# generated using pymatgen
data_AlNi3
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   5.08604894
_cell_length_b   20.85403357
_cell_length_c   55.69908231
_cell_angle_alpha   90.00000000
_cell_angle_beta   90.00000000
_cell_angle_gamma   90.00000000
_symmetry_Int_Tables_number   1
_chemical_formula_structural   AlNi3
_chemical_formula_sum   'Al60 Ni180'
_cell_volume   5907.70284811
_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  0.551232  0.748957  0.299323  1
  Al  Al2  1  0.551232  0.515789  0.239913  1
  Al  Al3  1  0.551232  0.131873  0.269441  1
  Al  Al4  1  0.051232  0.624069  0.257094  1
  Al  Al5  1  0.051232  0.242267  0.287931  1
  Al  Al6  1  0.051232  0.859586  0.318304  1
  Al  Al7  1  0.051232  0.817953  0.244018  1
  Al  Al8  1  0.051232  0.433272  0.273227  1
  Al  Al9  1  0.051232  0.050758  0.302606  1
  Al  Al10  1  0.551232  0.557746  0.314752  1
  Al  Al11  1  0.551232  0.323896  0.254627  1
  Al  Al12  1  0.551232  0.940413  0.284758  1
  Al  Al13  1  0.551232  0.599809  0.390876  1
  Al  Al14  1  0.551232  0.365726  0.330189  1
  Al  Al15  1  0.551232  0.982904  0.360483  1
  Al  Al16  1  0.051232  0.476166  0.348613  1
  Al  Al17  1  0.051232  0.092885  0.378650  1
  Al  Al18  1  0.051232  0.709849  0.409012  1
  Al  Al19  1  0.051232  0.667778  0.333174  1
  Al  Al20  1  0.051232  0.284460  0.363623  1
  Al  Al21  1  0.051232  0.901418  0.393943  1
  Al  Al22  1  0.551232  0.408179  0.406087  1
  Al  Al23  1  0.551232  0.174215  0.345215  1
  Al  Al24  1  0.551232  0.791273  0.375623  1
  Al  Al25  1  0.551232  0.450419  0.481953  1
  Al  Al26  1  0.551232  0.216561  0.421214  1
  Al  Al27  1  0.551232  0.833500  0.451581  1
  Al  Al28  1  0.051232  0.326725  0.439427  1
  Al  Al29  1  0.051232  0.943645  0.469800  1
  Al  Al30  1  0.051232  0.560584  0.500166  1
  Al  Al31  1  0.051232  0.518358  0.424288  1
  Al  Al32  1  0.051232  0.135142  0.454579  1
  Al  Al33  1  0.051232  0.752079  0.484945  1
  Al  Al34  1  0.551232  0.258786  0.497092  1
  Al  Al35  1  0.551232  0.025065  0.436436  1
  Al  Al36  1  0.551232  0.642003  0.466802  1
  Al  Al37  1  0.551232  0.300978  0.572767  1
  Al  Al38  1  0.551232  0.067295  0.512368  1
  Al  Al39  1  0.551232  0.684260  0.542730  1
  Al  Al40  1  0.051232  0.177335  0.530505  1
  Al  Al41  1  0.051232  0.794241  0.560897  1
  Al  Al42  1  0.051232  0.411418  0.591192  1
  Al  Al43  1  0.051232  0.368965  0.515293  1
  Al  Al44  1  0.051232  -0.014128  0.545757  1
  Al  Al45  1  0.051232  0.602930  0.576166  1
  Al  Al46  1  0.551232  0.109366  0.588207  1
  Al  Al47  1  0.551232  0.875727  0.527438  1
  Al  Al48  1  0.551232  0.492684  0.557758  1
  Al  Al49  1  0.551232  0.153075  0.664287  1
  Al  Al50  1  0.551232  0.917558  0.603076  1
  Al  Al51  1  0.551232  0.534878  0.633450  1
  Al  Al52  1  0.051232  0.028187  0.622058  1
  Al  Al53  1  0.051232  0.645271  0.651940  1
  Al  Al54  1  0.051232  0.261356  0.681468  1
