# generated using pymatgen
data_Al3Cu2
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   11.13779326
_cell_length_b   16.06368960
_cell_length_c   51.92539865
_cell_angle_alpha   90.00000000
_cell_angle_beta   90.00000000
_cell_angle_gamma   92.83874345
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Al3Cu2
_chemical_formula_sum   'Al162 Cu108'
_cell_volume   9278.78336422
_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  0.280084  0.387842  0.323077  1
  Al  Al2  1  0.257855  0.076638  0.297436  1
  Al  Al3  1  0.235626  0.765433  0.271795  1
  Al  Al4  1  0.613417  0.054509  0.323077  1
  Al  Al5  1  0.591188  0.743304  0.297436  1
  Al  Al6  1  0.946751  0.721175  0.323077  1
  Al  Al7  1  0.568960  0.432100  0.271795  1
  Al  Al8  1  0.924522  0.409971  0.297436  1
  Al  Al9  1  0.902293  0.098767  0.271795  1
  Al  Al10  1  0.480529  0.194072  0.297957  1
  Al  Al11  1  0.458300  0.882867  0.272316  1
  Al  Al12  1  0.502758  0.505276  0.323598  1
  Al  Al13  1  0.813862  0.860738  0.297957  1
  Al  Al14  1  0.791633  0.549534  0.272316  1
  Al  Al15  1  0.147196  0.527405  0.297957  1
  Al  Al16  1  0.836091  0.171943  0.323598  1
  Al  Al17  1  0.124967  0.216201  0.272316  1
  Al  Al18  1  0.169424  0.838610  0.323598  1
  Al  Al19  1  0.412972  0.248279  0.348197  1
  Al  Al20  1  0.390743  0.937074  0.322556  1
  Al  Al21  1  0.368515  0.625870  0.296915  1
  Al  Al22  1  0.746306  0.914945  0.348197  1
  Al  Al23  1  0.724077  0.603741  0.322556  1
  Al  Al24  1  0.079639  0.581612  0.348197  1
  Al  Al25  1  0.701848  0.292537  0.296915  1
  Al  Al26  1  0.057410  0.270408  0.322556  1
  Al  Al27  1  0.035181  0.959203  0.296915  1
  Al  Al28  1  0.346771  0.321455  0.400000  1
  Al  Al29  1  0.324542  0.010251  0.374359  1
  Al  Al30  1  0.302313  0.699046  0.348718  1
  Al  Al31  1  0.680104  0.988122  0.400000  1
  Al  Al32  1  0.657875  0.676917  0.374359  1
  Al  Al33  1  0.013437  0.654788  0.400000  1
  Al  Al34  1  0.635646  0.365713  0.348718  1
  Al  Al35  1  0.991208  0.343584  0.374359  1
  Al  Al36  1  0.968980  0.032380  0.348718  1
  Al  Al37  1  0.547216  0.127685  0.374880  1
  Al  Al38  1  0.524987  0.816481  0.349239  1
  Al  Al39  1  0.569444  0.438889  0.400521  1
  Al  Al40  1  0.880549  0.794352  0.374880  1
  Al  Al41  1  0.858320  0.483147  0.349239  1
  Al  Al42  1  0.213882  0.461018  0.374880  1
  Al  Al43  1  0.902778  0.105556  0.400521  1
  Al  Al44  1  0.191653  0.149814  0.349239  1
  Al  Al45  1  0.236111  0.772223  0.400521  1
  Al  Al46  1  0.479659  0.181892  0.425120  1
  Al  Al47  1  0.457430  0.870688  0.399479  1
  Al  Al48  1  0.435201  0.559483  0.373838  1
  Al  Al49  1  0.812992  0.848559  0.425120  1
  Al  Al50  1  0.790763  0.537354  0.399479  1
  Al  Al51  1  0.146326  0.515225  0.425120  1
  Al  Al52  1  0.768535  0.226150  0.373838  1
  Al  Al53  1  0.124097  0.204021  0.399479  1
  Al  Al54  1  0.101868  0.892817  0.373838  1
  Al  Al55  1  0.413457  0.255068  0.476923  1
  Al  Al56  1  0.391228  0.943864  0.451282  1
  Al  Al57  1  0.368999  0.632660  0.425641  1
  Al  Al58  1  0.746791  0.921735  0.476923  1
  Al  Al59  1  0.724562  0.610531  0.451282  1
  Al  Al60  1  0.080124  0.588402  0.476923  1
  Al  Al61  1  0.702333  0.299326  0.425641  1
  Al  Al62  1  0.057895  0.277197  0.451282  1
