# generated using pymatgen
data_Li9Ni3N4
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   5.13248431
_cell_length_b   5.13248424
_cell_length_c   9.64085530
_cell_angle_alpha   82.97455098
_cell_angle_beta   82.97455206
_cell_angle_gamma   41.88569217
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Li9Ni3N4
_chemical_formula_sum   'Li9 Ni3 N4'
_cell_volume   168.09736365
_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
  Li  Li0  1  0.41676822  0.41676822  0.25243402  1.0
  Li  Li1  1  0.17889511  0.17889511  0.00690246  1.0
  Li  Li2  1  0.94687659  0.94687659  0.77316711  1.0
  Li  Li3  1  0.70052789  0.70052789  0.53868341  1.0
  Li  Li4  1  0.82110489  0.82110489  0.99309754  1.0
  Li  Li5  1  0.58323178  0.58323178  0.74756598  1.0
  Li  Li6  1  0.29947211  0.29947211  0.46131659  1.0
  Li  Li7  1  0.05312341  0.05312341  0.22683289  1.0
  Li  Li8  1  0.00000000  0.00000000  0.50000000  1.0
  Ni  Ni9  1  0.73427786  0.73427786  0.25590658  1.0
  Ni  Ni10  1  0.50000000  0.50000000  0.00000000  1.0
  Ni  Ni11  1  0.26572214  0.26572214  0.74409342  1.0
  N  N12  1  0.61831228  0.61831228  0.12642249  1.0
  N  N13  1  0.38168772  0.38168772  0.87357751  1.0
  N  N14  1  0.13576835  0.13576835  0.62827900  1.0
  N  N15  1  0.86423165  0.86423165  0.37172100  1.0