# generated using pymatgen
data_Al2Cu
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   5.84008011
_cell_length_b   8.42884136
_cell_length_c   46.50050401
_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   2288.99236812
_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  0.256638  0.873979  0.295738  1
  Al  Al2  1  0.250380  0.623979  0.335268  1
  Al  Al3  1  0.768085  0.123979  0.335268  1
  Al  Al4  1  0.761827  0.373979  0.295738  1
  Al  Al5  1  0.768085  0.623979  0.335268  1
  Al  Al6  1  0.761827  0.873979  0.295738  1
  Al  Al7  1  0.256638  0.373979  0.295738  1
  Al  Al8  1  0.250380  0.123979  0.335268  1
  Al  Al9  1  0.255713  0.373979  0.384792  1
  Al  Al10  1  0.255781  0.123979  0.428501  1
  Al  Al11  1  0.762684  0.623979  0.428501  1
  Al  Al12  1  0.762752  0.873979  0.384792  1
  Al  Al13  1  0.762684  0.123979  0.428501  1
  Al  Al14  1  0.762752  0.373979  0.384792  1
  Al  Al15  1  0.255713  0.873979  0.384792  1
  Al  Al16  1  0.255781  0.623979  0.428501  1
  Al  Al17  1  0.259441  0.873979  0.474968  1
  Al  Al18  1  0.259024  0.623979  0.519944  1
  Al  Al19  1  0.759441  0.123979  0.519944  1
  Al  Al20  1  0.759024  0.373979  0.474968  1
  Al  Al21  1  0.759441  0.623979  0.519944  1
  Al  Al22  1  0.759024  0.873979  0.474968  1
  Al  Al23  1  0.259441  0.373979  0.474968  1
  Al  Al24  1  0.259024  0.123979  0.519944  1
  Al  Al25  1  0.262684  0.373979  0.566411  1
  Al  Al26  1  0.262752  0.123979  0.610120  1
  Al  Al27  1  0.755713  0.623979  0.610120  1
  Al  Al28  1  0.755781  0.873979  0.566411  1
  Al  Al29  1  0.755713  0.123979  0.610120  1
  Al  Al30  1  0.755781  0.373979  0.566411  1
  Al  Al31  1  0.262684  0.873979  0.566411  1
  Al  Al32  1  0.262752  0.623979  0.610120  1
  Al  Al33  1  0.268085  0.873979  0.659645  1
  Al  Al34  1  0.261827  0.623979  0.699175  1
  Al  Al35  1  0.756638  0.123979  0.699175  1
  Al  Al36  1  0.750380  0.373979  0.659645  1
  Al  Al37  1  0.756638  0.623979  0.699175  1
  Al  Al38  1  0.750380  0.873979  0.659645  1
  Al  Al39  1  0.268085  0.373979  0.659645  1
  Al  Al40  1  0.261827  0.123979  0.699175  1
  Cu  Cu41  1  0.509232  0.873979  0.340555  1
  Cu  Cu42  1  1.009232  0.623979  0.286596  1
  Cu  Cu43  1  1.009232  0.123979  0.286596  1
  Cu  Cu44  1  0.509232  0.373979  0.340555  1
  Cu  Cu45  1  0.509232  0.373979  0.429791  1
  Cu  Cu46  1  1.009232  0.123979  0.381854  1
  Cu  Cu47  1  1.009232  0.623979  0.381854  1
  Cu  Cu48  1  0.509232  0.873979  0.429791  1
  Cu  Cu49  1  0.509232  0.873979  0.520567  1
  Cu  Cu50  1  1.009232  0.623979  0.474346  1
  Cu  Cu51  1  1.009232  0.123979  0.474346  1
  Cu  Cu52  1  0.509232  0.373979  0.520567  1
  Cu  Cu53  1  0.509232  0.373979  0.613058  1
  Cu  Cu54  1  1.009232  0.123979  0.565121  1
  Cu  Cu55  1  1.009232  0.623979  0.565121  1
  Cu  Cu56  1  0.509232  0.873979  0.613058  1
  Cu  Cu57  1  0.509232  0.873979  0.708317  1
  Cu  Cu58  1  1.009232  0.623979  0.654357  1
  Cu  Cu59  1  1.009232  0.123979  0.654357  1
  Cu  Cu60  1  0.509232  0.373979  0.708317  1
