# generated using pymatgen
data_Al2Cu
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   13.62318936
_cell_length_b   7.80563335
_cell_length_c   47.41840425
_cell_angle_alpha   90.00000000
_cell_angle_beta   90.00000000
_cell_angle_gamma   69.54234490
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Al2Cu
_chemical_formula_sum   'Al96 Cu48'
_cell_volume   4724.34245694
_cell_formula_units_Z   48
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  0.483338  0.975344  0.290850  1
  Al  Al2  1  0.957646  0.712036  0.323244  1
  Al  Al3  1  0.315206  0.289049  0.312554  1
  Al  Al4  1  0.860263  0.581652  0.280375  1
  Al  Al5  1  0.428404  0.037235  0.348239  1
  Al  Al6  1  0.975747  0.309424  0.312259  1
  Al  Al7  1  0.304561  0.918807  0.297536  1
  Al  Al8  1  0.790324  0.612843  0.335276  1
  Al  Al9  1  0.179307  0.071954  0.342694  1
  Al  Al10  1  0.720977  0.350959  0.306511  1
  Al  Al11  1  0.543409  0.636073  0.329282  1
  Al  Al12  1  0.093286  0.937856  0.296546  1
  Al  Al13  1  0.204356  0.670938  0.331573  1
  Al  Al14  1  0.741605  0.951521  0.290830  1
  Al  Al15  1  0.553679  0.250734  0.315571  1
  Al  Al16  1  0.135389  0.573515  0.283115  1
  Al  Al17  1  0.413891  0.426976  0.358396  1
  Al  Al18  1  0.864779  0.140720  0.401045  1
  Al  Al19  1  0.230322  0.726127  0.388951  1
  Al  Al20  1  0.774818  1.000127  0.348522  1
  Al  Al21  1  0.336213  0.474470  0.425120  1
  Al  Al22  1  0.880245  0.756483  0.386138  1
  Al  Al23  1  0.249132  0.342425  0.374570  1
  Al  Al24  1  0.697292  0.057801  0.412664  1
  Al  Al25  1  0.094274  0.501954  0.420597  1
  Al  Al26  1  0.636682  0.779957  0.381691  1
  Al  Al27  1  0.456626  0.082627  0.407780  1
  Al  Al28  1  0.999962  0.363370  0.370515  1
  Al  Al29  1  0.110836  0.112277  0.405956  1
  Al  Al30  1  0.653460  0.395525  0.366519  1
  Al  Al31  1  0.468842  0.698825  0.392900  1
  Al  Al32  1  0.014708  0.974642  0.354374  1
  Al  Al33  1  0.320402  0.863763  0.438891  1
  Al  Al34  1  0.777257  0.584462  0.477952  1
  Al  Al35  1  0.138777  0.166035  0.465997  1
  Al  Al36  1  0.681069  0.444055  0.426645  1
  Al  Al37  1  0.248800  0.917508  0.502083  1
  Al  Al38  1  0.792791  0.197134  0.462981  1
  Al  Al39  1  0.155267  0.776427  0.451666  1
  Al  Al40  1  0.609994  0.501583  0.489148  1
  Al  Al41  1  0.005299  0.944381  0.497407  1
  Al  Al42  1  0.549283  0.224704  0.457547  1
  Al  Al43  1  0.367174  0.527464  0.485192  1
  Al  Al44  1  0.911033  0.804781  0.446444  1
  Al  Al45  1  0.021368  0.557201  0.482809  1
  Al  Al46  1  0.565647  0.833685  0.444023  1
  Al  Al47  1  0.384365  0.138922  0.470782  1
  Al  Al48  1  0.927480  0.416274  0.431976  1
  Al  Al49  1  0.233565  0.305687  0.517179  1
  Al  Al50  1  0.687506  0.030678  0.554526  1
  Al  Al51  1  0.050425  0.609295  0.543426  1
  Al  Al52  1  0.593854  0.888635  0.504320  1
  Al  Al53  1  0.161058  0.364154  0.580066  1
  Al  Al54  1  0.704706  0.640098  0.540357  1
  Al  Al55  1  0.066764  0.221552  0.528326  1
  Al  Al56  1  0.522759  0.942914  0.567206  1
  Al  Al57  1  0.917704  0.392418  0.574685  1
  Al  Al58  1  0.457903  0.667954  0.535719  1
  Al  Al59  1  0.277654  0.971413  0.562548  1
  Al  Al60  1  0.820749  0.250451  0.523405  1
  Al  Al61  1  0.932276  0.002049  0.559507  1
  Al  Al62  1  0.475312  0.277790  0.521347  1
  Al  Al63  1  0.293456  0.580347  0.548863  1
  Al  Al64  1  0.837825  0.861969  0.509020  1
  Al  Al65  1  0.145693  0.750145  0.593995  1
  Al  Al66  1  0.592019  0.472031  0.632138  1
  Al  Al67  1  0.961506  0.052706  0.618936  1
  Al  Al68  1  0.505703  0.334069  0.581303  1
