# generated using pymatgen
data_Al3Ni5
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   16.28935744
_cell_length_b   9.80214051
_cell_length_c   50.64360739
_cell_angle_alpha   90.00000000
_cell_angle_beta   90.00000000
_cell_angle_gamma   75.78844560
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Al3Ni5
_chemical_formula_sum   'Al120 Ni200'
_cell_volume   7838.81962933
_cell_formula_units_Z   40
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  0.436204  0.281996  0.293669  1
  Al  Al2  1  0.936204  0.781996  0.293669  1
  Al  Al3  1  0.900430  0.096451  0.344576  1
  Al  Al4  1  0.400430  0.596451  0.344576  1
  Al  Al5  1  0.544903  0.394372  0.333496  1
  Al  Al6  1  0.044903  0.894372  0.333496  1
  Al  Al7  1  0.099455  0.576763  0.286184  1
  Al  Al8  1  0.599455  0.076763  0.286184  1
  Al  Al9  1  0.294268  0.496053  0.306375  1
  Al  Al10  1  0.794268  0.996053  0.306375  1
  Al  Al11  1  0.751731  0.312082  0.354180  1
  Al  Al12  1  0.251731  0.812082  0.354180  1
  Al  Al13  1  0.171756  0.191933  0.320812  1
  Al  Al14  1  0.671756  0.691933  0.320812  1
  Al  Al15  1  0.716293  0.329226  0.276937  1
  Al  Al16  1  0.216293  0.829226  0.276937  1
  Al  Al17  1  0.273135  0.302595  0.355459  1
  Al  Al18  1  0.773135  0.802595  0.355459  1
  Al  Al19  1  0.820280  0.476543  0.310172  1
  Al  Al20  1  0.320280  0.976543  0.310172  1
  Al  Al21  1  0.570453  0.583237  0.285258  1
  Al  Al22  1  0.070453  0.083237  0.285258  1
  Al  Al23  1  0.026008  0.401610  0.331352  1
  Al  Al24  1  0.526008  0.901610  0.331352  1
  Al  Al25  1  0.352638  0.918207  0.388715  1
  Al  Al26  1  0.852638  0.418207  0.388715  1
  Al  Al27  1  0.806825  0.732100  0.433822  1
  Al  Al28  1  0.306825  0.232100  0.433822  1
  Al  Al29  1  0.453210  0.025153  0.423689  1
  Al  Al30  1  0.953210  0.525153  0.423689  1
  Al  Al31  1  1.000631  0.207858  0.378496  1
  Al  Al32  1  0.500631  0.707858  0.378496  1
  Al  Al33  1  0.206783  0.124853  0.398790  1
  Al  Al34  1  0.706783  0.624853  0.398790  1
  Al  Al35  1  0.659913  0.940092  0.444144  1
  Al  Al36  1  0.159913  0.440092  0.444144  1
  Al  Al37  1  0.080169  0.823348  0.411387  1
  Al  Al38  1  0.580169  0.323348  0.411387  1
  Al  Al39  1  0.625219  0.011430  0.365285  1
  Al  Al40  1  0.125219  0.511430  0.365285  1
  Al  Al41  1  0.180153  0.931492  0.446635  1
  Al  Al42  1  0.680153  0.431492  0.446635  1
  Al  Al43  1  0.726648  0.116389  0.400506  1
  Al  Al44  1  0.226648  0.616389  0.400506  1
  Al  Al45  1  0.479498  0.217319  0.375061  1
  Al  Al46  1  0.979498  0.717319  0.375061  1
  Al  Al47  1  0.933142  0.033016  0.421711  1
  Al  Al48  1  0.433142  0.533016  0.421711  1
  Al  Al49  1  0.260176  0.546600  0.479263  1
  Al  Al50  1  0.760176  0.046600  0.479263  1
  Al  Al51  1  0.713325  0.361497  0.525041  1
  Al  Al52  1  0.213325  0.861497  0.525041  1
  Al  Al53  1  0.360287  0.653485  0.514633  1
  Al  Al54  1  0.860287  0.153485  0.514633  1
  Al  Al55  1  0.906899  0.838788  0.468774  1
  Al  Al56  1  0.406899  0.338788  0.468774  1
  Al  Al57  1  0.113265  0.754596  0.489727  1
