# generated using pymatgen
data_Al2Cu
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   4.22638409
_cell_length_b   13.97756454
_cell_length_c   48.02980857
_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   'Al48 Cu24'
_cell_volume   2837.33963663
_cell_formula_units_Z   24
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  0.021825  0.869405  0.324560  1
  Al  Al2  1  0.023859  0.657970  0.338271  1
  Al  Al3  1  0.033777  0.232765  0.359356  1
  Al  Al4  1  0.531850  0.190454  0.322935  1
  Al  Al5  1  0.521635  0.767729  0.312900  1
  Al  Al6  1  0.495505  0.399690  0.306305  1
  Al  Al7  1  0.027027  0.046255  0.345676  1
  Al  Al8  1  0.024186  0.816997  0.381970  1
  Al  Al9  1  0.033910  0.408807  0.384814  1
  Al  Al10  1  0.534963  0.269323  0.402347  1
  Al  Al11  1  0.522687  0.909762  0.359584  1
  Al  Al12  1  0.529811  0.532803  0.361495  1
  Al  Al13  1  0.032323  0.106295  0.406959  1
  Al  Al14  1  0.031155  0.884878  0.435852  1
  Al  Al15  1  0.032170  0.486836  0.441699  1
  Al  Al16  1  0.535660  0.360100  0.455481  1
  Al  Al17  1  0.532468  0.982189  0.409355  1
  Al  Al18  1  0.032077  0.618319  0.396022  1
  Al  Al19  1  0.035489  0.267954  0.439249  1
  Al  Al20  1  0.038662  0.927244  0.489812  1
  Al  Al21  1  0.035186  0.665559  0.465966  1
  Al  Al22  1  0.527952  0.527362  0.476152  1
  Al  Al23  1  0.036007  0.105519  0.471175  1
  Al  Al24  1  0.536569  0.786469  0.470695  1
  Al  Al25  1  0.038224  0.366593  0.496496  1
  Al  Al26  1  0.037019  0.983920  0.545804  1
  Al  Al27  1  0.048689  0.758472  0.518194  1
  Al  Al28  1  0.045435  0.574620  0.542501  1
  Al  Al29  1  0.038602  0.172131  0.523654  1
  Al  Al30  1  0.540329  0.889160  0.520184  1
  Al  Al31  1  0.040912  0.377398  0.554674  1
  Al  Al32  1  0.036328  0.166152  0.581643  1
  Al  Al33  1  0.052353  0.756299  0.580736  1
  Al  Al34  1  0.542596  0.602421  0.579394  1
  Al  Al35  1  0.539870  0.269492  0.544531  1
  Al  Al36  1  0.533703  0.916526  0.577129  1
  Al  Al37  1  0.040395  0.519118  0.604575  1
  Al  Al38  1  0.033307  0.140422  0.638721  1
  Al  Al39  1  0.050638  0.764431  0.641199  1
  Al  Al40  1  0.536843  0.620342  0.637526  1
  Al  Al41  1  0.536078  0.258600  0.603972  1
  Al  Al42  1  0.032780  0.954999  0.608854  1
  Al  Al43  1  0.032813  0.520498  0.663050  1
  Al  Al44  1  0.036761  0.337606  0.634128  1
  Al  Al45  1  0.030431  0.943872  0.668941  1
  Al  Al46  1  0.553702  0.773976  0.675442  1
  Al  Al47  1  0.530720  0.415949  0.684081  1
  Al  Al48  1  0.532087  0.075056  0.668440  1
  Cu  Cu49  1  0.525111  0.000379  0.314009  1
  Cu  Cu50  1  0.522849  0.585248  0.311023  1
  Cu  Cu51  1  0.535978  0.346682  0.355362  1
  Cu  Cu52  1  0.529898  0.114567  0.371210  1
  Cu  Cu53  1  0.524667  0.715426  0.367068  1
  Cu  Cu54  1  0.533064  0.464589  0.410635  1
  Cu  Cu55  1  0.535047  0.144890  0.441978  1
  Cu  Cu56  1  0.526357  0.794176  0.414701  1
  Cu  Cu57  1  0.534594  0.628957  0.430590  1
  Cu  Cu58  1  0.538228  0.230297  0.490650  1
  Cu  Cu59  1  0.536707  0.975930  0.461709  1
  Cu  Cu60  1  0.549507  0.647805  0.512437  1
  Cu  Cu61  1  0.542770  0.457901  0.527026  1
  Cu  Cu62  1  0.537361  0.064128  0.506880  1
  Cu  Cu63  1  0.553227  0.751439  0.552383  1
  Cu  Cu64  1  0.541042  0.423117  0.580794  1
  Cu  Cu65  1  0.536993  0.090818  0.558125  1
  Cu  Cu66  1  0.553729  0.772047  0.609445  1
  Cu  Cu67  1  0.537192  0.439649  0.632038  1
  Cu  Cu68  1  0.533435  0.073122  0.611166  1
  Cu  Cu69  1  0.531314  0.914613  0.639033  1
  Cu  Cu70  1  0.529302  0.596215  0.690599  1
  Cu  Cu71  1  0.536163  0.256464  0.657785  1
  Cu  Cu72  1  0.528099  0.931400  0.700853  1
