# generated using pymatgen
data_Li2S
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   36.82345544
_cell_length_b   36.82345544
_cell_length_c   36.82345536
_cell_angle_alpha   6.22105896
_cell_angle_beta   6.22105896
_cell_angle_gamma   6.22105889
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Li2S
_chemical_formula_sum   'Li22 S11'
_cell_volume   508.28435310
_cell_formula_units_Z   11
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  0.67483900  0.67590200  0.68592100  1
  Li  Li1  1  0.03283500  0.04115500  0.05627300  1
  Li  Li2  1  0.01188700  0.03621200  0.01900800  1
  Li  Li3  1  0.37955300  0.39985000  0.37809100  1
  Li  Li4  1  0.41139200  0.41322100  0.39380600  1
  Li  Li5  1  0.41925600  0.43743900  0.44197600  1
  Li  Li6  1  0.75186800  0.74036000  0.76021700  1
  Li  Li7  1  0.78478000  0.79649900  0.80631600  1
  Li  Li8  1  0.16898200  0.14698100  0.16070000  1
  Li  Li9  1  0.11755100  0.12381600  0.09983200  1
  Li  Li10  1  0.47396000  0.46782400  0.49050500  1
  Li  Li11  1  0.52324100  0.53389000  0.51157500  1
  Li  Li12  1  0.85047600  0.84334400  0.82916200  1
  Li  Li13  1  0.89523500  0.87287100  0.89128900  1
  Li  Li14  1  0.19202600  0.20671100  0.21492200  1
  Li  Li15  1  0.24422900  0.26198000  0.24450800  1
  Li  Li16  1  0.55803300  0.57146200  0.57355300  1
  Li  Li17  1  0.61973200  0.60409900  0.61820700  1
  Li  Li18  1  0.92053600  0.92953600  0.94462200  1
  Li  Li19  1  0.98096500  0.98877900  0.96435900  1
  Li  Li20  1  0.28208300  0.30139500  0.30346200  1
  Li  Li21  1  0.66748300  0.65757400  0.65149800  1
  S  S22  1  0.01391000  0.99179600  0.99788500  1
  S  S23  1  0.37252200  0.36222400  0.36041900  1
  S  S24  1  0.72854300  0.73291300  0.72241300  1
  S  S25  1  0.46538700  0.45717700  0.44170800  1
  S  S26  1  0.10378700  0.08918200  0.08001900  1
  S  S27  1  0.80764100  0.81927500  0.82777500  1
  S  S28  1  0.53474900  0.55879700  0.54167100  1
  S  S29  1  0.91565500  0.91625300  0.89433000  1
  S  S30  1  0.16777100  0.18926600  0.18787300  1
  S  S31  1  0.27854900  0.26737100  0.27024200  1
  S  S32  1  0.62252200  0.64639200  0.64005100  1