  Al  Al55  1  0.051232  0.219398  0.606629  1
  Al  Al56  1  0.051232  0.836731  0.636623  1
  Al  Al57  1  0.051232  0.453248  0.666754  1
  Al  Al58  1  0.551232  0.959191  0.677363  1
  Al  Al59  1  0.551232  0.726387  0.618775  1
  Al  Al60  1  0.551232  0.343873  0.648154  1
  Ni  Ni61  1  0.298521  0.646616  0.295585  1
  Ni  Ni62  1  0.301232  0.413035  0.235653  1
  Ni  Ni63  1  0.300423  0.029782  0.264720  1
  Ni  Ni64  1  0.051232  0.748929  0.299172  1
  Ni  Ni65  1  0.051232  0.513969  0.239774  1
  Ni  Ni66  1  0.051232  0.132094  0.269187  1
  Ni  Ni67  1  0.803942  0.646616  0.295585  1
  Ni  Ni68  1  0.801232  0.413035  0.235653  1
  Ni  Ni69  1  0.802040  0.029782  0.264720  1
  Ni  Ni70  1  0.801691  0.535647  0.277249  1
  Ni  Ni71  1  0.800384  0.152975  0.307068  1
  Ni  Ni72  1  0.801125  0.920503  0.246949  1
  Ni  Ni73  1  0.551232  0.625548  0.258692  1
  Ni  Ni74  1  0.551232  0.242618  0.288735  1
  Ni  Ni75  1  0.551232  0.859733  0.318918  1
  Ni  Ni76  1  0.300773  0.535647  0.277249  1
  Ni  Ni77  1  0.302080  0.152975  0.307068  1
  Ni  Ni78  1  0.301339  0.920503  0.246949  1
  Ni  Ni79  1  0.801915  0.727153  0.261572  1
  Ni  Ni80  1  0.800214  0.344388  0.292142  1
  Ni  Ni81  1  0.800359  0.961848  0.322349  1
  Ni  Ni82  1  0.551232  0.818180  0.244904  1
  Ni  Ni83  1  0.551232  0.434470  0.273878  1
  Ni  Ni84  1  0.551232  0.050892  0.303409  1
  Ni  Ni85  1  0.300548  0.727153  0.261572  1
  Ni  Ni86  1  0.302250  0.344388  0.292142  1
  Ni  Ni87  1  0.302104  0.961848  0.322349  1
  Ni  Ni88  1  0.300362  0.455037  0.311045  1
  Ni  Ni89  1  0.300946  0.221481  0.250348  1
  Ni  Ni90  1  0.299783  0.838850  0.281275  1
  Ni  Ni91  1  0.051232  0.557103  0.314536  1
  Ni  Ni92  1  0.051232  0.323453  0.254333  1
  Ni  Ni93  1  0.051232  0.940254  0.284517  1
  Ni  Ni94  1  0.802102  0.455037  0.311045  1
  Ni  Ni95  1  0.801517  0.221481  0.250348  1
  Ni  Ni96  1  0.802680  0.838850  0.281275  1
  Ni  Ni97  1  0.300637  0.497374  0.386595  1
  Ni  Ni98  1  0.300172  0.263387  0.325950  1
  Ni  Ni99  1  0.300530  0.880503  0.356269  1
  Ni  Ni100  1  0.051232  0.599392  0.390230  1
  Ni  Ni101  1  0.051232  0.365459  0.329622  1
  Ni  Ni102  1  0.051232  0.982448  0.359896  1
  Ni  Ni103  1  0.801827  0.497374  0.386595  1
  Ni  Ni104  1  0.802292  0.263387  0.325950  1
  Ni  Ni105  1  0.801934  0.880503  0.356269  1
  Ni  Ni106  1  0.800298  0.386940  0.367943  1
  Ni  Ni107  1  0.800414  0.003852  0.398266  1
  Ni  Ni108  1  0.800030  0.770105  0.337383  1
  Ni  Ni109  1  0.551232  0.476634  0.349107  1
  Ni  Ni110  1  0.551232  0.093287  0.379251  1
  Ni  Ni111  1  0.551232  0.710251  0.409634  1
  Ni  Ni112  1  0.302165  0.386940  0.367943  1
  Ni  Ni113  1  0.302049  0.003852  0.398266  1
  Ni  Ni114  1  0.302433  0.770105  0.337383  1
  Ni  Ni115  1  0.800018  0.578644  0.352692  1
  Ni  Ni116  1  0.800372  0.195304  0.383041  1
  Ni  Ni117  1  0.800453  0.812280  0.413407  1
