# generated using pymatgen
data_Li10Fe4S9
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   11.74872800
_cell_length_b   11.74872800
_cell_length_c   5.71949300
_cell_angle_alpha   90.00000000
_cell_angle_beta   90.00000000
_cell_angle_gamma   90.00000000
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Li10Fe4S9
_chemical_formula_sum   'Li20 Fe8 S18'
_cell_volume   789.47654448
_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  0.14983900  0.31647200  0.21505600  1.0
  Li  Li1  1  0.85016100  0.31647200  0.21505600  1.0
  Li  Li2  1  0.81647200  0.35016100  0.71505600  1.0
  Li  Li3  1  0.18352800  0.35016100  0.71505600  1.0
  Li  Li4  1  0.00000000  0.50000000  0.17514000  1.0
  Li  Li5  1  0.00000000  0.50000000  0.67514000  1.0
  Li  Li6  1  0.81647200  0.64983900  0.71505600  1.0
  Li  Li7  1  0.18352800  0.64983900  0.71505600  1.0
  Li  Li8  1  0.85016100  0.68352800  0.21505600  1.0
  Li  Li9  1  0.14983900  0.68352800  0.21505600  1.0
  Li  Li10  1  0.35016100  0.81647200  0.28494400  1.0
  Li  Li11  1  0.64983900  0.81647200  0.28494400  1.0
  Li  Li12  1  0.31647200  0.85016100  0.78494400  1.0
  Li  Li13  1  0.68352800  0.85016100  0.78494400  1.0
  Li  Li14  1  0.50000000  0.00000000  0.82486000  1.0
  Li  Li15  1  0.50000000  0.00000000  0.32486000  1.0
  Li  Li16  1  0.68352800  0.14983900  0.78494400  1.0
  Li  Li17  1  0.31647200  0.14983900  0.78494400  1.0
  Li  Li18  1  0.35016100  0.18352800  0.28494400  1.0
  Li  Li19  1  0.64983900  0.18352800  0.28494400  1.0
  Fe  Fe20  1  0.50000000  0.34676500  0.76851500  1.0
  Fe  Fe21  1  0.65323500  0.50000000  0.23148500  1.0
  Fe  Fe22  1  0.34676500  0.50000000  0.23148500  1.0
  Fe  Fe23  1  0.50000000  0.65323500  0.76851500  1.0
  Fe  Fe24  1  0.00000000  0.84676500  0.73148500  1.0
  Fe  Fe25  1  0.84676500  0.00000000  0.26851500  1.0
  Fe  Fe26  1  0.15323500  0.00000000  0.26851500  1.0
  Fe  Fe27  1  0.00000000  0.15323500  0.73148500  1.0
  S  S28  1  0.33548400  0.33548400  0.00000000  1.0
  S  S29  1  0.66451600  0.33548400  0.00000000  1.0
  S  S30  1  0.00000000  0.33361100  0.92764700  1.0
  S  S31  1  0.50000000  0.50000000  0.50000000  1.0
  S  S32  1  0.83361100  0.50000000  0.42764700  1.0
  S  S33  1  0.16638900  0.50000000  0.42764700  1.0
  S  S34  1  0.00000000  0.66638900  0.92764700  1.0
  S  S35  1  0.33548400  0.66451600  0.00000000  1.0
  S  S36  1  0.66451600  0.66451600  0.00000000  1.0
  S  S37  1  0.83548400  0.83548400  0.50000000  1.0
  S  S38  1  0.16451600  0.83548400  0.50000000  1.0
  S  S39  1  0.50000000  0.83361100  0.57235300  1.0
  S  S40  1  0.66638900  0.00000000  0.07235300  1.0
  S  S41  1  0.00000000  0.00000000  0.00000000  1.0
  S  S42  1  0.33361100  0.00000000  0.07235300  1.0
  S  S43  1  0.50000000  0.16638900  0.57235300  1.0
  S  S44  1  0.83548400  0.16451600  0.50000000  1.0
  S  S45  1  0.16451600  0.16451600  0.50000000  1.0