# generated using pymatgen
data_AlCu3
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   8.39865263
_cell_length_b   18.29206715
_cell_length_c   48.96208568
_cell_angle_alpha   90.00000000
_cell_angle_beta   90.00000000
_cell_angle_gamma   102.92096638
_symmetry_Int_Tables_number   1
_chemical_formula_structural   AlCu3
_chemical_formula_sum   'Al60 Cu180'
_cell_volume   7331.52159566
_cell_formula_units_Z   60
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  0.904751  0.800388  0.328729  1
  Al  Al2  1  0.057460  0.116726  0.359250  1
  Al  Al3  1  0.748229  0.495795  0.300575  1
  Al  Al4  1  0.748229  0.995795  0.300575  1
  Al  Al5  1  0.904751  0.300388  0.328729  1
  Al  Al6  1  0.057460  0.616726  0.359250  1
  Al  Al7  1  0.242028  0.987551  0.300424  1
  Al  Al8  1  0.390167  0.299376  0.328633  1
  Al  Al9  1  0.551610  0.617141  0.357906  1
  Al  Al10  1  0.390167  0.799376  0.328633  1
  Al  Al11  1  0.551610  0.117141  0.357906  1
  Al  Al12  1  0.242028  0.487551  0.300424  1
  Al  Al13  1  0.372959  0.748887  0.414334  1
  Al  Al14  1  0.531664  0.063208  0.441490  1
  Al  Al15  1  0.214543  0.433995  0.387183  1
  Al  Al16  1  0.214543  0.933995  0.387183  1
  Al  Al17  1  0.372959  0.248887  0.414334  1
  Al  Al18  1  0.531664  0.563208  0.441490  1
  Al  Al19  1  0.708260  0.929130  0.383238  1
  Al  Al20  1  0.866684  0.247297  0.412627  1
  Al  Al21  1  0.022781  0.562206  0.440878  1
  Al  Al22  1  0.866684  0.747297  0.412627  1
  Al  Al23  1  0.022781  0.062206  0.440878  1
  Al  Al24  1  0.708260  0.429130  0.383238  1
  Al  Al25  1  0.844316  0.694473  0.497246  1
  Al  Al26  1  0.003141  0.009767  0.525065  1
  Al  Al27  1  0.688136  0.379329  0.468967  1
  Al  Al28  1  0.688136  0.879329  0.468967  1
  Al  Al29  1  0.844316  0.194473  0.497246  1
  Al  Al30  1  0.003141  0.509767  0.525065  1
  Al  Al31  1  0.181774  0.876918  0.468483  1
  Al  Al32  1  0.340599  0.192212  0.496302  1
  Al  Al33  1  0.496779  0.507356  0.524581  1
  Al  Al34  1  0.340599  0.692212  0.496302  1
  Al  Al35  1  0.496779  1.007356  0.524581  1
  Al  Al36  1  0.181774  0.376918  0.468483  1
  Al  Al37  1  0.318231  0.639388  0.580921  1
  Al  Al38  1  0.476655  0.957555  0.610310  1
  Al  Al39  1  0.162134  0.324479  0.552670  1
  Al  Al40  1  0.162134  0.824479  0.552670  1
  Al  Al41  1  0.318231  0.139388  0.580921  1
  Al  Al42  1  0.476655  0.457555  0.610310  1
  Al  Al43  1  0.653252  0.823477  0.552058  1
  Al  Al44  1  0.811956  0.137798  0.579214  1
  Al  Al45  1  0.970372  0.452690  0.606365  1
  Al  Al46  1  0.811956  0.637798  0.579214  1
  Al  Al47  1  0.970372  0.952690  0.606365  1
  Al  Al48  1  0.653252  0.323477  0.552058  1
  Al  Al49  1  0.794748  0.587308  0.664915  1
  Al  Al50  1  0.942887  0.899134  0.693124  1
  Al  Al51  1  0.633305  0.269543  0.635642  1
  Al  Al52  1  0.633305  0.769543  0.635642  1
  Al  Al53  1  0.794748  0.087308  0.664915  1
  Al  Al54  1  0.942887  0.399134  0.693124  1
