# generated using pymatgen
data_Nb16Cu5Ni3N4
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   8.26819111
_cell_length_b   8.26029281
_cell_length_c   8.26029197
_cell_angle_alpha   59.99999941
_cell_angle_beta   60.03159422
_cell_angle_gamma   60.03159595
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Nb16Cu5Ni3N4
_chemical_formula_sum   'Nb16 Cu5 Ni3 N4'
_cell_volume   399.11089523
_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  0.11798538  0.62733887  0.62733887  1.0
  Nb  Nb1  1  0.63143162  0.12046879  0.62404980  1.0
  Nb  Nb2  1  0.63143162  0.62404980  0.12046879  1.0
  Nb  Nb3  1  0.63143162  0.62404980  0.62404980  1.0
  Nb  Nb4  1  0.81615226  0.81590605  0.18397035  1.0
  Nb  Nb5  1  0.18246246  0.18675486  0.81539084  1.0
  Nb  Nb6  1  0.81615226  0.18397035  0.81590605  1.0
  Nb  Nb7  1  0.18246246  0.81539084  0.18675486  1.0
  Nb  Nb8  1  0.18246246  0.81539084  0.81539084  1.0
  Nb  Nb9  1  0.81615226  0.18397035  0.18397035  1.0
  Nb  Nb10  1  0.43532617  0.43567099  0.06450092  1.0
  Nb  Nb11  1  0.06696642  0.06525957  0.43388701  1.0
  Nb  Nb12  1  0.43532617  0.06450092  0.43567099  1.0
  Nb  Nb13  1  0.06696642  0.43388701  0.06525957  1.0
  Nb  Nb14  1  0.06696642  0.43388701  0.43388701  1.0
  Nb  Nb15  1  0.43532617  0.06450092  0.06450092  1.0
  Cu  Cu16  1  0.74813733  0.41728722  0.41728722  1.0
  Cu  Cu17  1  0.41824992  0.74658273  0.41758317  1.0
  Cu  Cu18  1  0.41824992  0.41758317  0.74658273  1.0
  Cu  Cu19  1  0.41824992  0.41758317  0.41758317  1.0
  Cu  Cu20  1  0.50083879  0.83305340  0.83305340  1.0
  Ni  Ni21  1  0.82718500  0.51495001  0.82893300  1.0
  Ni  Ni22  1  0.82718500  0.82893300  0.51495001  1.0
  Ni  Ni23  1  0.82718500  0.82893300  0.82893300  1.0
  N  N24  1  0.62323218  0.12558961  0.12558961  1.0
  N  N25  1  0.12549325  0.62385879  0.12532448  1.0
  N  N26  1  0.12549325  0.12532448  0.62385879  1.0
  N  N27  1  0.12549325  0.12532448  0.12532448  1.0