  Al  Al58  1  0.613265  0.254596  0.489727  1
  Al  Al59  1  0.566735  0.569018  0.535437  1
  Al  Al60  1  0.066735  0.069018  0.535437  1
  Al  Al61  1  0.986807  0.453912  0.502158  1
  Al  Al62  1  0.486807  0.953912  0.502158  1
  Al  Al63  1  0.533386  0.639842  0.456812  1
  Al  Al64  1  0.033386  0.139842  0.456812  1
  Al  Al65  1  0.086965  0.560882  0.537104  1
  Al  Al66  1  0.586965  0.060882  0.537104  1
  Al  Al67  1  0.633584  0.746428  0.491800  1
  Al  Al68  1  0.133584  0.246428  0.491800  1
  Al  Al69  1  0.386644  0.847066  0.467194  1
  Al  Al70  1  0.886644  0.347066  0.467194  1
  Al  Al71  1  0.839966  0.661872  0.512455  1
  Al  Al72  1  0.339966  0.161872  0.512455  1
  Al  Al73  1  0.166892  0.175637  0.570442  1
  Al  Al74  1  0.666892  0.675637  0.570442  1
  Al  Al75  1  0.620248  0.991906  0.615313  1
  Al  Al76  1  0.120248  0.491906  0.615313  1
  Al  Al77  1  0.266780  0.282638  0.605328  1
  Al  Al78  1  0.766780  0.782638  0.605328  1
  Al  Al79  1  0.813567  0.468084  0.560126  1
  Al  Al80  1  0.313567  0.968084  0.560126  1
  Al  Al81  1  0.020198  0.383645  0.580562  1
  Al  Al82  1  0.520198  0.883645  0.580562  1
  Al  Al83  1  0.473353  0.198953  0.625894  1
  Al  Al84  1  0.973353  0.698953  0.625894  1
  Al  Al85  1  0.893763  0.083501  0.593078  1
  Al  Al86  1  0.393763  0.583501  0.593078  1
  Al  Al87  1  0.439990  0.268882  0.547539  1
  Al  Al88  1  0.939990  0.768882  0.547539  1
  Al  Al89  1  0.994452  0.189437  0.628878  1
  Al  Al90  1  0.494452  0.689437  0.628878  1
  Al  Al91  1  0.540150  0.375533  0.582883  1
  Al  Al92  1  0.040150  0.875533  0.582883  1
  Al  Al93  1  0.293433  0.476646  0.557925  1
  Al  Al94  1  0.793433  0.976646  0.557925  1
  Al  Al95  1  0.746933  0.290742  0.603560  1
  Al  Al96  1  0.246933  0.790742  0.603560  1
  Al  Al97  1  0.075153  0.808006  0.660849  1
  Al  Al98  1  0.575153  0.308006  0.660849  1
  Al  Al99  1  0.531869  0.625179  0.709544  1
  Al  Al100  1  0.031869  0.125179  0.709544  1
  Al  Al101  1  0.179479  0.913456  0.697785  1
  Al  Al102  1  0.679479  0.413456  0.697785  1
  Al  Al103  1  0.721207  0.098246  0.651028  1
  Al  Al104  1  0.221207  0.598246  0.651028  1
  Al  Al105  1  0.927478  0.014384  0.671435  1
  Al  Al106  1  0.427478  0.514384  0.671435  1
  Al  Al107  1  0.374059  0.831707  0.716860  1
  Al  Al108  1  0.874059  0.331707  0.716860  1
  Al  Al109  1  0.802065  0.722657  0.681586  1
  Al  Al110  1  0.302065  0.222657  0.681586  1
  Al  Al111  1  0.348078  0.896023  0.638713  1
  Al  Al112  1  0.848078  0.396023  0.638713  1
  Al  Al113  1  0.903535  0.819386  0.718763  1
  Al  Al114  1  0.403535  0.319386  0.718763  1
  Al  Al115  1  0.447787  0.006889  0.672782  1
  Al  Al116  1  0.947787  0.506889  0.672782  1
  Al  Al117  1  0.199458  0.108245  0.648908  1
  Al  Al118  1  0.699458  0.608245  0.648908  1
  Al  Al119  1  0.652330  0.926835  0.693831  1
  Al  Al120  1  0.152330  0.426835  0.693831  1
  Ni  Ni121  1  0.401197  0.098502  0.343042  1
  Ni  Ni122  1  0.901197  0.598502  0.343042  1
  Ni  Ni123  1  0.944197  0.284334  0.297769  1
  Ni  Ni124  1  0.444197  0.784334  0.297769  1
