# generated using pymatgen
data_Nb12Ga9Ni3N4
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   8.20506447
_cell_length_b   8.20749775
_cell_length_c   8.20749709
_cell_angle_alpha   59.99999870
_cell_angle_beta   59.99018814
_cell_angle_gamma   59.99018269
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Nb12Ga9Ni3N4
_chemical_formula_sum   'Nb12 Ga9 Ni3 N4'
_cell_volume   390.77256265
_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  0.81565973  0.81201565  0.18616331  1.0
  Nb  Nb1  1  0.18651849  0.19696603  0.80825774  1.0
  Nb  Nb2  1  0.81565973  0.18616331  0.81201565  1.0
  Nb  Nb3  1  0.18651849  0.80825774  0.19696603  1.0
  Nb  Nb4  1  0.18651849  0.80825774  0.80825774  1.0
  Nb  Nb5  1  0.81565973  0.18616331  0.18616331  1.0
  Nb  Nb6  1  0.43434027  0.43798435  0.06383669  1.0
  Nb  Nb7  1  0.06348151  0.05303397  0.44174226  1.0
  Nb  Nb8  1  0.43434027  0.06383669  0.43798435  1.0
  Nb  Nb9  1  0.06348151  0.44174226  0.05303397  1.0
  Nb  Nb10  1  0.06348151  0.44174226  0.44174226  1.0
  Nb  Nb11  1  0.43434027  0.06383669  0.06383669  1.0
  Ga  Ga12  1  0.12500000  0.62500000  0.62500000  1.0
  Ga  Ga13  1  0.75893535  0.41368888  0.41368888  1.0
  Ga  Ga14  1  0.43294971  0.75179242  0.40762994  1.0
  Ga  Ga15  1  0.43294971  0.40762994  0.75179242  1.0
  Ga  Ga16  1  0.43294971  0.40762994  0.40762994  1.0
  Ga  Ga17  1  0.49106465  0.83631112  0.83631112  1.0
  Ga  Ga18  1  0.81705029  0.49820758  0.84237006  1.0
  Ga  Ga19  1  0.81705029  0.84237006  0.49820758  1.0
  Ga  Ga20  1  0.81705029  0.84237006  0.84237006  1.0
  Ni  Ni21  1  0.62500000  0.12500000  0.62500000  1.0
  Ni  Ni22  1  0.62500000  0.62500000  0.12500000  1.0
  Ni  Ni23  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