# generated using pymatgen
data_Nb3GaIrN
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   7.01628776
_cell_length_b   7.01628776
_cell_length_c   7.01628776
_cell_angle_alpha   90.00000000
_cell_angle_beta   90.00000000
_cell_angle_gamma   90.00000000
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Nb3GaIrN
_chemical_formula_sum   'Nb12 Ga4 Ir4 N4'
_cell_volume   345.39987635
_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
  Nb  Nb0  1  0.79560382  0.95435008  0.37796721  1.0
  Nb  Nb1  1  0.70439618  0.04564992  0.87796721  1.0
  Nb  Nb2  1  0.20439618  0.45435008  0.12203279  1.0
  Nb  Nb3  1  0.29560382  0.54564992  0.62203279  1.0
  Nb  Nb4  1  0.95435008  0.37796721  0.79560382  1.0
  Nb  Nb5  1  0.04564992  0.87796721  0.70439618  1.0
  Nb  Nb6  1  0.45435008  0.12203279  0.20439618  1.0
  Nb  Nb7  1  0.54564992  0.62203279  0.29560382  1.0
  Nb  Nb8  1  0.37796721  0.79560382  0.95435008  1.0
  Nb  Nb9  1  0.87796721  0.70439618  0.04564992  1.0
  Nb  Nb10  1  0.12203279  0.20439618  0.45435008  1.0
  Nb  Nb11  1  0.62203279  0.29560382  0.54564992  1.0
  Ga  Ga12  1  0.56819492  0.43180508  0.93180508  1.0
  Ga  Ga13  1  0.43180508  0.93180508  0.56819492  1.0
  Ga  Ga14  1  0.93180508  0.56819492  0.43180508  1.0
  Ga  Ga15  1  0.06819492  0.06819492  0.06819492  1.0
  Ir  Ir16  1  0.17813356  0.82186644  0.32186644  1.0
  Ir  Ir17  1  0.32186644  0.17813356  0.82186644  1.0
  Ir  Ir18  1  0.82186644  0.32186644  0.17813356  1.0
  Ir  Ir19  1  0.67813356  0.67813356  0.67813356  1.0
  N  N20  1  0.87272411  0.12727589  0.62727589  1.0
  N  N21  1  0.62727589  0.87272411  0.12727589  1.0
  N  N22  1  0.12727589  0.62727589  0.87272411  1.0
  N  N23  1  0.37272411  0.37272411  0.37272411  1.0