# generated using pymatgen
data_Ni8N
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   5.57300000
_cell_length_b   5.57300000
_cell_length_c   6.11700000
_cell_angle_alpha   90.00000000
_cell_angle_beta   90.00000000
_cell_angle_gamma   90.00000000
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Ni8N
_chemical_formula_sum   'Ni16 N2'
_cell_volume   189.98379849
_cell_formula_units_Z   2
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
  N  N0  1  0.00000000  0.00000000  0.00000000  1
  N  N1  1  0.50000000  0.50000000  0.50000000  1
  Ni  Ni2  1  0.23759000  0.23759000  0.00000000  1
  Ni  Ni3  1  0.76241000  0.76241000  0.00000000  1
  Ni  Ni4  1  0.76241000  0.23759000  0.00000000  1
  Ni  Ni5  1  0.23759000  0.76241000  0.00000000  1
  Ni  Ni6  1  0.73759000  0.73759000  0.50000000  1
  Ni  Ni7  1  0.26241000  0.26241000  0.50000000  1
  Ni  Ni8  1  0.26241000  0.73759000  0.50000000  1
  Ni  Ni9  1  0.73759000  0.26241000  0.50000000  1
  Ni  Ni10  1  0.00000000  0.00000000  0.70375000  1
  Ni  Ni11  1  0.00000000  0.00000000  0.29625000  1
  Ni  Ni12  1  0.50000000  0.50000000  0.20375000  1
  Ni  Ni13  1  0.50000000  0.50000000  0.79625000  1
  Ni  Ni14  1  0.00000000  0.50000000  0.25000000  1
  Ni  Ni15  1  0.00000000  0.50000000  0.75000000  1
  Ni  Ni16  1  0.50000000  0.00000000  0.25000000  1
  Ni  Ni17  1  0.50000000  0.00000000  0.75000000  1
