# generated using pymatgen
data_Al3Ni5
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   23.44602009
_cell_length_b   7.28707587
_cell_length_c   48.13590934
_cell_angle_alpha   90.00000000
_cell_angle_beta   90.00000000
_cell_angle_gamma   76.75748088
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Al3Ni5
_chemical_formula_sum   'Al126 Ni210'
_cell_volume   8005.4738028
_cell_formula_units_Z   42
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  0.408300  0.753698  0.297569  1
  Al  Al2  1  0.737796  0.515589  0.322521  1
  Al  Al3  1  0.082586  0.958824  0.274509  1
  Al  Al4  1  0.512077  0.546241  0.272266  1
  Al  Al5  1  0.835250  0.313629  0.294989  1
  Al  Al6  1  0.162359  0.073136  0.317661  1
  Al  Al7  1  0.309709  0.968410  0.326930  1
  Al  Al8  1  0.653025  0.444755  0.281071  1
  Al  Al9  1  0.984627  0.203351  0.304211  1
  Al  Al10  1  0.236197  0.517718  0.322014  1
  Al  Al11  1  0.585395  0.954447  0.275404  1
  Al  Al12  1  0.908274  0.764299  0.295716  1
  Al  Al13  1  0.334421  0.313283  0.294580  1
  Al  Al14  1  0.661817  0.075149  0.316037  1
  Al  Al15  1  0.013892  0.544229  0.271925  1
  Al  Al16  1  0.484192  0.201892  0.304118  1
  Al  Al17  1  0.809323  0.968072  0.326664  1
  Al  Al18  1  0.152925  0.452946  0.281155  1
  Al  Al19  1  0.389506  0.041022  0.365912  1
  Al  Al20  1  0.716245  0.802669  0.388251  1
  Al  Al21  1  0.062447  0.281310  0.343836  1
  Al  Al22  1  0.488255  0.834775  0.338656  1
  Al  Al23  1  0.815922  0.597327  0.360246  1
  Al  Al24  1  0.142035  0.357403  0.382942  1
  Al  Al25  1  0.290606  0.248499  0.393159  1
  Al  Al26  1  0.636753  0.726118  0.349539  1
  Al  Al27  1  0.963484  0.489302  0.370258  1
  Al  Al28  1  0.216325  0.802355  0.388478  1
  Al  Al29  1  0.562794  0.280053  0.344091  1
  Al  Al30  1  0.889707  0.038665  0.366427  1
  Al  Al31  1  0.315723  0.595895  0.360765  1
  Al  Al32  1  0.641898  0.358002  0.382720  1
  Al  Al33  1  0.988714  0.834135  0.339294  1
  Al  Al34  1  0.463522  0.487783  0.370684  1
  Al  Al35  1  0.790725  0.248339  0.393277  1
  Al  Al36  1  0.137111  0.726907  0.349038  1
  Al  Al37  1  0.369727  0.324967  0.432588  1
  Al  Al38  1  0.696280  0.086845  0.454655  1
  Al  Al39  1  0.043048  0.563822  0.410366  1
  Al  Al40  1  0.468631  0.118203  0.405222  1
  Al  Al41  1  0.795209  0.879944  0.427397  1
  Al  Al42  1  0.121976  0.641038  0.449802  1
  Al  Al43  1  0.270724  0.532066  0.459912  1
  Al  Al44  1  0.617301  0.009826  0.415309  1
  Al  Al45  1  0.943955  0.770839  0.437682  1
  Al  Al46  1  0.196342  0.086557  0.454844  1
  Al  Al47  1  0.542750  0.564189  0.410228  1
  Al  Al48  1  0.869767  0.325519  0.432462  1
  Al  Al49  1  0.295349  0.879653  0.427563  1
