# generated using pymatgen
data_Al3Cu2
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   11.13779326
_cell_length_b   6.66511691
_cell_length_c   48.42021707
_cell_angle_alpha   90.00000000
_cell_angle_beta   90.00000000
_cell_angle_gamma   96.85523975
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Al3Cu2
_chemical_formula_sum   'Al63 Cu42'
_cell_volume   3568.76282382
_cell_formula_units_Z   21
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  0.175671  0.426066  0.268889  1
  Al  Al2  1  0.523523  0.295989  0.291111  1
  Al  Al3  1  0.871375  0.165912  0.313333  1
  Al  Al4  1  0.408457  0.685071  0.285058  1
  Al  Al5  1  0.756309  0.554993  0.307280  1
  Al  Al6  1  0.104161  0.424916  0.329503  1
  Al  Al7  1  0.290737  0.036984  0.274942  1
  Al  Al8  1  0.638589  0.906907  0.297164  1
  Al  Al9  1  0.986440  0.776830  0.319386  1
  Al  Al10  1  0.219226  0.035834  0.335556  1
  Al  Al11  1  0.567078  0.905757  0.357778  1
  Al  Al12  1  0.914930  0.775680  0.380000  1
  Al  Al13  1  0.452012  0.294839  0.351725  1
  Al  Al14  1  0.799864  0.164762  0.373947  1
  Al  Al15  1  0.147716  0.034685  0.396169  1
  Al  Al16  1  0.334292  0.646753  0.341608  1
  Al  Al17  1  0.682143  0.516675  0.363831  1
  Al  Al18  1  0.029995  0.386598  0.386053  1
  Al  Al19  1  0.262781  0.645603  0.402222  1
  Al  Al20  1  0.610633  0.515526  0.424444  1
  Al  Al21  1  0.958484  0.385449  0.446667  1
  Al  Al22  1  0.495567  0.904607  0.418392  1
  Al  Al23  1  0.843419  0.774530  0.440614  1
  Al  Al24  1  0.191270  0.644453  0.462836  1
  Al  Al25  1  0.377847  0.256521  0.408275  1
  Al  Al26  1  0.725698  0.126444  0.430497  1
  Al  Al27  1  0.073550  0.996367  0.452720  1
  Al  Al28  1  0.306336  0.255371  0.468889  1
  Al  Al29  1  0.654188  0.125294  0.491111  1
  Al  Al30  1  0.002039  0.995217  0.513333  1
  Al  Al31  1  0.539122  0.514376  0.485058  1
  Al  Al32  1  0.886974  0.384299  0.507280  1
  Al  Al33  1  0.234825  0.254222  0.529503  1
  Al  Al34  1  0.421402  0.866290  0.474942  1
  Al  Al35  1  0.769253  0.736212  0.497164  1
  Al  Al36  1  0.117105  0.606135  0.519386  1
  Al  Al37  1  0.349891  0.865140  0.535556  1
  Al  Al38  1  0.697743  0.735063  0.557778  1
  Al  Al39  1  0.045594  0.604985  0.580000  1
  Al  Al40  1  0.582677  0.124144  0.551725  1
  Al  Al41  1  0.930529  0.994067  0.573947  1
  Al  Al42  1  0.278380  0.863990  0.596169  1
  Al  Al43  1  0.464957  0.476058  0.541608  1
  Al  Al44  1  0.812808  0.345981  0.563831  1
  Al  Al45  1  0.160660  0.215904  0.586053  1
  Al  Al46  1  0.393446  0.474908  0.602222  1
  Al  Al47  1  0.741297  0.344831  0.624444  1
  Al  Al48  1  0.089149  0.214754  0.646667  1
