# generated using pymatgen
data_LiCuS
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   7.57352667
_cell_length_b   7.57352667
_cell_length_c   7.57352667
_cell_angle_alpha   95.67815663
_cell_angle_beta   95.67815663
_cell_angle_gamma   143.33295239
_symmetry_Int_Tables_number   1
_chemical_formula_structural   LiCuS
_chemical_formula_sum   'Li4 Cu4 S4'
_cell_volume   246.24351585
_cell_formula_units_Z   4
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  0.15591200  0.50000000  0.65591200  1
  Li  Li1  1  0.50000000  0.15591200  0.65591200  1
  Li  Li2  1  0.50000000  0.84408800  0.34408800  1
  Li  Li3  1  0.84408800  0.50000000  0.34408800  1
  Cu  Cu4  1  0.85483400  0.14516600  0.00000000  1
  Cu  Cu5  1  0.85483400  0.85483400  0.70966800  1
  Cu  Cu6  1  0.14516600  0.14516600  0.29033200  1
  Cu  Cu7  1  0.14516600  0.85483400  0.00000000  1
  S  S8  1  0.70205400  0.00000000  0.70205400  1
  S  S9  1  0.00000000  0.70205400  0.70205400  1
  S  S10  1  0.00000000  0.29794600  0.29794600  1
  S  S11  1  0.29794600  0.00000000  0.29794600  1
