# generated using pymatgen
data_Al3Cu2
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   7.29139723
_cell_length_b   16.06368960
_cell_length_c   45.88556744
_cell_angle_alpha   90.00000000
_cell_angle_beta   90.00000000
_cell_angle_gamma   76.88226603
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Al3Cu2
_chemical_formula_sum   'Al90 Cu60'
_cell_volume   5234.18546857
_cell_formula_units_Z   30
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  0.037940  0.890787  0.274242  1
  Al  Al2  1  0.874290  0.218087  0.289394  1
  Al  Al3  1  0.710640  0.545386  0.304545  1
  Al  Al4  1  0.598832  0.102337  0.284036  1
  Al  Al5  1  0.435182  0.429636  0.299187  1
  Al  Al6  1  0.271532  0.756936  0.314339  1
  Al  Al7  1  0.313398  0.006537  0.279601  1
  Al  Al8  1  0.149748  0.333837  0.294752  1
  Al  Al9  1  0.986099  0.661136  0.309904  1
  Al  Al10  1  0.546990  0.872686  0.319697  1
  Al  Al11  1  0.383341  0.199985  0.334848  1
  Al  Al12  1  0.219691  0.527285  0.350000  1
  Al  Al13  1  0.107882  0.084235  0.329490  1
  Al  Al14  1  0.944233  0.411535  0.344642  1
  Al  Al15  1  0.780583  0.738834  0.359793  1
  Al  Al16  1  0.822449  0.988436  0.325055  1
  Al  Al17  1  0.658799  0.315735  0.340207  1
  Al  Al18  1  0.495149  0.643035  0.355358  1
  Al  Al19  1  0.056041  0.854584  0.365152  1
  Al  Al20  1  0.892391  0.181884  0.380303  1
  Al  Al21  1  0.728742  0.509183  0.395455  1
  Al  Al22  1  0.616933  0.066134  0.374945  1
  Al  Al23  1  0.453283  0.393433  0.390096  1
  Al  Al24  1  0.289634  0.720733  0.405248  1
  Al  Al25  1  0.331500  0.970334  0.370510  1
  Al  Al26  1  0.167850  0.297634  0.385661  1
  Al  Al27  1  0.004200  0.624933  0.400813  1
  Al  Al28  1  0.565092  0.836483  0.410606  1
  Al  Al29  1  0.401442  0.163782  0.425758  1
  Al  Al30  1  0.237793  0.491082  0.440909  1
  Al  Al31  1  0.125984  0.048032  0.420399  1
  Al  Al32  1  0.962334  0.375332  0.435551  1
  Al  Al33  1  0.798684  0.702631  0.450702  1
  Al  Al34  1  0.840550  0.952233  0.415964  1
  Al  Al35  1  0.676901  0.279532  0.431116  1
  Al  Al36  1  0.513251  0.606832  0.446267  1
  Al  Al37  1  0.074143  0.818381  0.456061  1
  Al  Al38  1  0.910493  0.145681  0.471212  1
  Al  Al39  1  0.746843  0.472980  0.486364  1
  Al  Al40  1  0.635035  0.029931  0.465854  1
  Al  Al41  1  0.471385  0.357230  0.481005  1
  Al  Al42  1  0.307735  0.684530  0.496157  1
  Al  Al43  1  0.349601  0.934131  0.461419  1
  Al  Al44  1  0.185951  0.261431  0.476570  1
  Al  Al45  1  0.022302  0.588730  0.491722  1
  Al  Al46  1  0.583194  0.800280  0.501515  1
  Al  Al47  1  0.419544  0.127579  0.516667  1
  Al  Al48  1  0.255894  0.454879  0.531818  1
  Al  Al49  1  0.144085  0.011829  0.511308  1
  Al  Al50  1  0.980436  0.339129  0.526460  1
  Al  Al51  1  0.816786  0.666428  0.541611  1
  Al  Al52  1  0.858652  0.916029  0.506874  1
  Al  Al53  1  0.695002  0.243329  0.522025  1
  Al  Al54  1  0.531352  0.570628  0.537177  1
  Al  Al55  1  0.092244  0.782178  0.546970  1
  Al  Al56  1  0.928595  0.109477  0.562121  1
  Al  Al57  1  0.764945  0.436777  0.577273  1
  Al  Al58  1  0.653136  0.993728  0.556763  1
  Al  Al59  1  0.489486  0.321027  0.571914  1
  Al  Al60  1  0.325837  0.648326  0.587066  1
  Al  Al61  1  0.367703  0.897928  0.552328  1
  Al  Al62  1  0.204053  0.225227  0.567480  1
  Al  Al63  1  0.040403  0.552527  0.582631  1
  Al  Al64  1  0.601295  0.764076  0.592424  1
  Al  Al65  1  0.437645  0.091376  0.607576  1
  Al  Al66  1  0.273996  0.418675  0.622727  1
  Al  Al67  1  0.162187  0.975626  0.602217  1
  Al  Al68  1  0.998537  0.302925  0.617369  1
  Al  Al69  1  0.834888  0.630225  0.632520  1
  Al  Al70  1  0.876753  0.879826  0.597783  1
  Al  Al71  1  0.713104  0.207126  0.612934  1