  Ni  Ni125  1  0.263908  0.056349  0.354071  1
  Ni  Ni126  1  0.763908  0.556349  0.354071  1
  Ni  Ni127  1  0.811487  0.232762  0.311847  1
  Ni  Ni128  1  0.311487  0.732762  0.311847  1
  Ni  Ni129  1  0.571781  0.334336  0.287755  1
  Ni  Ni130  1  0.071781  0.834336  0.287755  1
  Ni  Ni131  1  0.035478  0.147047  0.331922  1
  Ni  Ni132  1  0.535478  0.647047  0.331922  1
  Ni  Ni133  1  0.440010  0.527657  0.300301  1
  Ni  Ni134  1  0.940010  0.027657  0.300301  1
  Ni  Ni135  1  0.898353  0.340755  0.345778  1
  Ni  Ni136  1  0.398353  0.840755  0.345778  1
  Ni  Ni137  1  0.400513  0.357025  0.339363  1
  Ni  Ni138  1  0.900513  0.857025  0.339363  1
  Ni  Ni139  1  0.950477  0.536301  0.295178  1
  Ni  Ni140  1  0.450477  0.036301  0.295178  1
  Ni  Ni141  1  0.222348  0.365609  0.276214  1
  Ni  Ni142  1  0.722348  0.865609  0.276214  1
  Ni  Ni143  1  0.671860  0.196313  0.319895  1
  Ni  Ni144  1  0.171860  0.696313  0.319895  1
  Ni  Ni145  1  0.534726  0.151519  0.329600  1
  Ni  Ni146  1  0.034726  0.651519  0.329600  1
  Ni  Ni147  1  0.082631  0.329231  0.286782  1
  Ni  Ni148  1  0.582631  0.829231  0.286782  1
  Ni  Ni149  1  0.308394  0.229344  0.309928  1
  Ni  Ni150  1  0.808394  0.729344  0.309928  1
  Ni  Ni151  1  0.762385  0.057303  0.353506  1
  Ni  Ni152  1  0.262385  0.557303  0.353506  1
  Ni  Ni153  1  0.169640  0.435055  0.322574  1
  Ni  Ni154  1  0.669640  0.935055  0.322574  1
  Ni  Ni155  1  0.717406  0.605142  0.277829  1
  Ni  Ni156  1  0.217406  0.105142  0.277829  1
  Ni  Ni157  1  0.128477  0.267984  0.364058  1
  Ni  Ni158  1  0.628477  0.767984  0.364058  1
  Ni  Ni159  1  0.674050  0.450184  0.318256  1
  Ni  Ni160  1  0.174050  0.950184  0.318256  1
  Ni  Ni161  1  0.306702  0.731829  0.434191  1
  Ni  Ni162  1  0.806702  0.231829  0.434191  1
  Ni  Ni163  1  0.853163  0.918834  0.387536  1
  Ni  Ni164  1  0.353163  0.418834  0.387536  1
  Ni  Ni165  1  0.170226  0.685497  0.445216  1
  Ni  Ni166  1  0.670226  0.185497  0.445216  1
  Ni  Ni167  1  0.716536  0.871367  0.399677  1
  Ni  Ni168  1  0.216536  0.371367  0.399677  1
  Ni  Ni169  1  0.489575  0.962141  0.377636  1
  Ni  Ni170  1  0.989575  0.462141  0.377636  1
  Ni  Ni171  1  0.943143  0.779682  0.421856  1
  Ni  Ni172  1  0.443143  0.279682  0.421856  1
  Ni  Ni173  1  0.351446  0.160198  0.390223  1
  Ni  Ni174  1  0.851446  0.660198  0.390223  1
  Ni  Ni175  1  0.804738  0.974350  0.435518  1
  Ni  Ni176  1  0.304738  0.474350  0.435518  1
  Ni  Ni177  1  0.308511  0.989809  0.432239  1
  Ni  Ni178  1  0.808511  0.489809  0.432239  1
  Ni  Ni179  1  0.854919  0.176012  0.387039  1
  Ni  Ni180  1  0.354919  0.676012  0.387039  1
  Ni  Ni181  1  0.126998  0.010348  0.365846  1
  Ni  Ni182  1  0.626998  0.510348  0.365846  1
  Ni  Ni183  1  0.580221  0.824084  0.411443  1
  Ni  Ni184  1  0.080221  0.324084  0.411443  1
  Ni  Ni185  1  0.443302  0.779037  0.422721  1
  Ni  Ni186  1  0.943302  0.279037  0.422721  1
  Ni  Ni187  1  0.990743  0.961410  0.377783  1
  Ni  Ni188  1  0.490743  0.461410  0.377783  1
  Ni  Ni189  1  0.216132  0.870682  0.400323  1
