# generated using pymatgen
data_Al3Cu2
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   18.34961398
_cell_length_b   13.33023389
_cell_length_c   47.39957196
_cell_angle_alpha   90.00000000
_cell_angle_beta   90.00000000
_cell_angle_gamma   59.52604079
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Al3Cu2
_chemical_formula_sum   'Al162 Cu108'
_cell_volume   9992.53593883
_cell_formula_units_Z   54
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  0.717623  0.892643  0.303175  1
  Al  Al2  1  0.100644  0.924442  0.287302  1
  Al  Al3  1  0.334601  0.860845  0.319048  1
  Al  Al4  1  0.717623  0.392643  0.303175  1
  Al  Al5  1  0.100644  0.424442  0.287302  1
  Al  Al6  1  0.334601  0.360845  0.319048  1
  Al  Al7  1  0.876623  0.175357  0.323371  1
  Al  Al8  1  0.259644  0.207156  0.307498  1
  Al  Al9  1  0.642666  0.238955  0.291625  1
  Al  Al10  1  0.876623  0.675357  0.323371  1
  Al  Al11  1  0.259644  0.707156  0.307498  1
  Al  Al12  1  0.642666  0.738955  0.291625  1
  Al  Al13  1  0.792580  0.046332  0.314724  1
  Al  Al14  1  0.175601  0.078130  0.298851  1
  Al  Al15  1  0.409558  0.014533  0.330597  1
  Al  Al16  1  0.792580  0.546332  0.314724  1
  Al  Al17  1  0.175601  0.578130  0.298851  1
  Al  Al18  1  0.409558  0.514533  0.330597  1
  Al  Al19  1  0.568558  0.797247  0.350794  1
  Al  Al20  1  0.951580  0.829046  0.334921  1
  Al  Al21  1  0.185537  0.765448  0.366667  1
  Al  Al22  1  0.568558  0.297247  0.350794  1
  Al  Al23  1  0.951580  0.329046  0.334921  1
  Al  Al24  1  0.185537  0.265448  0.366667  1
  Al  Al25  1  0.727558  0.079961  0.370990  1
  Al  Al26  1  0.110580  0.111760  0.355117  1
  Al  Al27  1  0.493601  0.143559  0.339244  1
  Al  Al28  1  0.727558  0.579961  0.370990  1
  Al  Al29  1  0.110580  0.611760  0.355117  1
  Al  Al30  1  0.493601  0.643559  0.339244  1
  Al  Al31  1  0.643515  0.950935  0.362343  1
  Al  Al32  1  0.026537  0.982734  0.346470  1
  Al  Al33  1  0.260494  0.919136  0.378216  1
  Al  Al34  1  0.643515  0.450935  0.362343  1
  Al  Al35  1  0.026537  0.482734  0.346470  1
  Al  Al36  1  0.260494  0.419136  0.378216  1
  Al  Al37  1  0.419494  0.701851  0.398413  1
  Al  Al38  1  0.802515  0.733649  0.382540  1
  Al  Al39  1  0.036472  0.670052  0.414286  1
  Al  Al40  1  0.419494  0.201851  0.398413  1
  Al  Al41  1  0.802515  0.233649  0.382540  1
  Al  Al42  1  0.036472  0.170052  0.414286  1
  Al  Al43  1  0.578494  0.984565  0.418609  1
  Al  Al44  1  0.961515  0.016364  0.402736  1
  Al  Al45  1  0.344537  0.048162  0.386863  1
  Al  Al46  1  0.578494  0.484565  0.418609  1
  Al  Al47  1  0.961515  0.516364  0.402736  1
  Al  Al48  1  0.344537  0.548162  0.386863  1
  Al  Al49  1  0.494451  0.855539  0.409962  1
  Al  Al50  1  0.877472  0.887338  0.394089  1
  Al  Al51  1  0.111429  0.823740  0.425835  1
  Al  Al52  1  0.494451  0.355539  0.409962  1
  Al  Al53  1  0.877472  0.387338  0.394089  1
  Al  Al54  1  0.111429  0.323740  0.425835  1
  Al  Al55  1  0.270429  0.606454  0.446032  1
  Al  Al56  1  0.653451  0.638253  0.430159  1
  Al  Al57  1  0.887408  0.574656  0.461905  1
  Al  Al58  1  0.270429  0.106454  0.446032  1
  Al  Al59  1  0.653451  0.138253  0.430159  1
  Al  Al60  1  0.887408  0.074656  0.461905  1
  Al  Al61  1  0.429429  0.889168  0.466228  1