  Al  Al72  1  0.549454  0.534425  0.628086  1
  Al  Al73  1  0.110346  0.745975  0.637879  1
  Al  Al74  1  0.946696  0.073274  0.653030  1
  Al  Al75  1  0.783046  0.400574  0.668182  1
  Al  Al76  1  0.671238  0.957524  0.647672  1
  Al  Al77  1  0.507588  0.284824  0.662823  1
  Al  Al78  1  0.343938  0.612123  0.677975  1
  Al  Al79  1  0.385804  0.861725  0.643237  1
  Al  Al80  1  0.222155  0.189024  0.658389  1
  Al  Al81  1  0.058505  0.516324  0.673540  1
  Al  Al82  1  0.619397  0.727873  0.683333  1
  Al  Al83  1  0.455747  0.055173  0.698485  1
  Al  Al84  1  0.292097  0.382472  0.713636  1
  Al  Al85  1  0.180289  0.939423  0.693126  1
  Al  Al86  1  0.016639  0.266722  0.708278  1
  Al  Al87  1  0.852989  0.594022  0.723430  1
  Al  Al88  1  0.894855  0.843623  0.688692  1
  Al  Al89  1  0.731205  0.170923  0.703843  1
  Al  Al90  1  0.567556  0.498222  0.718995  1
  Cu  Cu91  1  0.680219  0.939562  0.276500  1
  Cu  Cu92  1  0.516569  0.266861  0.291652  1
  Cu  Cu93  1  0.352920  0.594161  0.306803  1
  Cu  Cu94  1  0.232010  0.169312  0.287136  1
  Cu  Cu95  1  0.068361  0.496612  0.302288  1
  Cu  Cu96  1  0.904711  0.823911  0.317439  1
  Cu  Cu97  1  0.189270  0.921460  0.321955  1
  Cu  Cu98  1  0.025620  0.248760  0.337106  1
  Cu  Cu99  1  0.861970  0.576059  0.352258  1
  Cu  Cu100  1  0.741061  0.151211  0.332591  1
  Cu  Cu101  1  0.577412  0.478510  0.347742  1
  Cu  Cu102  1  0.413762  0.805810  0.362894  1
  Cu  Cu103  1  0.698321  0.903359  0.367409  1
  Cu  Cu104  1  0.534671  0.230658  0.382561  1
  Cu  Cu105  1  0.371021  0.557958  0.397712  1
  Cu  Cu106  1  0.250112  0.133109  0.378045  1
  Cu  Cu107  1  0.086462  0.460409  0.393197  1
  Cu  Cu108  1  0.922813  0.787708  0.408348  1
  Cu  Cu109  1  0.207371  0.885257  0.412864  1
  Cu  Cu110  1  0.043722  0.212557  0.428015  1
  Cu  Cu111  1  0.880072  0.539856  0.443167  1
  Cu  Cu112  1  0.759163  0.115008  0.423500  1
  Cu  Cu113  1  0.595513  0.442307  0.438651  1
  Cu  Cu114  1  0.431863  0.769607  0.453803  1
  Cu  Cu115  1  0.716422  0.867155  0.458318  1
  Cu  Cu116  1  0.552773  0.194455  0.473470  1
  Cu  Cu117  1  0.389123  0.521754  0.488622  1
  Cu  Cu118  1  0.268214  0.096906  0.468954  1
  Cu  Cu119  1  0.104564  0.424206  0.484106  1
  Cu  Cu120  1  0.940914  0.751505  0.499257  1
  Cu  Cu121  1  0.225473  0.849054  0.503773  1
  Cu  Cu122  1  0.061823  0.176353  0.518925  1
  Cu  Cu123  1  0.898174  0.503653  0.534076  1
  Cu  Cu124  1  0.777264  0.078805  0.514409  1
  Cu  Cu125  1  0.613615  0.406104  0.529560  1
  Cu  Cu126  1  0.449965  0.733404  0.544712  1
  Cu  Cu127  1  0.734524  0.830952  0.549228  1
  Cu  Cu128  1  0.570874  0.158252  0.564379  1
  Cu  Cu129  1  0.407224  0.485551  0.579531  1
  Cu  Cu130  1  0.286315  0.060703  0.559863  1
  Cu  Cu131  1  0.122665  0.388003  0.575015  1
  Cu  Cu132  1  0.959016  0.715302  0.590166  1
  Cu  Cu133  1  0.243575  0.812851  0.594682  1
  Cu  Cu134  1  0.079925  0.140150  0.609834  1
  Cu  Cu135  1  0.916275  0.467450  0.624985  1
  Cu  Cu136  1  0.795366  0.042602  0.605318  1
  Cu  Cu137  1  0.631716  0.369901  0.620469  1
  Cu  Cu138  1  0.468066  0.697200  0.635621  1
  Cu  Cu139  1  0.752625  0.794749  0.640137  1
  Cu  Cu140  1  0.588976  0.122049  0.655288  1
  Cu  Cu141  1  0.425326  0.449348  0.670440  1
  Cu  Cu142  1  0.304417  0.024500  0.650772  1
  Cu  Cu143  1  0.140767  0.351799  0.665924  1
  Cu  Cu144  1  0.977117  0.679099  0.681075  1
  Cu  Cu145  1  0.261676  0.776648  0.685591  1
  Cu  Cu146  1  0.098026  0.103947  0.700743  1
  Cu  Cu147  1  0.934377  0.431247  0.715894  1
  Cu  Cu148  1  0.813467  0.006398  0.696227  1
  Cu  Cu149  1  0.649818  0.333698  0.711378  1
  Cu  Cu150  1  0.486168  0.660997  0.726530  1
