162270  0.49653178  1.0
  Ti  Ti5  1  0.37975159  0.12342935  0.74493761  1.0
  Ti  Ti6  1  0.37900474  0.63601047  0.25599916  1.0
  Nb  Nb7  1  0.79624544  0.29629730  0.08622594  1.0
  Al  Al8  1  0.00248692  0.50137562  0.51192609  1.0
  Al  Al9  1  0.15556585  0.34060144  0.18422952  1.0
  Al  Al10  1  0.15375786  0.96492010  0.81030497  1.0
  Al  Al11  1  0.14916785  0.34643729  0.80209927  1.0
  Al  Al12  1  0.53697984  0.34452912  0.19281925  1.0
  Al  Al13  1  0.84487423  0.65190853  0.80613153  1.0
  Al  Al14  1  0.84349365  0.03255652  0.18873821  1.0
  Al  Al15  1  0.84030343  0.65680714  0.18294984  1.0
  Al  Al16  1  0.46624757  0.65445075  0.81133033  1.0
  Al  Al17  1  0.37992188  0.12214991  0.25908966  1.0
  Al  Al18  1  0.86413541  0.12203640  0.74327908  1.0
  Al  Al19  1  0.62216984  0.87853505  0.25748507  1.0
  Al  Al20  1  0.62168118  0.36512945  0.74307590  1.0
  Al  Al21  1  0.62248580  0.87826652  0.74439264  1.0
  Al  Al22  1  0.13466778  0.87858165  0.25674391  1.0
  Ir  Ir23  1  0.00178562  0.99922185  0.50128725  1.0
  Ir  Ir24  1  0.49663125  0.99818599  0.99835339  1.0
  Ir  Ir25  1  0.49579588  0.49815392  0.99967674  1.0
  Ir  Ir26  1  0.49725814  0.50005852  0.49751864  1.0
  Ir  Ir27  1  0.00309878  0.50130117  0.00201873  1.0
  Ir  Ir28  1  0.00114371  0.99771271  0.00014032  1.0
  Ir  Ir29  1  0.50030398  0.99979463  0.50151326  1.0