# generated using pymatgen
data_Te2W2SeS
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   3.39690969
_cell_length_b   3.39690969
_cell_length_c   38.87313900
_cell_angle_alpha   90.00000000
_cell_angle_beta   90.00000000
_cell_angle_gamma   119.99999402
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Te2W2SeS
_chemical_formula_sum   'Te4 W4 Se2 S2'
_cell_volume   388.46175841
_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
  Te  Te0  1  0.00000000  0.00000000  0.70601100  1.0
  Te  Te1  1  0.33333300  0.66666700  0.42115900  1.0
  Te  Te2  1  0.33333300  0.66666700  0.51803200  1.0
  Te  Te3  1  0.00000000  0.00000000  0.60914600  1.0
  W  W4  1  0.00000000  0.00000000  0.09392900  1.0
  W  W5  1  0.00000000  0.00000000  0.46961000  1.0
  W  W6  1  0.33333300  0.66666700  0.28180600  1.0
  W  W7  1  0.33333300  0.66666700  0.65761400  1.0
  Se  Se8  1  0.33333300  0.66666700  0.05135500  1.0
  Se  Se9  1  0.33333300  0.66666700  0.13649600  1.0
  S  S10  1  0.00000000  0.00000000  0.32059700  1.0
  S  S11  1  0.00000000  0.00000000  0.24299200  1.0