  Al  Al55  1  0.127456  0.769959  0.634298  1
  Al  Al56  1  0.280164  0.086297  0.664819  1
  Al  Al57  1  0.436686  0.390889  0.692973  1
  Al  Al58  1  0.280164  0.586297  0.664819  1
  Al  Al59  1  0.436686  0.890889  0.692973  1
  Al  Al60  1  0.127456  0.269959  0.634298  1
  Cu  Cu61  1  0.167013  0.833963  0.292513  1
  Cu  Cu62  1  0.323411  0.144397  0.317985  1
  Cu  Cu63  1  0.481426  0.460313  0.344447  1
  Cu  Cu64  1  0.036763  0.068522  0.310430  1
  Cu  Cu65  1  0.190393  0.385875  0.338705  1
  Cu  Cu66  1  0.346210  0.698007  0.365751  1
  Cu  Cu67  1  0.766800  0.039876  0.350643  1
  Cu  Cu68  1  0.462151  0.411700  0.296842  1
  Cu  Cu69  1  0.610569  0.723547  0.322668  1
  Cu  Cu70  1  0.481426  0.960313  0.344447  1
  Cu  Cu71  1  0.167013  0.333963  0.292513  1
  Cu  Cu72  1  0.323411  0.644397  0.317985  1
  Cu  Cu73  1  0.190393  0.885875  0.338705  1
  Cu  Cu74  1  0.346210  0.198007  0.365751  1
  Cu  Cu75  1  0.036763  0.568522  0.310430  1
  Cu  Cu76  1  0.462151  0.911700  0.296842  1
  Cu  Cu77  1  0.610569  0.223547  0.322668  1
  Cu  Cu78  1  0.766800  0.539876  0.350643  1
  Cu  Cu79  1  0.971979  0.960124  0.344085  1
  Cu  Cu80  1  0.130599  0.273261  0.370664  1
  Cu  Cu81  1  0.816922  0.644134  0.316444  1
  Cu  Cu82  1  0.686633  0.879878  0.333276  1
  Cu  Cu83  1  0.842044  0.195541  0.364237  1
  Cu  Cu84  1  0.528368  0.566944  0.309588  1
  Cu  Cu85  1  0.949053  0.911343  0.296472  1
  Cu  Cu86  1  0.105147  0.216671  0.322297  1
  Cu  Cu87  1  0.263581  0.535145  0.350222  1
  Cu  Cu88  1  0.130599  0.773261  0.370664  1
  Cu  Cu89  1  0.816922  0.144134  0.316444  1
  Cu  Cu90  1  0.971979  0.460124  0.344085  1
  Cu  Cu91  1  0.528368  0.066944  0.309588  1
  Cu  Cu92  1  0.686633  0.379878  0.333276  1
  Cu  Cu93  1  0.842044  0.695541  0.364237  1
  Cu  Cu94  1  0.263581  0.035145  0.350222  1
  Cu  Cu95  1  0.949053  0.411343  0.296472  1
  Cu  Cu96  1  0.105147  0.716671  0.322297  1
  Cu  Cu97  1  0.635742  0.776577  0.370839  1
  Cu  Cu98  1  0.792966  0.091354  0.399548  1
  Cu  Cu99  1  0.951217  0.404608  0.427438  1
  Cu  Cu100  1  0.505850  0.011567  0.392951  1
  Cu  Cu101  1  0.661090  0.327982  0.420113  1
  Cu  Cu102  1  0.818695  0.643832  0.448384  1
  Cu  Cu103  1  0.240099  0.986101  0.435344  1
  Cu  Cu104  1  0.927001  0.353599  0.377933  1
  Cu  Cu105  1  0.083599  0.670648  0.407164  1
  Cu  Cu106  1  0.951217  0.904608  0.427438  1
  Cu  Cu107  1  0.635742  0.276577  0.370839  1
  Cu  Cu108  1  0.792966  0.591354  0.399548  1
  Cu  Cu109  1  0.661090  0.827982  0.420113  1
  Cu  Cu110  1  0.818695  0.143832  0.448384  1
  Cu  Cu111  1  0.505850  0.511567  0.392951  1
  Cu  Cu112  1  0.927001  0.853599  0.377933  1
  Cu  Cu113  1  0.083599  0.170648  0.407164  1
  Cu  Cu114  1  0.240099  0.486101  0.435344  1
  Cu  Cu115  1  0.444871  0.904179  0.426930  1
  Cu  Cu116  1  0.603266  0.220304  0.454797  1
