# generated using pymatgen
data_Al2S3
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   7.73859583
_cell_length_b   7.34919072
_cell_length_c   20.94019171
_cell_angle_alpha   81.49163827
_cell_angle_beta   100.10349445
_cell_angle_gamma   129.24587715
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Al2S3
_chemical_formula_sum   'Al12 S18'
_cell_volume   906.92279541
_cell_formula_units_Z   6
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
  Al  Al0  1  0.43406900  0.33201800  0.80693200  1.0
  Al  Al1  1  0.36150800  0.03047300  0.25591500  1.0
  Al  Al2  1  0.68533900  0.65065700  0.64076800  1.0
  Al  Al3  1  0.02608300  0.71913900  0.89170600  1.0
  Al  Al4  1  0.51821500  0.83884400  0.57148600  1.0
  Al  Al5  1  0.47976900  0.79907400  0.81253600  1.0
  Al  Al6  1  0.39383700  0.51401200  0.48329300  1.0
  Al  Al7  1  0.67707300  0.01289500  0.37433100  1.0
  Al  Al8  1  0.23865100  0.39265700  0.87865600  1.0
  Al  Al9  1  0.08826200  0.44318400  0.98119200  1.0
  Al  Al10  1  0.31316500  0.99786600  0.67483200  1.0
  Al  Al11  1  0.52180200  0.63066300  0.32113600  1.0
  S  S12  1  0.99656900  0.37027000  0.34758600  1.0
  S  S13  1  0.37822800  0.00476200  0.36217700  1.0
  S  S14  1  0.74933300  0.71179400  0.83516400  1.0
  S  S15  1  0.06588500  0.70616100  0.00156900  1.0
  S  S16  1  0.58289200  0.96823900  0.71616000  1.0
  S  S17  1  0.23371700  0.31547300  0.38553500  1.0
  S  S18  1  0.31914200  0.36836900  0.98822800  1.0
  S  S19  1  0.17137000  0.51395100  0.53482000  1.0
  S  S20  1  0.97660600  0.68041600  0.69439900  1.0
  S  S21  1  0.37277000  0.99340700  0.85559900  1.0
  S  S22  1  0.71700400  0.90065300  0.48013500  1.0
  S  S23  1  0.60793100  0.41731300  0.54544100  1.0
  S  S24  1  0.07285400  0.78443400  0.18403300  1.0
  S  S25  1  0.58966400  0.45459700  0.25751800  1.0
  S  S26  1  0.37512100  0.33312900  0.69625600  1.0
  S  S27  1  0.91351300  0.34419800  0.87867800  1.0
  S  S28  1  0.37236800  0.05049300  0.56287000  1.0
  S  S29  1  0.76726300  0.72086100  0.18516600  1.0