  Al  Al62  1  0.812451  0.920967  0.450355  1
  Al  Al63  1  0.195472  0.952766  0.434482  1
  Al  Al64  1  0.429429  0.389168  0.466228  1
  Al  Al65  1  0.812451  0.420967  0.450355  1
  Al  Al66  1  0.195472  0.452766  0.434482  1
  Al  Al67  1  0.345386  0.760143  0.457581  1
  Al  Al68  1  0.728408  0.791941  0.441708  1
  Al  Al69  1  0.962365  0.728344  0.473454  1
  Al  Al70  1  0.345386  0.260143  0.457581  1
  Al  Al71  1  0.728408  0.291941  0.441708  1
  Al  Al72  1  0.962365  0.228344  0.473454  1
  Al  Al73  1  0.121365  0.511058  0.493651  1
  Al  Al74  1  0.504386  0.542857  0.477778  1
  Al  Al75  1  0.738343  0.479259  0.509524  1
  Al  Al76  1  0.121365  0.011058  0.493651  1
  Al  Al77  1  0.504386  0.042857  0.477778  1
  Al  Al78  1  0.738343  0.979259  0.509524  1
  Al  Al79  1  0.280365  0.793772  0.513847  1
  Al  Al80  1  0.663386  0.825571  0.497974  1
  Al  Al81  1  0.046408  0.857370  0.482101  1
  Al  Al82  1  0.280365  0.293772  0.513847  1
  Al  Al83  1  0.663386  0.325571  0.497974  1
  Al  Al84  1  0.046408  0.357370  0.482101  1
  Al  Al85  1  0.196322  0.664746  0.505200  1
  Al  Al86  1  0.579343  0.696545  0.489327  1
  Al  Al87  1  0.813300  0.632947  0.521073  1
  Al  Al88  1  0.196322  0.164746  0.505200  1
  Al  Al89  1  0.579343  0.196545  0.489327  1
  Al  Al90  1  0.813300  0.132947  0.521073  1
  Al  Al91  1  0.972300  0.415662  0.541270  1
  Al  Al92  1  0.355322  0.447460  0.525397  1
  Al  Al93  1  0.589279  0.383863  0.557143  1
  Al  Al94  1  0.972300  0.915662  0.541270  1
  Al  Al95  1  0.355322  0.947460  0.525397  1
  Al  Al96  1  0.589279  0.883863  0.557143  1
  Al  Al97  1  0.131300  0.698376  0.561466  1
  Al  Al98  1  0.514322  0.730175  0.545593  1
  Al  Al99  1  0.897343  0.761973  0.529720  1
  Al  Al100  1  0.131300  0.198376  0.561466  1
  Al  Al101  1  0.514322  0.230175  0.545593  1
  Al  Al102  1  0.897343  0.261973  0.529720  1
  Al  Al103  1  0.047257  0.569350  0.552819  1
  Al  Al104  1  0.430279  0.601149  0.536946  1
  Al  Al105  1  0.664236  0.537551  0.568692  1
  Al  Al106  1  0.047257  0.069350  0.552819  1
  Al  Al107  1  0.430279  0.101149  0.536946  1
  Al  Al108  1  0.664236  0.037551  0.568692  1
  Al  Al109  1  0.823236  0.320265  0.588889  1
  Al  Al110  1  0.206257  0.352064  0.573016  1
  Al  Al111  1  0.440214  0.288466  0.604762  1
  Al  Al112  1  0.823236  0.820265  0.588889  1
  Al  Al113  1  0.206257  0.852064  0.573016  1
  Al  Al114  1  0.440214  0.788466  0.604762  1
  Al  Al115  1  0.982236  0.602979  0.609085  1
  Al  Al116  1  0.365257  0.634778  0.593212  1
  Al  Al117  1  0.748279  0.666577  0.577339  1
  Al  Al118  1  0.982236  0.102979  0.609085  1
  Al  Al119  1  0.365257  0.134778  0.593212  1
  Al  Al120  1  0.748279  0.166577  0.577339  1
  Al  Al121  1  0.898193  0.473954  0.600438  1
  Al  Al122  1  0.281214  0.505752  0.584565  1
  Al  Al123  1  0.515171  0.442155  0.616311  1
  Al  Al124  1  0.898193  0.973954  0.600438  1
  Al  Al125  1  0.281214  0.005752  0.584565  1
  Al  Al126  1  0.515171  0.942155  0.616311  1
  Al  Al127  1  0.674171  0.224869  0.636508  1
  Al  Al128  1  0.057193  0.256668  0.620635  1
  Al  Al129  1  0.291150  0.193070  0.652381  1
  Al  Al130  1  0.674171  0.724869  0.636508  1
  Al  Al131  1  0.057193  0.756668  0.620635  1