  Cu  Cu117  1  0.288581  0.588570  0.399061  1
  Cu  Cu118  1  0.156056  0.823925  0.419828  1
  Cu  Cu119  1  0.314434  0.139581  0.447736  1
  Cu  Cu120  1  0.995177  0.508730  0.392753  1
  Cu  Cu121  1  0.417043  0.851388  0.377785  1
  Cu  Cu122  1  0.578082  0.168721  0.406137  1
  Cu  Cu123  1  0.735738  0.481526  0.432418  1
  Cu  Cu124  1  0.603266  0.720304  0.454797  1
  Cu  Cu125  1  0.288581  0.088570  0.399061  1
  Cu  Cu126  1  0.444871  0.404179  0.426930  1
  Cu  Cu127  1  0.995177  1.008730  0.392753  1
  Cu  Cu128  1  0.156056  0.323925  0.419828  1
  Cu  Cu129  1  0.314434  0.639581  0.447736  1
  Cu  Cu130  1  0.735738  0.981526  0.432418  1
  Cu  Cu131  1  0.417043  0.351388  0.377785  1
  Cu  Cu132  1  0.578082  0.668721  0.406137  1
  Cu  Cu133  1  0.109233  0.720955  0.455642  1
  Cu  Cu134  1  0.265729  0.036600  0.483660  1
  Cu  Cu135  1  0.423327  0.352113  0.511815  1
  Cu  Cu136  1  0.977085  0.958022  0.476258  1
  Cu  Cu137  1  0.134627  0.273194  0.504105  1
  Cu  Cu138  1  0.291804  0.589076  0.532139  1
  Cu  Cu139  1  0.713803  0.931161  0.517743  1
  Cu  Cu140  1  0.398373  0.301099  0.462949  1
  Cu  Cu141  1  0.555887  0.614976  0.490140  1
  Cu  Cu142  1  0.423327  0.852113  0.511815  1
  Cu  Cu143  1  0.109233  0.220955  0.455642  1
  Cu  Cu144  1  0.265729  0.536600  0.483660  1
  Cu  Cu145  1  0.134627  0.773194  0.504105  1
  Cu  Cu146  1  0.291804  0.089076  0.532139  1
  Cu  Cu147  1  0.977085  0.458022  0.476258  1
  Cu  Cu148  1  0.398373  0.801099  0.462949  1
  Cu  Cu149  1  0.555887  0.114976  0.490140  1
  Cu  Cu150  1  0.713803  0.431161  0.517743  1
  Cu  Cu151  1  0.919187  0.850085  0.509888  1
  Cu  Cu152  1  0.075682  0.165730  0.537906  1
  Cu  Cu153  1  0.761588  0.534572  0.481733  1
  Cu  Cu154  1  0.629028  0.771709  0.503408  1
  Cu  Cu155  1  0.786542  0.085586  0.530599  1
  Cu  Cu156  1  0.471112  0.455523  0.475805  1
  Cu  Cu157  1  0.893111  0.797609  0.461409  1
  Cu  Cu158  1  0.050288  0.113491  0.489443  1
  Cu  Cu159  1  0.207830  0.428663  0.517290  1
  Cu  Cu160  1  0.075682  0.665730  0.537906  1
  Cu  Cu161  1  0.761588  0.034572  0.481733  1
  Cu  Cu162  1  0.919187  0.350085  0.509888  1
  Cu  Cu163  1  0.471112  0.955523  0.475805  1
  Cu  Cu164  1  0.629028  0.271709  0.503408  1
  Cu  Cu165  1  0.786542  0.585586  0.530599  1
  Cu  Cu166  1  0.207830  0.928663  0.517290  1
  Cu  Cu167  1  0.893111  0.297609  0.461409  1
  Cu  Cu168  1  0.050288  0.613491  0.489443  1
  Cu  Cu169  1  0.581649  0.666381  0.538751  1
  Cu  Cu170  1  0.740044  0.982505  0.566618  1
  Cu  Cu171  1  0.896334  0.298115  0.594487  1
  Cu  Cu172  1  0.449177  0.905159  0.561130  1
  Cu  Cu173  1  0.606833  0.217964  0.587411  1
  Cu  Cu174  1  0.767872  0.535296  0.615763  1
  Cu  Cu175  1  0.189738  0.877955  0.600796  1
  Cu  Cu176  1  0.870481  0.247104  0.545812  1
  Cu  Cu177  1  0.028860  0.562760  0.573720  1
  Cu  Cu178  1  0.896334  0.798115  0.594487  1
