# generated using pymatgen
data_Nb12Ga5Ni3N4
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   6.96576234
_cell_length_b   6.96576319
_cell_length_c   6.96576281
_cell_angle_alpha   90.24755946
_cell_angle_beta   90.24755817
_cell_angle_gamma   90.24756401
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Nb12Ga5Ni3N4
_chemical_formula_sum   'Nb12 Ga5 Ni3 N4'
_cell_volume   337.98221266
_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  0.79558713  0.95841522  0.37330072  1.0
  Nb  Nb1  1  0.70585565  0.04485897  0.87510707  1.0
  Nb  Nb2  1  0.20719672  0.45552568  0.12412049  1.0
  Nb  Nb3  1  0.29272505  0.54396416  0.62443361  1.0
  Nb  Nb4  1  0.95841522  0.37330072  0.79558713  1.0
  Nb  Nb5  1  0.04485897  0.87510707  0.70585565  1.0
  Nb  Nb6  1  0.45552568  0.12412049  0.20719672  1.0
  Nb  Nb7  1  0.54396416  0.62443361  0.29272505  1.0
  Nb  Nb8  1  0.37330072  0.79558713  0.95841522  1.0
  Nb  Nb9  1  0.87510707  0.70585565  0.04485897  1.0
  Nb  Nb10  1  0.12412049  0.20719672  0.45552568  1.0
  Nb  Nb11  1  0.62443361  0.29272505  0.54396416  1.0
  Ga  Ga12  1  0.67809889  0.67809889  0.67809889  1.0
  Ga  Ga13  1  0.56967938  0.41619882  0.93659938  1.0
  Ga  Ga14  1  0.41619882  0.93659938  0.56967938  1.0
  Ga  Ga15  1  0.93659938  0.56967938  0.41619882  1.0
  Ga  Ga16  1  0.07364960  0.07364960  0.07364960  1.0
  Ni  Ni17  1  0.17612796  0.82491535  0.32054119  1.0
  Ni  Ni18  1  0.32054119  0.17612796  0.82491535  1.0
  Ni  Ni19  1  0.82491535  0.32054119  0.17612796  1.0
  N  N20  1  0.87755909  0.12541562  0.62492949  1.0
  N  N21  1  0.62492949  0.87755909  0.12541562  1.0
  N  N22  1  0.12541562  0.62492949  0.87755909  1.0
  N  N23  1  0.37519676  0.37519676  0.37519676  1.0