  Al  Al63  1  0.035666  0.965993  0.425641  1
  Al  Al64  1  0.613902  0.061298  0.451803  1
  Al  Al65  1  0.591673  0.750094  0.426162  1
  Al  Al66  1  0.636131  0.372503  0.477444  1
  Al  Al67  1  0.947236  0.727965  0.451803  1
  Al  Al68  1  0.925007  0.416760  0.426162  1
  Al  Al69  1  0.280569  0.394631  0.451803  1
  Al  Al70  1  0.969464  0.039169  0.477444  1
  Al  Al71  1  0.258340  0.083427  0.426162  1
  Al  Al72  1  0.302798  0.705836  0.477444  1
  Al  Al73  1  0.546346  0.115505  0.502043  1
  Al  Al74  1  0.524117  0.804301  0.476402  1
  Al  Al75  1  0.501888  0.493096  0.450761  1
  Al  Al76  1  0.879679  0.782172  0.502043  1
  Al  Al77  1  0.857450  0.470967  0.476402  1
  Al  Al78  1  0.213012  0.448839  0.502043  1
  Al  Al79  1  0.835221  0.159763  0.450761  1
  Al  Al80  1  0.190783  0.137634  0.476402  1
  Al  Al81  1  0.168555  0.826430  0.450761  1
  Al  Al82  1  0.480144  0.188681  0.553846  1
  Al  Al83  1  0.457915  0.877477  0.528205  1
  Al  Al84  1  0.435686  0.566273  0.502564  1
  Al  Al85  1  0.813477  0.855348  0.553846  1
  Al  Al86  1  0.791248  0.544144  0.528205  1
  Al  Al87  1  0.146811  0.522015  0.553846  1
  Al  Al88  1  0.769019  0.232939  0.502564  1
  Al  Al89  1  0.124582  0.210810  0.528205  1
  Al  Al90  1  0.102353  0.899606  0.502564  1
  Al  Al91  1  0.680589  0.994911  0.528726  1
  Al  Al92  1  0.658360  0.683707  0.503085  1
  Al  Al93  1  0.702818  0.306116  0.554367  1
  Al  Al94  1  0.013922  0.661578  0.528726  1
  Al  Al95  1  0.991693  0.350374  0.503085  1
  Al  Al96  1  0.347256  0.328245  0.528726  1
  Al  Al97  1  0.036151  0.972782  0.554367  1
  Al  Al98  1  0.325027  0.017040  0.503085  1
  Al  Al99  1  0.369484  0.639449  0.554367  1
  Al  Al100  1  0.613032  0.049118  0.578966  1
  Al  Al101  1  0.590803  0.737914  0.553325  1
  Al  Al102  1  0.568574  0.426710  0.527684  1
  Al  Al103  1  0.946366  0.715785  0.578966  1
  Al  Al104  1  0.924137  0.404581  0.553325  1
  Al  Al105  1  0.279699  0.382452  0.578966  1
  Al  Al106  1  0.901908  0.093376  0.527684  1
  Al  Al107  1  0.257470  0.071247  0.553325  1
  Al  Al108  1  0.235241  0.760043  0.527684  1
  Al  Al109  1  0.546831  0.122295  0.630769  1
  Al  Al110  1  0.524602  0.811090  0.605128  1
  Al  Al111  1  0.502373  0.499886  0.579487  1
  Al  Al112  1  0.880164  0.788961  0.630769  1
  Al  Al113  1  0.857935  0.477757  0.605128  1
  Al  Al114  1  0.213497  0.455628  0.630769  1
  Al  Al115  1  0.835706  0.166553  0.579487  1
  Al  Al116  1  0.191268  0.144424  0.605128  1
  Al  Al117  1  0.169039  0.833219  0.579487  1
  Al  Al118  1  0.747276  0.928524  0.605649  1
  Al  Al119  1  0.725047  0.617320  0.580008  1
  Al  Al120  1  0.769504  0.239729  0.631290  1
  Al  Al121  1  0.080609  0.595191  0.605649  1
  Al  Al122  1  0.058380  0.283987  0.580008  1
  Al  Al123  1  0.413942  0.261858  0.605649  1
  Al  Al124  1  0.102838  0.906396  0.631290  1
  Al  Al125  1  0.391713  0.950653  0.580008  1
  Al  Al126  1  0.436171  0.573062  0.631290  1
  Al  Al127  1  0.679719  0.982732  0.655889  1
  Al  Al128  1  0.657490  0.671527  0.630248  1
  Al  Al129  1  0.635261  0.360323  0.604607  1
  Al  Al130  1  0.013052  0.649398  0.655889  1
  Al  Al131  1  0.990823  0.338194  0.630248  1
  Al  Al132  1  0.346386  0.316065  0.655889  1