  Al  Al69  1  0.071785  0.805167  0.656980  1
  Al  Al70  1  0.611596  0.082354  0.617394  1
  Al  Al71  1  0.977455  0.668579  0.605850  1
  Al  Al72  1  0.431427  0.377462  0.647249  1
  Al  Al73  1  0.821042  0.839054  0.651811  1
  Al  Al74  1  0.373079  0.108998  0.614120  1
  Al  Al75  1  0.187645  0.415377  0.640975  1
  Al  Al76  1  0.733041  0.692490  0.600750  1
  Al  Al77  1  0.844373  0.444845  0.636789  1
  Al  Al78  1  0.387556  0.721700  0.598481  1
  Al  Al79  1  0.205601  0.026769  0.624481  1
  Al  Al80  1  0.750935  0.305727  0.584431  1
  Al  Al81  1  0.062097  0.204500  0.671406  1
  Al  Al82  1  0.531152  0.877512  0.708264  1
  Al  Al83  1  0.877929  0.483429  0.697588  1
  Al  Al84  1  0.416311  0.774278  0.658488  1
  Al  Al85  1  0.978106  0.155649  0.723886  1
  Al  Al86  1  0.527003  0.513459  0.693345  1
  Al  Al87  1  0.896841  0.097888  0.675500  1
  Al  Al88  1  0.354648  0.810263  0.716163  1
  Al  Al89  1  0.768242  0.188119  0.720316  1
  Al  Al90  1  0.294114  0.543826  0.690095  1
  Al  Al91  1  0.122752  0.814263  0.715592  1
  Al  Al92  1  0.642246  0.138935  0.676299  1
  Al  Al93  1  0.744806  0.852891  0.709052  1
  Al  Al94  1  0.300896  0.167529  0.677508  1
  Al  Al95  1  0.117952  0.465300  0.700520  1
  Al  Al96  1  0.660524  0.731534  0.663524  1
  Cu  Cu97  1  0.435176  0.301120  0.271103  1
  Cu  Cu98  1  0.892056  0.058391  0.306869  1
  Cu  Cu99  1  0.387563  0.561456  0.304353  1
  Cu  Cu100  1  0.950949  0.817001  0.270449  1
  Cu  Cu101  1  0.123496  0.411014  0.329789  1
  Cu  Cu102  1  0.658641  0.686429  0.287377  1
  Cu  Cu103  1  0.156556  0.223405  0.285748  1
  Cu  Cu104  1  0.623420  0.894504  0.329616  1
  Cu  Cu105  1  0.353810  0.774453  0.347068  1
  Cu  Cu106  1  0.805967  0.488642  0.387208  1
  Cu  Cu107  1  0.302177  0.992864  0.386687  1
  Cu  Cu108  1  0.848101  0.262668  0.349172  1
  Cu  Cu109  1  0.034766  0.849821  0.406636  1
  Cu  Cu110  1  0.582221  0.126490  0.367320  1
  Cu  Cu111  1  0.074906  0.626630  0.368928  1
  Cu  Cu112  1  0.526550  0.352081  0.405337  1
  Cu  Cu113  1  0.262743  0.209159  0.426095  1
  Cu  Cu114  1  0.717330  0.931518  0.464369  1
  Cu  Cu115  1  0.215209  0.428607  0.465267  1
  Cu  Cu116  1  0.758863  0.707936  0.426098  1
  Cu  Cu117  1  0.945184  0.292199  0.483854  1
  Cu  Cu118  1  0.488261  0.571658  0.444653  1
  Cu  Cu119  1  0.986878  0.068930  0.445580  1
  Cu  Cu120  1  0.441481  0.792680  0.483710  1
  Cu  Cu121  1  0.174138  0.652059  0.503636  1
  Cu  Cu122  1  0.626280  0.378991  0.540889  1
  Cu  Cu123  1  0.126096  0.874555  0.542176  1
  Cu  Cu124  1  0.668343  0.154841  0.502671  1
  Cu  Cu125  1  0.856284  0.737909  0.560836  1
  Cu  Cu126  1  0.400852  0.013502  0.522694  1
  Cu  Cu127  1  0.898327  0.513597  0.522636  1
  Cu  Cu128  1  0.354258  0.233362  0.562031  1
  Cu  Cu129  1  0.084382  0.101141  0.580255  1
  Cu  Cu130  1  0.539798  0.818198  0.619234  1
  Cu  Cu131  1  0.036661  0.322187  0.619895  1
  Cu  Cu132  1  0.581286  0.597192  0.580281  1
  Cu  Cu133  1  0.761243  0.189756  0.635725  1
  Cu  Cu134  1  0.314759  0.454063  0.601129  1
  Cu  Cu135  1  0.807280  0.957885  0.599417  1
  Cu  Cu136  1  0.264800  0.678700  0.639027  1
  Cu  Cu137  1  0.988799  0.557830  0.658553  1
  Cu  Cu138  1  0.456290  0.243130  0.702321  1
  Cu  Cu139  1  0.944249  0.781752  0.700516  1
  Cu  Cu140  1  0.492825  0.035203  0.659533  1
  Cu  Cu141  1  0.686312  0.569429  0.720623  1
  Cu  Cu142  1  0.221351  0.910204  0.676382  1
  Cu  Cu143  1  0.724034  0.395255  0.676646  1
  Cu  Cu144  1  0.179590  0.117551  0.718647  1