  Al  Al50  1  0.621995  0.640619  0.449838  1
  Al  Al51  1  0.968589  0.118749  0.405238  1
  Al  Al52  1  0.443918  0.770916  0.437574  1
  Al  Al53  1  0.770794  0.532099  0.459763  1
  Al  Al54  1  0.117134  0.010267  0.415521  1
  Al  Al55  1  0.349715  0.608451  0.499336  1
  Al  Al56  1  0.676517  0.369744  0.521451  1
  Al  Al57  1  0.022978  0.847623  0.477052  1
  Al  Al58  1  0.448717  0.401809  0.471924  1
  Al  Al59  1  0.775436  0.162930  0.494214  1
  Al  Al60  1  0.102059  0.924144  0.516504  1
  Al  Al61  1  0.250767  0.815280  0.526697  1
  Al  Al62  1  0.597386  0.293302  0.481951  1
  Al  Al63  1  0.923982  0.054373  0.504309  1
  Al  Al64  1  0.176349  0.369965  0.521491  1
  Al  Al65  1  0.523030  0.847281  0.477043  1
  Al  Al66  1  0.849715  0.608890  0.499172  1
  Al  Al67  1  0.275386  0.163132  0.494200  1
  Al  Al68  1  0.602098  0.923962  0.516454  1
  Al  Al69  1  0.948676  0.402143  0.471816  1
  Al  Al70  1  0.424070  0.054215  0.504303  1
  Al  Al71  1  0.750711  0.815450  0.526576  1
  Al  Al72  1  0.097325  0.293257  0.482114  1
  Al  Al73  1  0.329672  0.892303  0.565939  1
  Al  Al74  1  0.656479  0.653090  0.588248  1
  Al  Al75  1  0.003073  0.130746  0.543795  1
  Al  Al76  1  0.428636  0.685263  0.538657  1
  Al  Al77  1  0.755512  0.446601  0.560841  1
  Al  Al78  1  0.082157  0.207134  0.583319  1
  Al  Al79  1  0.230780  0.098856  0.593258  1
  Al  Al80  1  0.577482  0.576313  0.548727  1
  Al  Al81  1  0.904158  0.337782  0.570991  1
  Al  Al82  1  0.156607  0.653574  0.588178  1
  Al  Al83  1  0.503173  0.130518  0.543725  1
  Al  Al84  1  0.829718  0.891841  0.566042  1
  Al  Al85  1  0.255477  0.446300  0.560937  1
  Al  Al86  1  0.582270  0.207430  0.582879  1
  Al  Al87  1  0.928711  0.685220  0.538697  1
  Al  Al88  1  0.404155  0.337296  0.571057  1
  Al  Al89  1  0.730884  0.098821  0.593314  1
  Al  Al90  1  0.077429  0.576674  0.548661  1
  Al  Al91  1  0.309986  0.177657  0.632255  1
  Al  Al92  1  0.636384  0.937765  0.654342  1
  Al  Al93  1  0.983326  0.414253  0.610337  1
  Al  Al94  1  0.408906  0.968450  0.605316  1
  Al  Al95  1  0.735750  0.729499  0.627892  1
  Al  Al96  1  0.062475  0.491532  0.649053  1
  Al  Al97  1  0.210817  0.383055  0.659477  1
  Al  Al98  1  0.557429  0.859188  0.615748  1
  Al  Al99  1  0.883794  0.620743  0.638062  1
  Al  Al100  1  0.137221  0.935694  0.654696  1
  Al  Al101  1  0.482992  0.415434  0.609943  1
  Al  Al102  1  0.809679  0.177450  0.632408  1
  Al  Al103  1  0.236117  0.728124  0.628165  1
  Al  Al104  1  0.562576  0.490166  0.649373  1
  Al  Al105  1  0.908637  0.969382  0.605274  1
  Al  Al106  1  0.383423  0.620664  0.637991  1
  Al  Al107  1  0.711052  0.382612  0.659687  1
