# generated using pymatgen
data_Li6MnS4
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   8.01416210
_cell_length_b   8.01416210
_cell_length_c   5.75655003
_cell_angle_alpha   90.00000000
_cell_angle_beta   90.00000000
_cell_angle_gamma   90.00000000
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Li6MnS4
_chemical_formula_sum   'Li12 Mn2 S8'
_cell_volume   369.72475388
_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  0.27247952  0.27247952  0.50000000  1.0
  Li  Li1  1  0.72752048  0.27247952  0.50000000  1.0
  Li  Li2  1  -0.00000000  0.50000000  0.46040726  1.0
  Li  Li3  1  -0.00000000  0.50000000  0.96040726  1.0
  Li  Li4  1  0.27247952  0.72752048  0.50000000  1.0
  Li  Li5  1  0.72752048  0.72752048  0.50000000  1.0
  Li  Li6  1  0.77247952  0.77247952  0.00000000  1.0
  Li  Li7  1  0.22752048  0.77247952  0.00000000  1.0
  Li  Li8  1  0.50000000  0.00000000  0.03959274  1.0
  Li  Li9  1  0.50000000  0.00000000  0.53959274  1.0
  Li  Li10  1  0.77247952  0.22752048  0.00000000  1.0
  Li  Li11  1  0.22752048  0.22752048  0.00000000  1.0
  Mn  Mn12  1  0.50000000  0.50000000  0.00000000  1.0
  Mn  Mn13  1  -0.00000000  0.00000000  0.50000000  1.0
  S  S14  1  -0.00000000  0.25782938  0.71716699  1.0
  S  S15  1  0.75782938  0.50000000  0.21716699  1.0
  S  S16  1  0.24217062  0.50000000  0.21716699  1.0
  S  S17  1  -0.00000000  0.74217062  0.71716699  1.0
  S  S18  1  0.50000000  0.75782938  0.78283301  1.0
  S  S19  1  0.74217062  0.00000000  0.28283301  1.0
  S  S20  1  0.25782938  0.00000000  0.28283301  1.0
  S  S21  1  0.50000000  0.24217062  0.78283301  1.0