# generated using pymatgen
data_Nb12Al9Ir3C4
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   8.35023939
_cell_length_b   8.32855727
_cell_length_c   8.35023926
_cell_angle_alpha   59.91384508
_cell_angle_beta   60.00000050
_cell_angle_gamma   59.91384946
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Nb12Al9Ir3C4
_chemical_formula_sum   'Nb12 Al9 Ir3 C4'
_cell_volume   410.09630827
_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
  Nb  Nb0  1  0.81405527  0.81603429  0.18495522  1.0
  Nb  Nb1  1  0.19326198  0.18671529  0.81001186  1.0
  Nb  Nb2  1  0.81001186  0.18671529  0.81001186  1.0
  Nb  Nb3  1  0.18495522  0.81603429  0.18495522  1.0
  Nb  Nb4  1  0.18495522  0.81603429  0.81405527  1.0
  Nb  Nb5  1  0.81001186  0.18671529  0.19326198  1.0
  Nb  Nb6  1  0.43594473  0.43396571  0.06504478  1.0
  Nb  Nb7  1  0.05673802  0.06328471  0.43998814  1.0
  Nb  Nb8  1  0.43998814  0.06328471  0.43998814  1.0
  Nb  Nb9  1  0.06504478  0.43396571  0.06504478  1.0
  Nb  Nb10  1  0.06504478  0.43396571  0.43594473  1.0
  Nb  Nb11  1  0.43998814  0.06328471  0.05673802  1.0
  Al  Al12  1  0.62500000  0.12500000  0.62500000  1.0
  Al  Al13  1  0.75180373  0.42535794  0.41142017  1.0
  Al  Al14  1  0.41551619  0.75345344  0.41551619  1.0
  Al  Al15  1  0.41142017  0.42535794  0.75180373  1.0
  Al  Al16  1  0.41142017  0.42535794  0.41142017  1.0
  Al  Al17  1  0.49819627  0.82464206  0.83857983  1.0
  Al  Al18  1  0.83448381  0.49654656  0.83448381  1.0
  Al  Al19  1  0.83857983  0.82464206  0.49819627  1.0
  Al  Al20  1  0.83857983  0.82464206  0.83857983  1.0
  Ir  Ir21  1  0.12500000  0.62500000  0.62500000  1.0
  Ir  Ir22  1  0.62500000  0.62500000  0.12500000  1.0
  Ir  Ir23  1  0.62500000  0.62500000  0.62500000  1.0
  C  C24  1  0.62500000  0.12500000  0.12500000  1.0
  C  C25  1  0.12500000  0.62500000  0.12500000  1.0
  C  C26  1  0.12500000  0.12500000  0.62500000  1.0
  C  C27  1  0.12500000  0.12500000  0.12500000  1.0