  Al  Al108  1  0.057502  0.860032  0.615622  1
  Al  Al109  1  0.291363  0.450922  0.703000  1
  Al  Al110  1  0.616327  0.264095  0.723526  1
  Al  Al111  1  0.962221  0.702174  0.675932  1
  Al  Al112  1  0.390115  0.247997  0.671882  1
  Al  Al113  1  0.714836  0.014866  0.694546  1
  Al  Al114  1  0.045606  0.775397  0.717173  1
  Al  Al115  1  0.186998  0.671602  0.726614  1
  Al  Al116  1  0.537381  0.143876  0.680721  1
  Al  Al117  1  0.863990  0.904001  0.703860  1
  Al  Al118  1  0.114006  0.256751  0.723578  1
  Al  Al119  1  0.462520  0.699403  0.676541  1
  Al  Al120  1  0.790695  0.465676  0.700700  1
  Al  Al121  1  0.215264  0.014502  0.694152  1
  Al  Al122  1  0.547330  0.762098  0.717642  1
  Al  Al123  1  0.889725  0.250382  0.671513  1
  Al  Al124  1  0.365057  0.904085  0.703660  1
  Al  Al125  1  0.685930  0.672241  0.726223  1
  Al  Al126  1  0.037290  0.142477  0.682673  1
  Ni  Ni127  1  0.399439  0.399441  0.332451  1
  Ni  Ni128  1  0.741836  0.883651  0.288399  1
  Ni  Ni129  1  0.073853  0.639188  0.310641  1
  Ni  Ni130  1  0.331813  1.001401  0.277643  1
  Ni  Ni131  1  0.661152  0.746676  0.301343  1
  Ni  Ni132  1  0.985713  0.523724  0.320641  1
  Ni  Ni133  1  0.492413  0.881773  0.288247  1
  Ni  Ni134  1  0.822985  0.645800  0.308745  1
  Ni  Ni135  1  0.167587  0.111337  0.267854  1
  Ni  Ni136  1  0.403749  0.061327  0.317286  1
  Ni  Ni137  1  0.750201  0.543144  0.273958  1
  Ni  Ni138  1  0.078585  0.286542  0.295568  1
  Ni  Ni139  1  0.415031  0.446589  0.280928  1
  Ni  Ni140  1  0.741092  0.220324  0.301696  1
  Ni  Ni141  1  0.068632  0.975669  0.325015  1
  Ni  Ni142  1  0.246536  0.878871  0.289503  1
  Ni  Ni143  1  0.571875  0.642932  0.310147  1
  Ni  Ni144  1  0.918439  0.113112  0.268255  1
  Ni  Ni145  1  0.486010  0.518847  0.321347  1
  Ni  Ni146  1  0.828175  1.001638  0.277382  1
  Ni  Ni147  1  0.161198  0.760043  0.299948  1
  Ni  Ni148  1  0.323021  0.639575  0.309939  1
  Ni  Ni149  1  0.649157  0.403269  0.331967  1
  Ni  Ni150  1  0.995215  0.872759  0.289940  1
  Ni  Ni151  1  0.249631  0.547042  0.273618  1
  Ni  Ni152  1  0.577388  0.288199  0.295695  1
  Ni  Ni153  1  0.903961  0.060455  0.318339  1
  Ni  Ni154  1  0.240331  0.219527  0.301375  1
  Ni  Ni155  1  0.568652  0.975043  0.325182  1
  Ni  Ni156  1  0.915530  0.451677  0.280720  1
  Ni  Ni157  1  0.379643  0.683947  0.399019  1
  Ni  Ni158  1  0.725884  0.164808  0.354198  1
  Ni  Ni159  1  0.052914  0.923348  0.376967  1
  Ni  Ni160  1  0.312994  0.280716  0.343816  1
  Ni  Ni161  1  0.639896  0.041947  0.365711  1
  Ni  Ni162  1  0.966537  0.801687  0.388332  1
  Ni  Ni163  1  0.476105  0.160671  0.354669  1
  Ni  Ni164  1  0.802391  0.923736  0.376786  1
