# generated using pymatgen
data_WS2
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   6.74526743
_cell_length_b   6.74526764
_cell_length_c   6.74526793
_cell_angle_alpha   27.31076796
_cell_angle_beta   27.31076339
_cell_angle_gamma   27.31077248
_symmetry_Int_Tables_number   1
_chemical_formula_structural   WS2
_chemical_formula_sum   'W1 S2'
_cell_volume   57.00912584
_cell_formula_units_Z   1
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
  W  W0  1  0.00066787  0.00066787  0.00066787  1.0
  S  S1  1  0.41411232  0.41411232  0.41411232  1.0
  S  S2  1  0.25391981  0.25391981  0.25391981  1.0