# generated using pymatgen
data_Nb12Ga9Fe3N4
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   8.21050935
_cell_length_b   8.22964188
_cell_length_c   8.22964177
_cell_angle_alpha   59.99999640
_cell_angle_beta   59.92288242
_cell_angle_gamma   59.92288395
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Nb12Ga9Fe3N4
_chemical_formula_sum   'Nb12 Ga9 Fe3 N4'
_cell_volume   392.74417400
_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  0.80741991  0.80551147  0.19353481  1.0
  Nb  Nb1  1  0.19424028  0.19605037  0.80485468  1.0
  Nb  Nb2  1  0.80741991  0.19353481  0.80551147  1.0
  Nb  Nb3  1  0.19424028  0.80485468  0.19605037  1.0
  Nb  Nb4  1  0.19424028  0.80485468  0.80485468  1.0
  Nb  Nb5  1  0.80741991  0.19353481  0.19353481  1.0
  Nb  Nb6  1  0.44258009  0.44448853  0.05646519  1.0
  Nb  Nb7  1  0.05575972  0.05394963  0.44514532  1.0
  Nb  Nb8  1  0.44258009  0.05646519  0.44448853  1.0
  Nb  Nb9  1  0.05575972  0.44514532  0.05394963  1.0
  Nb  Nb10  1  0.05575972  0.44514532  0.44514532  1.0
  Nb  Nb11  1  0.44258009  0.05646519  0.05646519  1.0
  Ga  Ga12  1  0.12500000  0.62500000  0.62500000  1.0
  Ga  Ga13  1  0.75776418  0.41407894  0.41407894  1.0
  Ga  Ga14  1  0.42443190  0.75748359  0.40904275  1.0
  Ga  Ga15  1  0.42443190  0.40904275  0.75748359  1.0
  Ga  Ga16  1  0.42443190  0.40904275  0.40904275  1.0
  Ga  Ga17  1  0.49223582  0.83592106  0.83592106  1.0
  Ga  Ga18  1  0.82556810  0.49251641  0.84095725  1.0
  Ga  Ga19  1  0.82556810  0.84095725  0.49251641  1.0
  Ga  Ga20  1  0.82556810  0.84095725  0.84095725  1.0
  Fe  Fe21  1  0.62500000  0.12500000  0.62500000  1.0
  Fe  Fe22  1  0.62500000  0.62500000  0.12500000  1.0
  Fe  Fe23  1  0.62500000  0.62500000  0.62500000  1.0
  N  N24  1  0.62500000  0.12500000  0.12500000  1.0
  N  N25  1  0.12500000  0.62500000  0.12500000  1.0
  N  N26  1  0.12500000  0.12500000  0.62500000  1.0
  N  N27  1  0.12500000  0.12500000  0.12500000  1.0