# generated using pymatgen
data_Li2CuS2
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   5.59665685
_cell_length_b   7.94202814
_cell_length_c   5.80595840
_cell_angle_alpha   90.00807734
_cell_angle_beta   90.16324441
_cell_angle_gamma   44.85223235
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Li2CuS2
_chemical_formula_sum   'Li4 Cu2 S4'
_cell_volume   182.00895935
_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  0.00688700  0.49672200  0.76238100  1
  Li  Li1  1  0.00677500  0.99644300  0.76237900  1
  Li  Li2  1  0.01071800  0.49868800  0.26165100  1
  Li  Li3  1  0.01075500  0.99042100  0.26160500  1
  Cu  Cu4  1  0.49881000  0.00057400  0.26264500  1
  Cu  Cu5  1  0.49977100  0.00007200  0.76548800  1
  S  S6  1  0.04561100  0.22719000  0.51086800  1
  S  S7  1  0.50900900  0.76737200  0.01251800  1
  S  S8  1  0.50877100  0.22368800  0.01261600  1
  S  S9  1  0.95670500  0.77162900  0.51380100  1
