# generated using pymatgen
data_Pa2(Al3Ir)3
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   7.59270675
_cell_length_b   7.59275197
_cell_length_c   9.33915882
_cell_angle_alpha   90.00000000
_cell_angle_beta   90.00000000
_cell_angle_gamma   119.36085390
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Pa2(Al3Ir)3
_chemical_formula_sum   'Pa4 Al18 Ir6'
_cell_volume   469.24041848
_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
  Pa  Pa0  1  0.99500816  0.67699593  0.25000000  1.0
  Pa  Pa1  1  0.00499184  0.32300407  0.75000000  1.0
  Pa  Pa2  1  0.67704837  0.99499584  0.25000000  1.0
  Pa  Pa3  1  0.32295163  0.00500416  0.75000000  1.0
  Al  Al4  1  0.13584389  0.13586583  0.25000000  1.0
  Al  Al5  1  0.86415611  0.86413417  0.75000000  1.0
  Al  Al6  1  0.00348428  0.33731442  0.07289763  1.0
  Al  Al7  1  0.99651572  0.66268558  0.92710237  1.0
  Al  Al8  1  0.99651572  0.66268558  0.57289763  1.0
  Al  Al9  1  0.33733075  0.00349689  0.42710609  1.0
  Al  Al10  1  0.00348428  0.33731442  0.42710237  1.0
  Al  Al11  1  0.66266925  0.99650311  0.57289391  1.0
  Al  Al12  1  0.66266925  0.99650311  0.92710609  1.0
  Al  Al13  1  0.33733075  0.00349689  0.07289391  1.0
  Al  Al14  1  0.33617883  0.33618771  0.54738673  1.0
  Al  Al15  1  0.66382117  0.66381229  0.45261327  1.0
  Al  Al16  1  0.66382117  0.66381229  0.04738673  1.0
  Al  Al17  1  0.33617883  0.33618771  0.95261327  1.0
  Al  Al18  1  0.34126647  0.54822378  0.25000000  1.0
  Al  Al19  1  0.65873353  0.45177622  0.75000000  1.0
  Al  Al20  1  0.54828230  0.34132529  0.25000000  1.0
  Al  Al21  1  0.45171770  0.65867471  0.75000000  1.0
  Ir  Ir22  1  0.67229464  0.32771164  0.00000744  1.0
  Ir  Ir23  1  0.32770536  0.67228836  0.99999256  1.0
  Ir  Ir24  1  0.32770536  0.67228836  0.50000744  1.0
  Ir  Ir25  1  0.67229464  0.32771164  0.49999256  1.0
  Ir  Ir26  1  0.00000000  0.00000000  0.00000000  1.0
  Ir  Ir27  1  0.00000000  0.00000000  0.50000000  1.0