  Al  Al49  1  0.626232  0.733913  0.618392  1
  Al  Al50  1  0.974083  0.603836  0.640614  1
  Al  Al51  1  0.321935  0.473758  0.662836  1
  Al  Al52  1  0.508511  0.085826  0.608275  1
  Al  Al53  1  0.856363  0.955749  0.630497  1
  Al  Al54  1  0.204215  0.825672  0.652720  1
  Al  Al55  1  0.437001  0.084677  0.668889  1
  Al  Al56  1  0.784852  0.954599  0.691111  1
  Al  Al57  1  0.132704  0.824522  0.713333  1
  Al  Al58  1  0.669787  0.343681  0.685058  1
  Al  Al59  1  0.017638  0.213604  0.707280  1
  Al  Al60  1  0.365490  0.083527  0.729503  1
  Al  Al61  1  0.552066  0.695595  0.674942  1
  Al  Al62  1  0.899918  0.565518  0.697164  1
  Al  Al63  1  0.247770  0.435440  0.719386  1
  Cu  Cu64  1  0.430118  0.988325  0.318213  1
  Cu  Cu65  1  0.734415  0.248480  0.273769  1
  Cu  Cu66  1  0.082267  0.118403  0.295991  1
  Cu  Cu67  1  0.312631  0.343498  0.308453  1
  Cu  Cu68  1  0.660482  0.213421  0.330675  1
  Cu  Cu69  1  0.964779  0.473575  0.286231  1
  Cu  Cu70  1  0.473673  0.598094  0.384880  1
  Cu  Cu71  1  0.777970  0.858248  0.340436  1
  Cu  Cu72  1  0.125822  0.728171  0.362658  1
  Cu  Cu73  1  0.356186  0.953266  0.375120  1
  Cu  Cu74  1  0.704037  0.823189  0.397342  1
  Cu  Cu75  1  0.008334  0.083343  0.352898  1
  Cu  Cu76  1  0.517228  0.207862  0.451547  1
  Cu  Cu77  1  0.821525  0.468017  0.407102  1
  Cu  Cu78  1  0.169377  0.337939  0.429325  1
  Cu  Cu79  1  0.399741  0.563035  0.441787  1
  Cu  Cu80  1  0.747592  0.432958  0.464009  1
  Cu  Cu81  1  0.051889  0.693112  0.419564  1
  Cu  Cu82  1  0.560783  0.817631  0.518213  1
  Cu  Cu83  1  0.865080  0.077785  0.473769  1
  Cu  Cu84  1  0.212932  0.947708  0.495991  1
  Cu  Cu85  1  0.443295  0.172803  0.508453  1
  Cu  Cu86  1  0.791147  0.042726  0.530675  1
  Cu  Cu87  1  0.095444  0.302880  0.486231  1
  Cu  Cu88  1  0.604338  0.427399  0.584880  1
  Cu  Cu89  1  0.908635  0.687554  0.540436  1
  Cu  Cu90  1  0.256486  0.557476  0.562658  1
  Cu  Cu91  1  0.486850  0.782572  0.575120  1
  Cu  Cu92  1  0.834702  0.652494  0.597342  1
  Cu  Cu93  1  0.138999  0.912649  0.552898  1
  Cu  Cu94  1  0.647893  0.037168  0.651547  1
  Cu  Cu95  1  0.952190  0.297322  0.607102  1
  Cu  Cu96  1  0.300041  0.167245  0.629325  1
  Cu  Cu97  1  0.530405  0.392340  0.641787  1
  Cu  Cu98  1  0.878257  0.262263  0.664009  1
  Cu  Cu99  1  0.182554  0.522417  0.619564  1
  Cu  Cu100  1  0.691448  0.646936  0.718213  1
  Cu  Cu101  1  0.995745  0.907090  0.673769  1
  Cu  Cu102  1  0.343596  0.777013  0.695991  1
  Cu  Cu103  1  0.573960  0.002108  0.708453  1
  Cu  Cu104  1  0.921812  0.872031  0.730675  1
  Cu  Cu105  1  0.226108  0.132186  0.686231  1