  Al  Al133  1  0.968594  0.026989  0.604607  1
  Al  Al134  1  0.324157  0.004860  0.630248  1
  Al  Al135  1  0.301928  0.693656  0.604607  1
  Al  Al136  1  0.613517  0.055908  0.707692  1
  Al  Al137  1  0.591288  0.744703  0.682051  1
  Al  Al138  1  0.569059  0.433499  0.656410  1
  Al  Al139  1  0.946851  0.722575  0.707692  1
  Al  Al140  1  0.924622  0.411370  0.682051  1
  Al  Al141  1  0.280184  0.389241  0.707692  1
  Al  Al142  1  0.902393  0.100166  0.656410  1
  Al  Al143  1  0.257955  0.078037  0.682051  1
  Al  Al144  1  0.235726  0.766832  0.656410  1
  Al  Al145  1  0.813962  0.862138  0.682572  1
  Al  Al146  1  0.791733  0.550933  0.656931  1
  Al  Al147  1  0.836191  0.173342  0.708213  1
  Al  Al148  1  0.147296  0.528804  0.682572  1
  Al  Al149  1  0.125067  0.217600  0.656931  1
  Al  Al150  1  0.480629  0.195471  0.682572  1
  Al  Al151  1  0.169524  0.840009  0.708213  1
  Al  Al152  1  0.458400  0.884267  0.656931  1
  Al  Al153  1  0.502858  0.506675  0.708213  1
  Al  Al154  1  0.746406  0.916345  0.732812  1
  Al  Al155  1  0.724177  0.605140  0.707171  1
  Al  Al156  1  0.701948  0.293936  0.681530  1
  Al  Al157  1  0.079739  0.583011  0.732812  1
  Al  Al158  1  0.057510  0.271807  0.707171  1
  Al  Al159  1  0.413072  0.249678  0.732812  1
  Al  Al160  1  0.035281  0.960603  0.681530  1
  Al  Al161  1  0.390843  0.938474  0.707171  1
  Al  Al162  1  0.368614  0.627269  0.681530  1
  Cu  Cu163  1  0.491584  0.348842  0.310709  1
  Cu  Cu164  1  0.469355  0.037638  0.285068  1
  Cu  Cu165  1  0.513813  0.660047  0.336350  1
  Cu  Cu166  1  0.824917  0.015509  0.310709  1
  Cu  Cu167  1  0.802688  0.704305  0.285068  1
  Cu  Cu168  1  0.158251  0.682176  0.310709  1
  Cu  Cu169  1  0.847146  0.326713  0.336350  1
  Cu  Cu170  1  0.136022  0.370971  0.285068  1
  Cu  Cu171  1  0.180480  0.993380  0.336350  1
  Cu  Cu172  1  0.401917  0.093508  0.335445  1
  Cu  Cu173  1  0.379688  0.782304  0.309804  1
  Cu  Cu174  1  0.357459  0.471099  0.284163  1
  Cu  Cu175  1  0.735251  0.760175  0.335445  1
  Cu  Cu176  1  0.713022  0.448970  0.309804  1
  Cu  Cu177  1  0.068584  0.426842  0.335445  1
  Cu  Cu178  1  0.690793  0.137766  0.284163  1
  Cu  Cu179  1  0.046355  0.115637  0.309804  1
  Cu  Cu180  1  0.024126  0.804433  0.284163  1
  Cu  Cu181  1  0.558271  0.282456  0.387632  1
  Cu  Cu182  1  0.536042  0.971251  0.361991  1
  Cu  Cu183  1  0.580500  0.593660  0.413273  1
  Cu  Cu184  1  0.891604  0.949122  0.387632  1
  Cu  Cu185  1  0.869375  0.637918  0.361991  1
  Cu  Cu186  1  0.224937  0.615789  0.387632  1
  Cu  Cu187  1  0.913833  0.260327  0.413273  1
  Cu  Cu188  1  0.202708  0.304585  0.361991  1
  Cu  Cu189  1  0.247166  0.926993  0.413273  1
  Cu  Cu190  1  0.468604  0.027121  0.412368  1
  Cu  Cu191  1  0.446375  0.715917  0.386727  1
  Cu  Cu192  1  0.424146  0.404713  0.361086  1
  Cu  Cu193  1  0.801937  0.693788  0.412368  1
  Cu  Cu194  1  0.779708  0.382584  0.386727  1
  Cu  Cu195  1  0.135271  0.360455  0.412368  1
  Cu  Cu196  1  0.757479  0.071379  0.361086  1
  Cu  Cu197  1  0.113042  0.049250  0.386727  1
  Cu  Cu198  1  0.090813  0.738046  0.361086  1
  Cu  Cu199  1  0.624957  0.216069  0.464555  1
  Cu  Cu200  1  0.602728  0.904864  0.438914  1
  Cu  Cu201  1  0.647186  0.527273  0.490196  1
