# generated using pymatgen
data_LiCoS2
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   4.50180700
_cell_length_b   3.41253200
_cell_length_c   7.80428225
_cell_angle_alpha   89.53751201
_cell_angle_beta   90.00000000
_cell_angle_gamma   90.00000000
_symmetry_Int_Tables_number   1
_chemical_formula_structural   LiCoS2
_chemical_formula_sum   'Li2 Co2 S4'
_cell_volume   119.88985187
_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  0.25000000  0.01575500  0.12406300  1
  Li  Li1  1  0.75000000  0.98424500  0.87593700  1
  Co  Co2  1  0.75000000  0.75725900  0.37012300  1
  Co  Co3  1  0.25000000  0.24274100  0.62987700  1
  S  S4  1  0.75000000  0.25994300  0.17413400  1
  S  S5  1  0.25000000  0.75091200  0.44397200  1
  S  S6  1  0.75000000  0.24908800  0.55602800  1
  S  S7  1  0.25000000  0.74005700  0.82586600  1
