# generated using pymatgen
data_Ta3AlIrN
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   6.97952340
_cell_length_b   6.97952340
_cell_length_c   6.97952340
_cell_angle_alpha   90.00000000
_cell_angle_beta   90.00000000
_cell_angle_gamma   90.00000000
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Ta3AlIrN
_chemical_formula_sum   'Ta12 Al4 Ir4 N4'
_cell_volume   339.99873686
_cell_formula_units_Z   4
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
  Ta  Ta0  1  0.79395901  0.95509281  0.37697087  1.0
  Ta  Ta1  1  0.70604099  0.04490719  0.87697087  1.0
  Ta  Ta2  1  0.20604099  0.45509281  0.12302913  1.0
  Ta  Ta3  1  0.29395901  0.54490719  0.62302913  1.0
  Ta  Ta4  1  0.95509281  0.37697087  0.79395901  1.0
  Ta  Ta5  1  0.04490719  0.87697087  0.70604099  1.0
  Ta  Ta6  1  0.45509281  0.12302913  0.20604099  1.0
  Ta  Ta7  1  0.54490719  0.62302913  0.29395901  1.0
  Ta  Ta8  1  0.37697087  0.79395901  0.95509281  1.0
  Ta  Ta9  1  0.87697087  0.70604099  0.04490719  1.0
  Ta  Ta10  1  0.12302913  0.20604099  0.45509281  1.0
  Ta  Ta11  1  0.62302913  0.29395901  0.54490719  1.0
  Al  Al12  1  0.57061868  0.42938132  0.92938132  1.0
  Al  Al13  1  0.42938132  0.92938132  0.57061868  1.0
  Al  Al14  1  0.92938132  0.57061868  0.42938132  1.0
  Al  Al15  1  0.07061868  0.07061868  0.07061868  1.0
  Ir  Ir16  1  0.17769983  0.82230017  0.32230017  1.0
  Ir  Ir17  1  0.32230017  0.17769983  0.82230017  1.0
  Ir  Ir18  1  0.82230017  0.32230017  0.17769983  1.0
  Ir  Ir19  1  0.67769983  0.67769983  0.67769983  1.0
  N  N20  1  0.87400165  0.12599835  0.62599835  1.0
  N  N21  1  0.62599835  0.87400165  0.12599835  1.0
  N  N22  1  0.12599835  0.62599835  0.87400165  1.0
  N  N23  1  0.37400165  0.37400165  0.37400165  1.0