  Cu  Cu179  1  0.581649  0.166381  0.538751  1
  Cu  Cu180  1  0.740044  0.482505  0.566618  1
  Cu  Cu181  1  0.606833  0.717964  0.587411  1
  Cu  Cu182  1  0.767872  0.035296  0.615763  1
  Cu  Cu183  1  0.449177  0.405159  0.561130  1
  Cu  Cu184  1  0.870481  0.747104  0.545812  1
  Cu  Cu185  1  0.028860  0.062760  0.573720  1
  Cu  Cu186  1  0.189738  0.377955  0.600796  1
  Cu  Cu187  1  0.391949  0.795331  0.594000  1
  Cu  Cu188  1  0.549174  0.110108  0.622709  1
  Cu  Cu189  1  0.233698  0.482077  0.566110  1
  Cu  Cu190  1  0.101316  0.716036  0.586384  1
  Cu  Cu191  1  0.257915  0.033086  0.615615  1
  Cu  Cu192  1  0.944816  0.400584  0.558205  1
  Cu  Cu193  1  0.366220  0.742852  0.545164  1
  Cu  Cu194  1  0.523826  0.058703  0.573435  1
  Cu  Cu195  1  0.679065  0.375118  0.600597  1
  Cu  Cu196  1  0.549174  0.610108  0.622709  1
  Cu  Cu197  1  0.233698  0.982077  0.566110  1
  Cu  Cu198  1  0.391949  0.295331  0.594000  1
  Cu  Cu199  1  0.944816  0.900584  0.558205  1
  Cu  Cu200  1  0.101316  0.216036  0.586384  1
  Cu  Cu201  1  0.257915  0.533086  0.615615  1
  Cu  Cu202  1  0.679065  0.875118  0.600597  1
  Cu  Cu203  1  0.366220  0.242852  0.545164  1
  Cu  Cu204  1  0.523826  0.558703  0.573435  1
  Cu  Cu205  1  0.054316  0.613424  0.622884  1
  Cu  Cu206  1  0.212936  0.926561  0.649463  1
  Cu  Cu207  1  0.367993  0.242551  0.677104  1
  Cu  Cu208  1  0.921334  0.851540  0.643326  1
  Cu  Cu209  1  0.079768  0.170014  0.671251  1
  Cu  Cu210  1  0.235863  0.475342  0.697076  1
  Cu  Cu211  1  0.656547  0.819741  0.683960  1
  Cu  Cu212  1  0.342871  0.191144  0.629311  1
  Cu  Cu213  1  0.498282  0.506807  0.660272  1
  Cu  Cu214  1  0.367993  0.742551  0.677104  1
  Cu  Cu215  1  0.054316  0.113424  0.622884  1
  Cu  Cu216  1  0.212936  0.426561  0.649463  1
  Cu  Cu217  1  0.079768  0.670014  0.671251  1
  Cu  Cu218  1  0.235863  0.975342  0.697076  1
  Cu  Cu219  1  0.921334  0.351540  0.643326  1
  Cu  Cu220  1  0.342871  0.691144  0.629311  1
  Cu  Cu221  1  0.498282  1.006807  0.660272  1
  Cu  Cu222  1  0.656547  0.319741  0.683960  1
  Cu  Cu223  1  0.861504  0.742288  0.675563  1
  Cu  Cu224  1  0.017902  0.052722  0.701035  1
  Cu  Cu225  1  0.703489  0.426372  0.649101  1
  Cu  Cu226  1  0.574346  0.663138  0.670880  1
  Cu  Cu227  1  0.722764  0.974985  0.696706  1
  Cu  Cu228  1  0.418115  0.346808  0.642905  1
  Cu  Cu229  1  0.838705  0.688678  0.627798  1
  Cu  Cu230  1  0.994523  1.000810  0.654843  1
  Cu  Cu231  1  0.148152  0.318163  0.683118  1
  Cu  Cu232  1  0.017902  0.552722  0.701035  1
  Cu  Cu233  1  0.703489  0.926372  0.649101  1
  Cu  Cu234  1  0.861504  0.242288  0.675563  1
  Cu  Cu235  1  0.418115  0.846808  0.642905  1
  Cu  Cu236  1  0.574346  0.163138  0.670880  1
  Cu  Cu237  1  0.722764  0.474985  0.696706  1
  Cu  Cu238  1  0.148152  0.818163  0.683118  1
  Cu  Cu239  1  0.838705  0.188678  0.627798  1
  Cu  Cu240  1  0.994523  0.500810  0.654843  1
