# generated using pymatgen
data_Li6NCl3
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   3.73818200
_cell_length_b   3.74088082
_cell_length_c   13.47811573
_cell_angle_alpha   97.19075264
_cell_angle_beta   90.49617285
_cell_angle_gamma   119.93689316
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Li6NCl3
_chemical_formula_sum   'Li6 N1 Cl3'
_cell_volume   161.49140241
_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  0.38111400  0.67518500  0.96757600  1
  Li  Li1  1  0.13352200  0.05722800  0.83842700  1
  Li  Li2  1  0.94485600  0.94670600  0.12852600  1
  Li  Li3  1  0.63773200  0.77876600  0.58507200  1
  Li  Li4  1  0.13677400  0.53045200  0.33468200  1
  Li  Li5  1  0.69544200  0.33051100  0.99761100  1
  N  N6  1  0.03477000  0.00045700  0.98792200  1
  Cl  Cl7  1  0.52011900  0.75288700  0.75679700  1
  Cl  Cl8  1  0.02211300  0.47485300  0.50611700  1
  Cl  Cl9  1  0.52355800  0.22795400  0.25227100  1
