# generated using pymatgen
data_Al
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   4.72887783
_cell_length_b   4.41475324
_cell_length_c   47.61849566
_cell_angle_alpha   90.00000000
_cell_angle_beta   90.00000000
_cell_angle_gamma   120.00000000
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Al
_chemical_formula_sum   Al22
_cell_volume   860.935926492
_cell_formula_units_Z   22
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  Al1  1  0.274437  0.248069  0.311653  1
  Al  Al2  1  0.639839  0.939182  0.296687  1
  Al  Al3  1  0.509077  0.854381  0.352213  1
  Al  Al4  1  0.903153  0.560220  0.329763  1
  Al  Al5  1  0.753796  0.464453  0.388957  1
  Al  Al6  1  0.131407  0.159992  0.369962  1
  Al  Al7  1  0.993018  0.061973  0.429314  1
  Al  Al8  1  0.370806  0.761477  0.409991  1
  Al  Al9  1  0.237267  0.661161  0.468872  1
  Al  Al10  1  0.616400  0.363397  0.448636  1
  Al  Al11  1  0.482535  0.260221  0.508087  1
  Al  Al12  1  0.859183  0.959869  0.488689  1
  Al  Al13  1  0.725318  0.856693  0.548141  1
  Al  Al14  1  0.104451  0.558928  0.527905  1
  Al  Al15  1  0.970912  0.458612  0.586786  1
  Al  Al16  1  0.348700  0.158116  0.567463  1
  Al  Al17  1  0.210311  0.060098  0.626815  1
  Al  Al18  1  0.587921  0.755637  0.607820  1
  Al  Al19  1  0.438565  0.659869  0.667014  1
  Al  Al20  1  0.832641  0.365709  0.644564  1
  Al  Al21  1  0.701879  0.280908  0.700090  1
  Al  Al22  1  0.067281  0.972020  0.685123  1
