# generated using pymatgen
data_LiCoS2
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   6.86143752
_cell_length_b   6.86143752
_cell_length_c   6.86143752
_cell_angle_alpha   60.00000000
_cell_angle_beta   60.00000000
_cell_angle_gamma   60.00000000
_symmetry_Int_Tables_number   1
_chemical_formula_structural   LiCoS2
_chemical_formula_sum   'Li4 Co4 S8'
_cell_volume   228.41800889
_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  0.12500000  0.12500000  0.12500000  1
  Li  Li1  1  0.62500000  0.12500000  0.12500000  1
  Li  Li2  1  0.12500000  0.62500000  0.12500000  1
  Li  Li3  1  0.12500000  0.12500000  0.62500000  1
  Co  Co4  1  0.62500000  0.62500000  0.12500000  1
  Co  Co5  1  0.62500000  0.62500000  0.62500000  1
  Co  Co6  1  0.62500000  0.12500000  0.62500000  1
  Co  Co7  1  0.12500000  0.62500000  0.62500000  1
  S  S8  1  0.85994500  0.42016400  0.85994500  1
  S  S9  1  0.85994500  0.85994500  0.42016400  1
  S  S10  1  0.85994500  0.85994500  0.85994500  1
  S  S11  1  0.42016400  0.85994500  0.85994500  1
  S  S12  1  0.39005500  0.39005500  0.39005500  1
  S  S13  1  0.82983600  0.39005500  0.39005500  1
  S  S14  1  0.39005500  0.82983600  0.39005500  1
  S  S15  1  0.39005500  0.39005500  0.82983600  1
