# generated using pymatgen
data_Li6I3N
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   6.71862158
_cell_length_b   6.71862158
_cell_length_c   6.68798547
_cell_angle_alpha   60.42202457
_cell_angle_beta   60.42202457
_cell_angle_gamma   90.93109151
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Li6I3N
_chemical_formula_sum   'Li6 I3 N1'
_cell_volume   214.43471306
_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  0.72280422  0.72280422  0.40712600  1
  Li  Li1  1  0.78163461  0.18298530  0.03675952  1
  Li  Li2  1  0.86927318  0.86927318  0.87988618  1
  Li  Li3  1  0.10404748  0.10404748  0.17291180  1
  Li  Li4  1  0.24897251  0.24897251  0.64721658  1
  Li  Li5  1  0.18298530  0.78163461  0.03675952  1
  I  I6  1  0.74387582  0.24389047  0.51242473  1
  I  I7  1  0.49298861  0.49298861  0.01363543  1
  I  I8  1  0.24389047  0.74387582  0.51242473  1
  N  N9  1  0.98672680  0.98672680  0.02645750  1
