# generated using pymatgen
data_Al2Cu
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   6.10127617
_cell_length_b   6.10127454
_cell_length_c   53.64766790
_cell_angle_alpha   90.00000000
_cell_angle_beta   90.00000000
_cell_angle_gamma   90.00000000
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Al2Cu
_chemical_formula_sum   'Al40 Cu20'
_cell_volume   1997.06453059
_cell_formula_units_Z   20
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  0.848936  0.654708  0.334184  1
  Al  Al2  1  0.847956  0.347957  0.290191  1
  Al  Al3  1  0.155687  0.655688  0.290191  1
  Al  Al4  1  0.154708  0.348936  0.334184  1
  Al  Al5  1  0.347956  0.155688  0.290191  1
  Al  Al6  1  0.348936  0.848936  0.334184  1
  Al  Al7  1  0.654708  0.154708  0.334184  1
  Al  Al8  1  0.655687  0.847957  0.290191  1
  Al  Al9  1  0.849236  0.654408  0.425356  1
  Al  Al10  1  0.849122  0.349122  0.379850  1
  Al  Al11  1  0.154522  0.654522  0.379850  1
  Al  Al12  1  0.154408  0.349236  0.425356  1
  Al  Al13  1  0.349122  0.154522  0.379850  1
  Al  Al14  1  0.349236  0.849236  0.425356  1
  Al  Al15  1  0.654408  0.154408  0.425356  1
  Al  Al16  1  0.654522  0.849122  0.379850  1
  Al  Al17  1  0.849255  0.654389  0.516276  1
  Al  Al18  1  0.849252  0.349252  0.470820  1
  Al  Al19  1  0.154392  0.654392  0.470820  1
  Al  Al20  1  0.154389  0.349255  0.516276  1
  Al  Al21  1  0.349252  0.154392  0.470820  1
  Al  Al22  1  0.349255  0.849255  0.516276  1
  Al  Al23  1  0.654389  0.154389  0.516276  1
  Al  Al24  1  0.654392  0.849252  0.470820  1
  Al  Al25  1  0.849234  0.654410  0.607200  1
  Al  Al26  1  0.849252  0.349252  0.561733  1
  Al  Al27  1  0.154392  0.654392  0.561733  1
  Al  Al28  1  0.154410  0.349235  0.607200  1
  Al  Al29  1  0.349252  0.154392  0.561733  1
  Al  Al30  1  0.349234  0.849235  0.607200  1
  Al  Al31  1  0.654410  0.154410  0.607200  1
  Al  Al32  1  0.654392  0.849252  0.561733  1
  Al  Al33  1  0.847399  0.656245  0.697495  1
  Al  Al34  1  0.849266  0.349267  0.652743  1
  Al  Al35  1  0.154378  0.654378  0.652743  1
  Al  Al36  1  0.156245  0.347399  0.697495  1
  Al  Al37  1  0.349266  0.154378  0.652743  1
  Al  Al38  1  0.347399  0.847399  0.697495  1
  Al  Al39  1  0.656245  0.156245  0.697495  1
  Al  Al40  1  0.654378  0.849267  0.652743  1
  Cu  Cu41  1  0.501822  0.501822  0.356701  1
  Cu  Cu42  1  0.501822  0.501822  0.310360  1
  Cu  Cu43  1  0.001822  1.001822  0.310360  1
  Cu  Cu44  1  0.001822  1.001822  0.356701  1
  Cu  Cu45  1  0.501822  0.501822  0.448068  1
  Cu  Cu46  1  0.501822  0.501822  0.402511  1
  Cu  Cu47  1  0.001822  1.001822  0.402511  1
  Cu  Cu48  1  0.001822  1.001822  0.448068  1
  Cu  Cu49  1  0.501822  0.501822  0.539007  1
  Cu  Cu50  1  0.501822  0.501822  0.493545  1
  Cu  Cu51  1  0.001822  1.001822  0.493545  1
  Cu  Cu52  1  0.001822  1.001822  0.539007  1
  Cu  Cu53  1  0.501822  0.501822  0.630009  1
  Cu  Cu54  1  0.501822  0.501822  0.584481  1
  Cu  Cu55  1  0.001822  1.001822  0.584481  1
  Cu  Cu56  1  0.001822  1.001822  0.630009  1
  Cu  Cu57  1  0.501822  0.501822  0.721688  1
  Cu  Cu58  1  0.501822  0.501822  0.675666  1
  Cu  Cu59  1  0.001822  1.001822  0.675666  1
  Cu  Cu60  1  0.001822  1.001822  0.721688  1