  Ni  Ni118  1  0.551232  0.668214  0.333654  1
  Ni  Ni119  1  0.551232  0.284801  0.364209  1
  Ni  Ni120  1  0.551232  0.901814  0.394543  1
  Ni  Ni121  1  0.302445  0.578644  0.352692  1
  Ni  Ni122  1  0.302092  0.195304  0.383041  1
  Ni  Ni123  1  0.302010  0.812280  0.413407  1
  Ni  Ni124  1  0.300513  0.305698  0.401706  1
  Ni  Ni125  1  0.300184  0.071897  0.340854  1
  Ni  Ni126  1  0.300607  0.688882  0.371250  1
  Ni  Ni127  1  0.051232  0.407817  0.405450  1
  Ni  Ni128  1  0.051232  0.173877  0.344657  1
  Ni  Ni129  1  0.051232  0.790873  0.374990  1
  Ni  Ni130  1  0.801951  0.305698  0.401706  1
  Ni  Ni131  1  0.802280  0.071897  0.340854  1
  Ni  Ni132  1  0.801857  0.688882  0.371250  1
  Ni  Ni133  1  0.300485  0.347936  0.477564  1
  Ni  Ni134  1  0.300476  0.114114  0.416814  1
  Ni  Ni135  1  0.300458  0.731057  0.447183  1
  Ni  Ni136  1  0.051232  0.450047  0.481332  1
  Ni  Ni137  1  0.051232  0.216189  0.420585  1
  Ni  Ni138  1  0.051232  0.833128  0.450955  1
  Ni  Ni139  1  0.801978  0.347936  0.477564  1
  Ni  Ni140  1  0.801988  0.114114  0.416814  1
  Ni  Ni141  1  0.802005  0.731057  0.447183  1
  Ni  Ni142  1  0.800480  0.237593  0.458957  1
  Ni  Ni143  1  0.800500  0.854528  0.489323  1
  Ni  Ni144  1  0.800476  0.620796  0.428631  1
  Ni  Ni145  1  0.551232  0.327097  0.440049  1
  Ni  Ni146  1  0.551232  0.944017  0.470425  1
  Ni  Ni147  1  0.551232  0.560955  0.500795  1
  Ni  Ni148  1  0.301983  0.237593  0.458957  1
  Ni  Ni149  1  0.301964  0.854528  0.489323  1
  Ni  Ni150  1  0.301987  0.620796  0.428631  1
  Ni  Ni151  1  0.800485  0.429208  0.443816  1
  Ni  Ni152  1  0.800458  0.046087  0.474198  1
  Ni  Ni153  1  0.800476  0.663030  0.504567  1
  Ni  Ni154  1  0.551232  0.518736  0.424909  1
  Ni  Ni155  1  0.551232  0.135532  0.455203  1
  Ni  Ni156  1  0.551232  0.752470  0.485572  1
  Ni  Ni157  1  0.301978  0.429208  0.443816  1
  Ni  Ni158  1  0.302005  0.046087  0.474198  1
  Ni  Ni159  1  0.301988  0.663030  0.504567  1
  Ni  Ni160  1  0.300476  0.156349  0.492749  1
  Ni  Ni161  1  0.300500  0.922617  0.432058  1
  Ni  Ni162  1  0.300480  0.539552  0.462423  1
  Ni  Ni163  1  0.051232  0.258408  0.496472  1
  Ni  Ni164  1  0.051232  0.024674  0.435809  1
  Ni  Ni165  1  0.051232  0.641612  0.466178  1
  Ni  Ni166  1  0.801987  0.156349  0.492749  1
  Ni  Ni167  1  0.801964  0.922617  0.432058  1
  Ni  Ni168  1  0.801983  0.539552  0.462423  1
  Ni  Ni169  1  0.300018  0.198501  0.568689  1
  Ni  Ni170  1  0.300453  0.964864  0.507973  1
  Ni  Ni171  1  0.300372  0.581840  0.538340  1
  Ni  Ni172  1  0.051232  0.300510  0.572274  1
  Ni  Ni173  1  0.051232  0.066893  0.511746  1
  Ni  Ni174  1  0.051232  0.683857  0.542129  1
  Ni  Ni175  1  0.802445  0.198501  0.568689  1
  Ni  Ni176  1  0.802010  0.964864  0.507973  1
  Ni  Ni177  1  0.802092  0.581840  0.538340  1
  Ni  Ni178  1  0.800607  0.088263  0.550130  1