  Ni  Ni190  1  0.716132  0.370682  0.400323  1
  Ni  Ni191  1  0.670292  0.685546  0.445395  1
  Ni  Ni192  1  0.170292  0.185546  0.445395  1
  Ni  Ni193  1  0.078393  0.066135  0.413409  1
  Ni  Ni194  1  0.578393  0.566135  0.413409  1
  Ni  Ni195  1  0.624182  0.251626  0.367591  1
  Ni  Ni196  1  0.124182  0.751626  0.367591  1
  Ni  Ni197  1  0.035337  0.897514  0.454805  1
  Ni  Ni198  1  0.535337  0.397514  0.454805  1
  Ni  Ni199  1  0.581672  0.082151  0.408959  1
  Ni  Ni200  1  0.081672  0.582151  0.408959  1
  Ni  Ni201  1  0.213501  0.361724  0.524700  1
  Ni  Ni202  1  0.713501  0.861724  0.524700  1
  Ni  Ni203  1  0.760063  0.546550  0.479570  1
  Ni  Ni204  1  0.260063  0.046550  0.479570  1
  Ni  Ni205  1  0.076948  0.314869  0.536224  1
  Ni  Ni206  1  0.576948  0.814869  0.536224  1
  Ni  Ni207  1  0.623321  0.500475  0.490961  1
  Ni  Ni208  1  0.123321  1.000475  0.490961  1
  Ni  Ni209  1  0.396817  0.592784  0.468188  1
  Ni  Ni210  1  0.896817  0.092784  0.468188  1
  Ni  Ni211  1  0.850125  0.407505  0.513674  1
  Ni  Ni212  1  0.350125  0.907505  0.513674  1
  Ni  Ni213  1  0.258110  0.788779  0.481509  1
  Ni  Ni214  1  0.758110  0.288779  0.481509  1
  Ni  Ni215  1  0.711467  0.603815  0.526859  1
  Ni  Ni216  1  0.211467  0.103815  0.526859  1
  Ni  Ni217  1  0.215492  0.619208  0.522906  1
  Ni  Ni218  1  0.715492  0.119208  0.522906  1
  Ni  Ni219  1  0.762127  0.804373  0.477392  1
  Ni  Ni220  1  0.262127  0.304373  0.477392  1
  Ni  Ni221  1  0.033170  0.640390  0.456336  1
  Ni  Ni222  1  0.533170  0.140390  0.456336  1
  Ni  Ni223  1  0.486836  0.453774  0.502227  1
  Ni  Ni224  1  0.986836  0.953774  0.502227  1
  Ni  Ni225  1  0.350181  0.407791  0.513368  1
  Ni  Ni226  1  0.850181  0.907791  0.513368  1
  Ni  Ni227  1  0.896686  0.592997  0.468092  1
  Ni  Ni228  1  0.396686  0.092997  0.468092  1
  Ni  Ni229  1  0.123324  0.500865  0.490568  1
  Ni  Ni230  1  0.623324  1.000865  0.490568  1
  Ni  Ni231  1  0.576800  0.314745  0.536352  1
  Ni  Ni232  1  0.076800  0.814745  0.536352  1
  Ni  Ni233  1  0.984721  0.696413  0.503913  1
  Ni  Ni234  1  0.484721  0.196413  0.503913  1
  Ni  Ni235  1  0.531408  0.882213  0.458613  1
  Ni  Ni236  1  0.031408  0.382213  0.458613  1
  Ni  Ni237  1  0.942086  0.526335  0.545628  1
  Ni  Ni238  1  0.442086  0.026335  0.545628  1
  Ni  Ni239  1  0.488823  0.711530  0.500389  1
  Ni  Ni240  1  0.988823  0.211530  0.500389  1
  Ni  Ni241  1  0.119614  0.990754  0.616331  1
  Ni  Ni242  1  0.619614  0.490754  0.616331  1
  Ni  Ni243  1  0.667043  0.175518  0.570434  1
  Ni  Ni244  1  0.167043  0.675518  0.570434  1
  Ni  Ni245  1  0.982859  0.944258  0.627375  1
  Ni  Ni246  1  0.482859  0.444258  0.627375  1
  Ni  Ni247  1  0.530073  0.130036  0.581465  1
  Ni  Ni248  1  0.030073  0.630036  0.581465  1
  Ni  Ni249  1  0.303377  0.222584  0.558839  1
  Ni  Ni250  1  0.803377  0.722584  0.558839  1
  Ni  Ni251  1  0.757375  0.036232  0.604629  1
  Ni  Ni252  1  0.257375  0.536232  0.604629  1
  Ni  Ni253  1  0.165029  0.418056  0.572025  1
  Ni  Ni254  1  0.665029  0.918056  0.572025  1
  Ni  Ni255  1  0.618600  0.233090  0.617701  1