  Ni  Ni165  1  0.149521  0.400252  0.332356  1
  Ni  Ni166  1  0.384206  0.346676  0.383989  1
  Ni  Ni167  1  0.730597  0.824613  0.339903  1
  Ni  Ni168  1  0.057632  0.585435  0.361817  1
  Ni  Ni169  1  0.394938  0.737093  0.347050  1
  Ni  Ni170  1  0.721999  0.497444  0.370347  1
  Ni  Ni171  1  0.048110  0.259462  0.392181  1
  Ni  Ni172  1  0.226372  0.163507  0.354487  1
  Ni  Ni173  1  0.552963  0.922994  0.376916  1
  Ni  Ni174  1  0.899316  0.401668  0.332261  1
  Ni  Ni175  1  0.466244  0.802887  0.388026  1
  Ni  Ni176  1  0.813665  0.277561  0.344162  1
  Ni  Ni177  1  0.139663  0.041689  0.366268  1
  Ni  Ni178  1  0.302750  0.922562  0.377048  1
  Ni  Ni179  1  0.629436  0.682741  0.399527  1
  Ni  Ni180  1  0.975917  0.161253  0.354654  1
  Ni  Ni181  1  0.231134  0.822989  0.340269  1
  Ni  Ni182  1  0.557095  0.586111  0.361610  1
  Ni  Ni183  1  0.884261  0.347527  0.383822  1
  Ni  Ni184  1  0.221757  0.497999  0.370189  1
  Ni  Ni185  1  0.548245  0.258784  0.392280  1
  Ni  Ni186  1  0.895027  0.738550  0.346192  1
  Ni  Ni187  1  0.359664  0.967067  0.465906  1
  Ni  Ni188  1  0.706548  0.444560  0.421508  1
  Ni  Ni189  1  0.032802  0.206686  0.443615  1
  Ni  Ni190  1  0.293197  0.563818  0.410394  1
  Ni  Ni191  1  0.619659  0.326037  0.432368  1
  Ni  Ni192  1  0.946302  0.086300  0.454818  1
  Ni  Ni193  1  0.456206  0.444824  0.421339  1
  Ni  Ni194  1  0.783095  0.205478  0.443741  1
  Ni  Ni195  1  0.129476  0.683824  0.399351  1
  Ni  Ni196  1  0.364269  0.630664  0.450677  1
  Ni  Ni197  1  0.710746  0.109308  0.405990  1
  Ni  Ni198  1  0.037472  0.869814  0.428487  1
  Ni  Ni199  1  0.375046  0.019734  0.414450  1
  Ni  Ni200  1  0.701725  0.780919  0.436730  1
  Ni  Ni201  1  0.028435  0.542220  0.458912  1
  Ni  Ni202  1  0.206335  0.445116  0.421488  1
  Ni  Ni203  1  0.533013  0.205941  0.443633  1
  Ni  Ni204  1  0.879541  0.685603  0.398631  1
  Ni  Ni205  1  0.446399  0.086168  0.454789  1
  Ni  Ni206  1  0.793318  0.564604  0.410124  1
  Ni  Ni207  1  0.119692  0.325583  0.432568  1
  Ni  Ni208  1  0.282988  0.206069  0.443687  1
  Ni  Ni209  1  0.609688  0.966902  0.465896  1
  Ni  Ni210  1  0.956127  0.446335  0.421070  1
  Ni  Ni211  1  0.210863  0.108877  0.406226  1
  Ni  Ni212  1  0.537531  0.869547  0.428445  1
  Ni  Ni213  1  0.864226  0.631150  0.450473  1
  Ni  Ni214  1  0.201730  0.781021  0.436862  1
  Ni  Ni215  1  0.528383  0.542171  0.458825  1
  Ni  Ni216  1  0.875051  0.019502  0.414678  1
  Ni  Ni217  1  0.339791  0.250400  0.532585  1
  Ni  Ni218  1  0.686374  0.727975  0.488163  1
  Ni  Ni219  1  0.013101  0.489110  0.510368  1
  Ni  Ni220  1  0.273045  0.847465  0.477116  1
  Ni  Ni221  1  0.599740  0.608394  0.499273  1
  Ni  Ni222  1  0.926433  0.369959  0.521428  1