  Al  Al132  1  0.291150  0.693070  0.652381  1
  Al  Al133  1  0.833171  0.507583  0.656704  1
  Al  Al134  1  0.216193  0.539382  0.640831  1
  Al  Al135  1  0.599214  0.571181  0.624958  1
  Al  Al136  1  0.833171  0.007583  0.656704  1
  Al  Al137  1  0.216193  0.039382  0.640831  1
  Al  Al138  1  0.599214  0.071181  0.624958  1
  Al  Al139  1  0.749128  0.378557  0.648057  1
  Al  Al140  1  0.132150  0.410356  0.632184  1
  Al  Al141  1  0.366107  0.346758  0.663930  1
  Al  Al142  1  0.749128  0.878557  0.648057  1
  Al  Al143  1  0.132150  0.910356  0.632184  1
  Al  Al144  1  0.366107  0.846758  0.663930  1
  Al  Al145  1  0.525107  0.129473  0.684127  1
  Al  Al146  1  0.908128  0.161271  0.668254  1
  Al  Al147  1  0.142085  0.097674  0.700000  1
  Al  Al148  1  0.525107  0.629473  0.684127  1
  Al  Al149  1  0.908128  0.661271  0.668254  1
  Al  Al150  1  0.142085  0.597674  0.700000  1
  Al  Al151  1  0.684107  0.412187  0.704323  1
  Al  Al152  1  0.067128  0.443986  0.688450  1
  Al  Al153  1  0.450150  0.475784  0.672577  1
  Al  Al154  1  0.684107  0.912187  0.704323  1
  Al  Al155  1  0.067128  0.943986  0.688450  1
  Al  Al156  1  0.450150  0.975784  0.672577  1
  Al  Al157  1  0.600064  0.283161  0.695677  1
  Al  Al158  1  0.983085  0.314960  0.679804  1
  Al  Al159  1  0.217042  0.251362  0.711550  1
  Al  Al160  1  0.600064  0.783161  0.695677  1
  Al  Al161  1  0.983085  0.814960  0.679804  1
  Al  Al162  1  0.217042  0.751362  0.711550  1
  Cu  Cu163  1  0.950757  0.974137  0.299689  1
  Cu  Cu164  1  0.184714  0.910539  0.331435  1
  Cu  Cu165  1  0.567735  0.942338  0.315562  1
  Cu  Cu166  1  0.950757  0.474137  0.299689  1
  Cu  Cu167  1  0.184714  0.410539  0.331435  1
  Cu  Cu168  1  0.567735  0.442338  0.315562  1
  Cu  Cu169  1  0.867510  0.342949  0.290787  1
  Cu  Cu170  1  0.101467  0.279351  0.322533  1
  Cu  Cu171  1  0.484489  0.311150  0.306660  1
  Cu  Cu172  1  0.867510  0.842949  0.290787  1
  Cu  Cu173  1  0.101467  0.779351  0.322533  1
  Cu  Cu174  1  0.484489  0.811150  0.306660  1
  Cu  Cu175  1  0.801692  0.878740  0.347308  1
  Cu  Cu176  1  0.035649  0.815143  0.379054  1
  Cu  Cu177  1  0.418671  0.846942  0.363181  1
  Cu  Cu178  1  0.801692  0.378740  0.347308  1
  Cu  Cu179  1  0.035649  0.315143  0.379054  1
  Cu  Cu180  1  0.418671  0.346942  0.363181  1
  Cu  Cu181  1  0.718446  0.247552  0.338406  1
  Cu  Cu182  1  0.952403  0.183955  0.370152  1
  Cu  Cu183  1  0.335424  0.215753  0.354279  1
  Cu  Cu184  1  0.718446  0.747552  0.338406  1
  Cu  Cu185  1  0.952403  0.683955  0.370152  1
  Cu  Cu186  1  0.335424  0.715753  0.354279  1
  Cu  Cu187  1  0.652628  0.783344  0.394927  1
  Cu  Cu188  1  0.886585  0.719747  0.426673  1
  Cu  Cu189  1  0.269606  0.751545  0.410800  1
  Cu  Cu190  1  0.652628  0.283344  0.394927  1
  Cu  Cu191  1  0.886585  0.219747  0.426673  1
  Cu  Cu192  1  0.269606  0.251545  0.410800  1
  Cu  Cu193  1  0.569381  0.152156  0.386025  1
  Cu  Cu194  1  0.803338  0.088558  0.417771  1
  Cu  Cu195  1  0.186360  0.120357  0.401898  1
  Cu  Cu196  1  0.569381  0.652156  0.386025  1
  Cu  Cu197  1  0.803338  0.588558  0.417771  1
  Cu  Cu198  1  0.186360  0.620357  0.401898  1
  Cu  Cu199  1  0.503563  0.687948  0.442546  1
  Cu  Cu200  1  0.737520  0.624350  0.474292  1
  Cu  Cu201  1  0.120542  0.656149  0.458419  1
