# generated using pymatgen
data_Ta5Al3S20
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   9.64543687
_cell_length_b   9.64543680
_cell_length_c   10.38374413
_cell_angle_alpha   64.38489968
_cell_angle_beta   64.38489784
_cell_angle_gamma   41.45236208
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Ta5Al3S20
_chemical_formula_sum   'Ta5 Al3 S20'
_cell_volume   567.09767197
_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
  Ta  Ta0  1  0.33381023  0.83284453  0.86678372  1.0
  Ta  Ta1  1  0.83284453  0.33381023  0.86678372  1.0
  Ta  Ta2  1  0.16445806  0.16445806  0.13439389  1.0
  Ta  Ta3  1  0.66538595  0.66538595  0.13561292  1.0
  Ta  Ta4  1  0.79557260  0.79557260  0.58620376  1.0
  Al  Al5  1  0.28862556  0.28862556  0.60363781  1.0
  Al  Al6  1  0.70369231  0.22909321  0.39727469  1.0
  Al  Al7  1  0.22909321  0.70369231  0.39727469  1.0
  S  S8  1  0.96735276  0.96735276  0.98439405  1.0
  S  S9  1  0.46699159  0.46699159  0.98674467  1.0
  S  S10  1  0.53087170  0.03204170  0.01684081  1.0
  S  S11  1  0.03204170  0.53087170  0.01684081  1.0
  S  S12  1  0.11825016  0.61778543  0.65041065  1.0
  S  S13  1  0.61778543  0.11825016  0.65041065  1.0
  S  S14  1  0.38453530  0.38453530  0.35669880  1.0
  S  S15  1  0.88016342  0.88016342  0.34340868  1.0
  S  S16  1  0.02138021  0.02138021  0.76295507  1.0
  S  S17  1  0.52084759  0.52084759  0.76466047  1.0
  S  S18  1  0.47478296  0.97725476  0.23882440  1.0
  S  S19  1  0.97725476  0.47478296  0.23882440  1.0
  S  S20  1  0.31507877  0.81456775  0.13040104  1.0
  S  S21  1  0.81456775  0.31507877  0.13040104  1.0
  S  S22  1  0.18464422  0.18464422  0.86708563  1.0
  S  S23  1  0.68392540  0.68392540  0.87011088  1.0
  S  S24  1  0.44332910  0.94636710  0.59821649  1.0
  S  S25  1  0.94636710  0.44332910  0.59821649  1.0
  S  S26  1  0.04946723  0.04946723  0.40080066  1.0
  S  S27  1  0.55687840  0.55687840  0.40579011  1.0