# generated using pymatgen
data_Li3N
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   3.52407593
_cell_length_b   3.52407723
_cell_length_c   6.25954487
_cell_angle_alpha   90.00000000
_cell_angle_beta   90.00000000
_cell_angle_gamma   119.99999728
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Li3N
_chemical_formula_sum   'Li6 N2'
_cell_volume   67.32309528
_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
  Li  Li0  1  0.00000000  -0.00000000  0.25000000  1
  Li  Li1  1  -0.00000000  0.00000000  0.75000000  1
  Li  Li2  1  0.33333300  0.66666700  0.57699336  1
  Li  Li3  1  0.66666700  0.33333300  0.07699336  1
  Li  Li4  1  0.66666700  0.33333300  0.42300664  1
  Li  Li5  1  0.33333300  0.66666700  0.92300664  1
  N  N6  1  0.33333300  0.66666700  0.25000000  1
  N  N7  1  0.66666700  0.33333300  0.75000000  1