  Cu  Cu202  1  0.503563  0.187948  0.442546  1
  Cu  Cu203  1  0.737520  0.124350  0.474292  1
  Cu  Cu204  1  0.120542  0.156149  0.458419  1
  Cu  Cu205  1  0.420317  0.056760  0.433645  1
  Cu  Cu206  1  0.654274  0.993162  0.465391  1
  Cu  Cu207  1  0.037295  0.024961  0.449518  1
  Cu  Cu208  1  0.420317  0.556760  0.433645  1
  Cu  Cu209  1  0.654274  0.493162  0.465391  1
  Cu  Cu210  1  0.037295  0.524961  0.449518  1
  Cu  Cu211  1  0.354499  0.592551  0.490165  1
  Cu  Cu212  1  0.588456  0.528954  0.521911  1
  Cu  Cu213  1  0.971477  0.560753  0.506038  1
  Cu  Cu214  1  0.354499  0.092551  0.490165  1
  Cu  Cu215  1  0.588456  0.028954  0.521911  1
  Cu  Cu216  1  0.971477  0.060753  0.506038  1
  Cu  Cu217  1  0.271252  0.961363  0.481264  1
  Cu  Cu218  1  0.505209  0.897766  0.513010  1
  Cu  Cu219  1  0.888231  0.929564  0.497137  1
  Cu  Cu220  1  0.271252  0.461363  0.481264  1
  Cu  Cu221  1  0.505209  0.397766  0.513010  1
  Cu  Cu222  1  0.888231  0.429564  0.497137  1
  Cu  Cu223  1  0.205434  0.497155  0.537784  1
  Cu  Cu224  1  0.439391  0.433558  0.569530  1
  Cu  Cu225  1  0.822413  0.465356  0.553657  1
  Cu  Cu226  1  0.205434  0.997155  0.537784  1
  Cu  Cu227  1  0.439391  0.933558  0.569530  1
  Cu  Cu228  1  0.822413  0.965356  0.553657  1
  Cu  Cu229  1  0.122188  0.865967  0.528883  1
  Cu  Cu230  1  0.356145  0.802369  0.560629  1
  Cu  Cu231  1  0.739166  0.834168  0.544756  1
  Cu  Cu232  1  0.122188  0.365967  0.528883  1
  Cu  Cu233  1  0.356145  0.302369  0.560629  1
  Cu  Cu234  1  0.739166  0.334168  0.544756  1
  Cu  Cu235  1  0.056370  0.401759  0.585403  1
  Cu  Cu236  1  0.290327  0.338161  0.617149  1
  Cu  Cu237  1  0.673348  0.369960  0.601276  1
  Cu  Cu238  1  0.056370  0.901759  0.585403  1
  Cu  Cu239  1  0.290327  0.838161  0.617149  1
  Cu  Cu240  1  0.673348  0.869960  0.601276  1
  Cu  Cu241  1  0.973123  0.770571  0.576502  1
  Cu  Cu242  1  0.207080  0.706973  0.608248  1
  Cu  Cu243  1  0.590102  0.738772  0.592375  1
  Cu  Cu244  1  0.973123  0.270571  0.576502  1
  Cu  Cu245  1  0.207080  0.206973  0.608248  1
  Cu  Cu246  1  0.590102  0.238772  0.592375  1
  Cu  Cu247  1  0.907305  0.306362  0.633022  1
  Cu  Cu248  1  0.141262  0.242765  0.664768  1
  Cu  Cu249  1  0.524284  0.274564  0.648895  1
  Cu  Cu250  1  0.907305  0.806362  0.633022  1
  Cu  Cu251  1  0.141262  0.742765  0.664768  1
  Cu  Cu252  1  0.524284  0.774564  0.648895  1
  Cu  Cu253  1  0.824059  0.675174  0.624121  1
  Cu  Cu254  1  0.058016  0.611577  0.655867  1
  Cu  Cu255  1  0.441037  0.643375  0.639994  1
  Cu  Cu256  1  0.824059  0.175174  0.624121  1
  Cu  Cu257  1  0.058016  0.111577  0.655867  1
  Cu  Cu258  1  0.441037  0.143375  0.639994  1
  Cu  Cu259  1  0.758241  0.210966  0.680641  1
  Cu  Cu260  1  0.992198  0.147369  0.712387  1
  Cu  Cu261  1  0.375219  0.179167  0.696514  1
  Cu  Cu262  1  0.758241  0.710966  0.680641  1
  Cu  Cu263  1  0.992198  0.647369  0.712387  1
  Cu  Cu264  1  0.375219  0.679167  0.696514  1
  Cu  Cu265  1  0.674994  0.579778  0.671740  1
  Cu  Cu266  1  0.908951  0.516180  0.703486  1
  Cu  Cu267  1  0.291973  0.547979  0.687613  1
  Cu  Cu268  1  0.674994  0.079778  0.671740  1
  Cu  Cu269  1  0.908951  0.016180  0.703486  1
  Cu  Cu270  1  0.291973  0.047979  0.687613  1
