# generated using pymatgen
data_LiHS
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   6.09541482
_cell_length_b   3.92023637
_cell_length_c   3.92023637
_cell_angle_alpha   91.16299734
_cell_angle_beta   90.00000000
_cell_angle_gamma   90.00000000
_symmetry_Int_Tables_number   1
_chemical_formula_structural   LiHS
_chemical_formula_sum   'Li2 H2 S2'
_cell_volume   93.65658119
_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  0.00000000  0.50312984  0.50312984  1
  Li  Li1  1  0.50000000  0.50312984  0.50312984  1
  H  H2  1  0.75000000  0.98561304  0.12999181  1
  H  H3  1  0.25000000  0.12999181  0.98561304  1
  S  S4  1  0.25000000  0.47238614  -0.00025066  1
  S  S5  1  0.75000000  -0.00025066  0.47238614  1