  Ni  Ni223  1  0.436305  0.728122  0.488115  1
  Ni  Ni224  1  0.763120  0.489443  0.510310  1
  Ni  Ni225  1  0.109583  0.967288  0.465982  1
  Ni  Ni226  1  0.344274  0.914178  0.517376  1
  Ni  Ni227  1  0.691035  0.391790  0.472899  1
  Ni  Ni228  1  0.017547  0.153160  0.495159  1
  Ni  Ni229  1  0.355165  0.303187  0.481147  1
  Ni  Ni230  1  0.681831  0.064359  0.503293  1
  Ni  Ni231  1  0.008433  0.825604  0.525581  1
  Ni  Ni232  1  0.186374  0.728215  0.488226  1
  Ni  Ni233  1  0.513024  0.489375  0.510263  1
  Ni  Ni234  1  0.859670  0.966471  0.465998  1
  Ni  Ni235  1  0.426457  0.369576  0.521485  1
  Ni  Ni236  1  0.772934  0.847694  0.476983  1
  Ni  Ni237  1  0.099702  0.608918  0.499242  1
  Ni  Ni238  1  0.263057  0.489230  0.510423  1
  Ni  Ni239  1  0.589818  0.250537  0.532445  1
  Ni  Ni240  1  0.936384  0.727852  0.488181  1
  Ni  Ni241  1  0.190922  0.392060  0.472936  1
  Ni  Ni242  1  0.517666  0.152886  0.495120  1
  Ni  Ni243  1  0.844266  0.913993  0.517438  1
  Ni  Ni244  1  0.181824  0.064268  0.503447  1
  Ni  Ni245  1  0.508482  0.825176  0.525617  1
  Ni  Ni246  1  0.855167  0.303295  0.481065  1
  Ni  Ni247  1  0.319836  0.531729  0.599854  1
  Ni  Ni248  1  0.666487  0.011280  0.554789  1
  Ni  Ni249  1  0.992950  0.773120  0.576940  1
  Ni  Ni250  1  0.253041  0.131275  0.543696  1
  Ni  Ni251  1  0.579744  0.891259  0.566044  1
  Ni  Ni252  1  0.906329  0.652915  0.588295  1
  Ni  Ni253  1  0.416480  0.011282  0.554812  1
  Ni  Ni254  1  0.743162  0.772152  0.577209  1
  Ni  Ni255  1  0.089778  0.249948  0.532700  1
  Ni  Ni256  1  0.324432  0.197496  0.583942  1
  Ni  Ni257  1  0.671020  0.675087  0.539639  1
  Ni  Ni258  1  0.997742  0.436329  0.561815  1
  Ni  Ni259  1  0.335166  0.586208  0.548018  1
  Ni  Ni260  1  0.662038  0.347578  0.570033  1
  Ni  Ni261  1  0.988587  0.108460  0.592445  1
  Ni  Ni262  1  0.166564  0.010791  0.554977  1
  Ni  Ni263  1  0.493034  0.771801  0.577095  1
  Ni  Ni264  1  0.839748  0.250721  0.532533  1
  Ni  Ni265  1  0.406016  0.653271  0.588226  1
  Ni  Ni266  1  0.753139  0.130882  0.543727  1
  Ni  Ni267  1  0.079769  0.891777  0.566046  1
  Ni  Ni268  1  0.243380  0.771422  0.577388  1
  Ni  Ni269  1  0.570033  0.533222  0.599174  1
  Ni  Ni270  1  0.916312  0.011817  0.554786  1
  Ni  Ni271  1  0.171038  0.675191  0.539646  1
  Ni  Ni272  1  0.497680  0.436388  0.561610  1
  Ni  Ni273  1  0.824347  0.197931  0.583948  1
  Ni  Ni274  1  0.161832  0.347674  0.570077  1
  Ni  Ni275  1  0.488672  0.108002  0.592360  1
  Ni  Ni276  1  0.835199  0.586653  0.547850  1
  Ni  Ni277  1  0.300035  0.817944  0.665943  1
  Ni  Ni278  1  0.646791  0.293974  0.621584  1
  Ni  Ni279  1  0.973093  0.054015  0.644160  1