  Cu  Cu202  1  0.958291  0.882735  0.464555  1
  Cu  Cu203  1  0.936062  0.571531  0.438914  1
  Cu  Cu204  1  0.291624  0.549402  0.464555  1
  Cu  Cu205  1  0.980520  0.193940  0.490196  1
  Cu  Cu206  1  0.269395  0.238198  0.438914  1
  Cu  Cu207  1  0.313853  0.860606  0.490196  1
  Cu  Cu208  1  0.535291  0.960735  0.489291  1
  Cu  Cu209  1  0.513062  0.649530  0.463650  1
  Cu  Cu210  1  0.490833  0.338326  0.438009  1
  Cu  Cu211  1  0.868624  0.627401  0.489291  1
  Cu  Cu212  1  0.846395  0.316197  0.463650  1
  Cu  Cu213  1  0.201957  0.294068  0.489291  1
  Cu  Cu214  1  0.824166  0.004992  0.438009  1
  Cu  Cu215  1  0.179728  0.982864  0.463650  1
  Cu  Cu216  1  0.157499  0.671659  0.438009  1
  Cu  Cu217  1  0.691644  0.149682  0.541478  1
  Cu  Cu218  1  0.669415  0.838478  0.515837  1
  Cu  Cu219  1  0.713873  0.460886  0.567119  1
  Cu  Cu220  1  0.024977  0.816349  0.541478  1
  Cu  Cu221  1  0.002748  0.505144  0.515837  1
  Cu  Cu222  1  0.358311  0.483015  0.541478  1
  Cu  Cu223  1  0.047206  0.127553  0.567119  1
  Cu  Cu224  1  0.336082  0.171811  0.515837  1
  Cu  Cu225  1  0.380539  0.794220  0.567119  1
  Cu  Cu226  1  0.601977  0.894348  0.566214  1
  Cu  Cu227  1  0.579748  0.583143  0.540573  1
  Cu  Cu228  1  0.557519  0.271939  0.514932  1
  Cu  Cu229  1  0.935311  0.561014  0.566214  1
  Cu  Cu230  1  0.913082  0.249810  0.540573  1
  Cu  Cu231  1  0.268644  0.227681  0.566214  1
  Cu  Cu232  1  0.890853  0.938606  0.514932  1
  Cu  Cu233  1  0.246415  0.916477  0.540573  1
  Cu  Cu234  1  0.224186  0.605272  0.514932  1
  Cu  Cu235  1  0.758331  0.083295  0.618401  1
  Cu  Cu236  1  0.736102  0.772091  0.592760  1
  Cu  Cu237  1  0.780559  0.394499  0.644042  1
  Cu  Cu238  1  0.091664  0.749962  0.618401  1
  Cu  Cu239  1  0.069435  0.438757  0.592760  1
  Cu  Cu240  1  0.424997  0.416628  0.618401  1
  Cu  Cu241  1  0.113893  0.061166  0.644042  1
  Cu  Cu242  1  0.402768  0.105424  0.592760  1
  Cu  Cu243  1  0.447226  0.727833  0.644042  1
  Cu  Cu244  1  0.668664  0.827961  0.643137  1
  Cu  Cu245  1  0.646435  0.516757  0.617496  1
  Cu  Cu246  1  0.624206  0.205552  0.591855  1
  Cu  Cu247  1  0.001997  0.494628  0.643137  1
  Cu  Cu248  1  0.979768  0.183423  0.617496  1
  Cu  Cu249  1  0.335331  0.161294  0.643137  1
  Cu  Cu250  1  0.957539  0.872219  0.591855  1
  Cu  Cu251  1  0.313102  0.850090  0.617496  1
  Cu  Cu252  1  0.290873  0.538885  0.591855  1
  Cu  Cu253  1  0.825017  0.016908  0.695324  1
  Cu  Cu254  1  0.802788  0.705704  0.669683  1
  Cu  Cu255  1  0.847246  0.328113  0.720965  1
  Cu  Cu256  1  0.158351  0.683575  0.695324  1
  Cu  Cu257  1  0.136122  0.372371  0.669683  1
  Cu  Cu258  1  0.491684  0.350242  0.695324  1
  Cu  Cu259  1  0.180579  0.994779  0.720965  1
  Cu  Cu260  1  0.469455  0.039037  0.669683  1
  Cu  Cu261  1  0.513913  0.661446  0.720965  1
  Cu  Cu262  1  0.735351  0.761574  0.720060  1
  Cu  Cu263  1  0.713122  0.450370  0.694419  1
  Cu  Cu264  1  0.690893  0.139165  0.668778  1
  Cu  Cu265  1  0.068684  0.428241  0.720060  1
  Cu  Cu266  1  0.046455  0.117036  0.694419  1
  Cu  Cu267  1  0.402017  0.094907  0.720060  1
  Cu  Cu268  1  0.024226  0.805832  0.668778  1
  Cu  Cu269  1  0.379788  0.783703  0.694419  1
  Cu  Cu270  1  0.357559  0.472499  0.668778  1