  Ni  Ni256  1  0.118600  0.733090  0.617701  1
  Ni  Ni257  1  0.121907  0.249008  0.613927  1
  Ni  Ni258  1  0.621907  0.749008  0.613927  1
  Ni  Ni259  1  0.668692  0.433426  0.568698  1
  Ni  Ni260  1  0.168692  0.933426  0.568698  1
  Ni  Ni261  1  0.940297  0.268316  0.547780  1
  Ni  Ni262  1  0.440297  0.768316  0.547780  1
  Ni  Ni263  1  0.393534  0.083204  0.592823  1
  Ni  Ni264  1  0.893534  0.583204  0.592823  1
  Ni  Ni265  1  0.256696  0.036077  0.604651  1
  Ni  Ni266  1  0.756696  0.536077  0.604651  1
  Ni  Ni267  1  0.803504  0.222416  0.559048  1
  Ni  Ni268  1  0.303504  0.722416  0.559048  1
  Ni  Ni269  1  0.030312  0.129440  0.582038  1
  Ni  Ni270  1  0.530312  0.629440  0.582038  1
  Ni  Ni271  1  0.484378  0.944002  0.626868  1
  Ni  Ni272  1  0.984378  0.444002  0.626868  1
  Ni  Ni273  1  0.891963  0.325228  0.595162  1
  Ni  Ni274  1  0.391963  0.825228  0.595162  1
  Ni  Ni275  1  0.438238  0.510843  0.549584  1
  Ni  Ni276  1  0.938238  0.010843  0.549584  1
  Ni  Ni277  1  0.849504  0.155375  0.636487  1
  Ni  Ni278  1  0.349504  0.655375  0.636487  1
  Ni  Ni279  1  0.395114  0.341406  0.591248  1
  Ni  Ni280  1  0.895114  0.841406  0.591248  1
  Ni  Ni281  1  0.027962  0.620873  0.706394  1
  Ni  Ni282  1  0.527962  0.120873  0.706394  1
  Ni  Ni283  1  0.574020  0.806209  0.661701  1
  Ni  Ni284  1  0.074020  0.306209  0.661701  1
  Ni  Ni285  1  0.885540  0.577449  0.716802  1
  Ni  Ni286  1  0.385540  0.077449  0.716802  1
  Ni  Ni287  1  0.439189  0.758131  0.673502  1
  Ni  Ni288  1  0.939189  0.258131  0.673502  1
  Ni  Ni289  1  0.210467  0.854364  0.649932  1
  Ni  Ni290  1  0.710467  0.354364  0.649932  1
  Ni  Ni291  1  0.667588  0.670523  0.696085  1
  Ni  Ni292  1  0.167588  0.170523  0.696085  1
  Ni  Ni293  1  0.072601  0.049181  0.664634  1
  Ni  Ni294  1  0.572601  0.549181  0.664634  1
  Ni  Ni295  1  0.521790  0.869893  0.708930  1
  Ni  Ni296  1  0.021790  0.369893  0.708930  1
  Ni  Ni297  1  0.032344  0.879125  0.704441  1
  Ni  Ni298  1  0.532344  0.379125  0.704441  1
  Ni  Ni299  1  0.575731  0.066085  0.658651  1
  Ni  Ni300  1  0.075731  0.566085  0.658651  1
  Ni  Ni301  1  0.845921  0.897257  0.639257  1
  Ni  Ni302  1  0.345921  0.397257  0.639257  1
  Ni  Ni303  1  0.301625  0.716753  0.683038  1
  Ni  Ni304  1  0.801625  0.216753  0.683038  1
  Ni  Ni305  1  0.165193  0.669664  0.695509  1
  Ni  Ni306  1  0.665193  0.169664  0.695509  1
  Ni  Ni307  1  0.708581  0.855311  0.649361  1
  Ni  Ni308  1  0.208581  0.355311  0.649361  1
  Ni  Ni309  1  0.939395  0.761332  0.672155  1
  Ni  Ni310  1  0.439395  0.261332  0.672155  1
  Ni  Ni311  1  0.392387  0.572706  0.717337  1
  Ni  Ni312  1  0.892387  0.072706  0.717337  1
  Ni  Ni313  1  0.797132  0.962416  0.687776  1
  Ni  Ni314  1  0.297132  0.462416  0.687776  1
  Ni  Ni315  1  0.345322  0.138980  0.639720  1
  Ni  Ni316  1  0.845322  0.638980  0.639720  1
  Ni  Ni317  1  0.756824  0.791457  0.725466  1
  Ni  Ni318  1  0.256824  0.291457  0.725466  1
  Ni  Ni319  1  0.303122  0.977296  0.681166  1
  Ni  Ni320  1  0.803122  0.477296  0.681166  1