  Ni  Ni280  1  0.232945  0.414751  0.610362  1
  Ni  Ni281  1  0.559649  0.176865  0.632030  1
  Ni  Ni282  1  0.885826  0.938835  0.654501  1
  Ni  Ni283  1  0.396983  0.293650  0.621662  1
  Ni  Ni284  1  0.723473  0.055503  0.643963  1
  Ni  Ni285  1  0.069958  0.534840  0.598972  1
  Ni  Ni286  1  0.304465  0.478649  0.652359  1
  Ni  Ni287  1  0.651174  0.958499  0.606136  1
  Ni  Ni288  1  0.977556  0.720321  0.628079  1
  Ni  Ni289  1  0.315219  0.870300  0.614535  1
  Ni  Ni290  1  0.642061  0.631161  0.636894  1
  Ni  Ni291  1  0.968832  0.392969  0.658696  1
  Ni  Ni292  1  0.146212  0.294181  0.621596  1
  Ni  Ni293  1  0.473506  0.052295  0.644184  1
  Ni  Ni294  1  0.819829  0.533398  0.599512  1
  Ni  Ni295  1  0.386319  0.937719  0.654548  1
  Ni  Ni296  1  0.733115  0.415284  0.610330  1
  Ni  Ni297  1  0.059626  0.174158  0.633040  1
  Ni  Ni298  1  0.223427  0.057114  0.643753  1
  Ni  Ni299  1  0.550267  0.813531  0.666543  1
  Ni  Ni300  1  0.896764  0.294801  0.621502  1
  Ni  Ni301  1  0.151338  0.957949  0.606403  1
  Ni  Ni302  1  0.477542  0.718902  0.628411  1
  Ni  Ni303  1  0.804393  0.480378  0.651393  1
  Ni  Ni304  1  0.142118  0.631884  0.636697  1
  Ni  Ni305  1  0.468353  0.394154  0.658124  1
  Ni  Ni306  1  0.815205  0.870127  0.614690  1
  Ni  Ni307  1  0.281166  0.102749  0.730342  1
  Ni  Ni308  1  0.627049  0.573020  0.688368  1
  Ni  Ni309  1  0.956312  0.332411  0.710238  1
  Ni  Ni310  1  0.214282  0.693920  0.677804  1
  Ni  Ni311  1  0.538313  0.460062  0.698035  1
  Ni  Ni312  1  0.867524  0.219444  0.720409  1
  Ni  Ni313  1  0.375545  0.575943  0.689102  1
  Ni  Ni314  1  0.707725  0.336440  0.710022  1
  Ni  Ni315  1  0.049914  0.817428  0.666185  1
  Ni  Ni316  1  0.284585  0.765049  0.717510  1
  Ni  Ni317  1  0.631040  0.241430  0.673385  1
  Ni  Ni318  1  0.957553  0.998564  0.696686  1
  Ni  Ni319  1  0.295712  0.156515  0.680314  1
  Ni  Ni320  1  0.620826  0.930485  0.702728  1
  Ni  Ni321  1  0.949511  0.672516  0.724452  1
  Ni  Ni322  1  0.126223  0.579446  0.687853  1
  Ni  Ni323  1  0.454326  0.339777  0.708809  1
  Ni  Ni324  1  0.800133  0.815392  0.666395  1
  Ni  Ni325  1  0.371524  0.212929  0.721533  1
  Ni  Ni326  1  0.712831  0.698552  0.677191  1
  Ni  Ni327  1  0.038233  0.468742  0.697572  1
  Ni  Ni328  1  0.203448  0.342702  0.709021  1
  Ni  Ni329  1  0.532573  0.104963  0.730638  1
  Ni  Ni330  1  0.877241  0.573006  0.689325  1
  Ni  Ni331  1  0.130518  0.242412  0.673473  1
  Ni  Ni332  1  0.459818  0.996321  0.697250  1
  Ni  Ni333  1  0.783665  0.770810  0.717905  1
  Ni  Ni334  1  0.122255  0.928837  0.702948  1
  Ni  Ni335  1  0.449556  0.672200  0.724984  1
  Ni  Ni336  1  0.795470  0.156363  0.681038  1