  Ni  Ni179  1  0.800184  0.705248  0.580526  1
  Ni  Ni180  1  0.800513  0.471446  0.519674  1
  Ni  Ni181  1  0.551232  0.177752  0.531150  1
  Ni  Ni182  1  0.551232  0.794697  0.561485  1
  Ni  Ni183  1  0.551232  0.411685  0.591758  1
  Ni  Ni184  1  0.301857  0.088263  0.550130  1
  Ni  Ni185  1  0.302280  0.705248  0.580526  1
  Ni  Ni186  1  0.301951  0.471446  0.519674  1
  Ni  Ni187  1  0.800637  0.279770  0.534786  1
  Ni  Ni188  1  0.800530  0.896641  0.565111  1
  Ni  Ni189  1  0.800172  0.513758  0.595430  1
  Ni  Ni190  1  0.551232  0.369328  0.515930  1
  Ni  Ni191  1  0.551232  -0.013728  0.546391  1
  Ni  Ni192  1  0.551232  0.603267  0.576724  1
  Ni  Ni193  1  0.301827  0.279770  0.534786  1
  Ni  Ni194  1  0.301934  0.896641  0.565111  1
  Ni  Ni195  1  0.302292  0.513758  0.595430  1
  Ni  Ni196  1  0.300030  0.007039  0.583998  1
  Ni  Ni197  1  0.300414  0.773292  0.523115  1
  Ni  Ni198  1  0.300298  0.390204  0.553437  1
  Ni  Ni199  1  0.051232  0.108930  0.587726  1
  Ni  Ni200  1  0.051232  0.875330  0.526837  1
  Ni  Ni201  1  0.051232  0.492343  0.557172  1
  Ni  Ni202  1  0.802433  0.007039  0.583998  1
  Ni  Ni203  1  0.802049  0.773292  0.523115  1
  Ni  Ni204  1  0.802165  0.390204  0.553437  1
  Ni  Ni205  1  0.301915  0.049991  0.659808  1
  Ni  Ni206  1  0.300359  0.815296  0.599031  1
  Ni  Ni207  1  0.300214  0.432756  0.629239  1
  Ni  Ni208  1  0.051232  0.151596  0.662688  1
  Ni  Ni209  1  0.051232  0.917412  0.602463  1
  Ni  Ni210  1  0.051232  0.534527  0.632646  1
  Ni  Ni211  1  0.800548  0.049991  0.659808  1
  Ni  Ni212  1  0.802104  0.815296  0.599031  1
  Ni  Ni213  1  0.802250  0.432756  0.629239  1
  Ni  Ni214  1  0.799783  0.938295  0.640105  1
  Ni  Ni215  1  0.800946  0.555663  0.671032  1
  Ni  Ni216  1  0.800362  0.322107  0.610336  1
  Ni  Ni217  1  0.551232  0.028215  0.622208  1
  Ni  Ni218  1  0.551232  0.645050  0.652194  1
  Ni  Ni219  1  0.551232  0.263175  0.681607  1
  Ni  Ni220  1  0.302680  0.938295  0.640105  1
  Ni  Ni221  1  0.301517  0.555663  0.671032  1
  Ni  Ni222  1  0.302102  0.322107  0.610336  1
  Ni  Ni223  1  0.798521  0.130529  0.625796  1
  Ni  Ni224  1  0.800423  0.747363  0.656660  1
  Ni  Ni225  1  0.801232  0.364109  0.685728  1
  Ni  Ni226  1  0.551232  0.220041  0.606845  1
  Ni  Ni227  1  0.551232  0.836891  0.636863  1
  Ni  Ni228  1  0.551232  0.453691  0.667048  1
  Ni  Ni229  1  0.303942  0.130529  0.625796  1
  Ni  Ni230  1  0.302040  0.747363  0.656660  1
  Ni  Ni231  1  0.301232  0.364109  0.685728  1
  Ni  Ni232  1  0.301125  0.856641  0.674431  1
  Ni  Ni233  1  0.300384  0.624170  0.614313  1
  Ni  Ni234  1  0.301691  0.241498  0.644131  1
  Ni  Ni235  1  0.051232  0.958964  0.676477  1
  Ni  Ni236  1  0.051232  0.726252  0.617972  1
  Ni  Ni237  1  0.051232  0.342674  0.647503  1
  Ni  Ni238  1  0.801339  0.856641  0.674431  1
  Ni  Ni239  1  0.802080  0.624170  0.614313  1
  Ni  Ni240  1  0.800773  0.241498  0.644131  1
