# generated using pymatgen
data_Al2O3
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   7.68627162
_cell_length_b   7.68627162
_cell_length_c   7.68627162
_cell_angle_alpha   109.47122063
_cell_angle_beta   109.47122063
_cell_angle_gamma   109.47122063
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Al2O3
_chemical_formula_sum   'Al16 O24'
_cell_volume   349.56286690
_cell_formula_units_Z   8
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  0.50000000  0.00000000  -0.00000000  1.0
  Al  Al1  1  0.96216034  0.25000000  0.21216034  1.0
  Al  Al2  1  0.78783966  0.03783966  0.75000000  1.0
  Al  Al3  1  0.71216034  0.46216034  0.25000000  1.0
  Al  Al4  1  0.75000000  0.78783966  0.03783966  1.0
  Al  Al5  1  0.75000000  0.28783966  0.53783966  1.0
  Al  Al6  1  0.46216034  0.25000000  0.71216034  1.0
  Al  Al7  1  0.00000000  0.50000000  -0.00000000  1.0
  Al  Al8  1  0.50000000  0.50000000  0.50000000  1.0
  Al  Al9  1  0.00000000  0.00000000  0.50000000  1.0
  Al  Al10  1  0.53783966  0.75000000  0.28783966  1.0
  Al  Al11  1  0.25000000  0.71216034  0.46216034  1.0
  Al  Al12  1  0.25000000  0.21216034  0.96216034  1.0
  Al  Al13  1  0.28783966  0.53783966  0.75000000  1.0
  Al  Al14  1  0.21216034  0.96216034  0.25000000  1.0
  Al  Al15  1  0.03783966  0.75000000  0.78783966  1.0
  O  O16  1  0.77066706  0.04587283  0.49711850  1.0
  O  O17  1  0.72933294  0.22645143  0.27520577  1.0
  O  O18  1  0.27354857  0.00288150  0.04875433  1.0
  O  O19  1  0.95412717  0.50288150  0.22933294  1.0
  O  O20  1  0.45412717  0.22479323  0.45124567  1.0
  O  O21  1  0.77354857  0.72479423  0.27066706  1.0
  O  O22  1  0.04875433  0.27354857  0.00288150  1.0
  O  O23  1  0.45124567  0.45412717  0.22479323  1.0
  O  O24  1  0.72479423  0.27066706  0.77354857  1.0
  O  O25  1  0.77520577  0.54875433  0.54587283  1.0
  O  O26  1  0.00288150  0.04875433  0.27354857  1.0
  O  O27  1  0.49711850  0.77066706  0.04587283  1.0
  O  O28  1  0.99711850  0.95124567  0.72645143  1.0
  O  O29  1  0.22479323  0.45124567  0.45412717  1.0
  O  O30  1  0.27520577  0.72933294  0.22645143  1.0
  O  O31  1  0.50288150  0.22933294  0.95412717  1.0
  O  O32  1  0.54875433  0.54587283  0.77520577  1.0
  O  O33  1  0.95124567  0.72645143  0.99711850  1.0
  O  O34  1  0.54587283  0.77520577  0.54875433  1.0
  O  O35  1  0.22645143  0.27520577  0.72933294  1.0
  O  O36  1  0.04587283  0.49711850  0.77066706  1.0
  O  O37  1  0.72645143  0.99711850  0.95124567  1.0
  O  O38  1  0.22933294  0.95412717  0.50288150  1.0
  O  O39  1  0.27066706  0.77354857  0.72479423  1.0