# generated using pymatgen
data_Al3Ni5
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   8.02875984
_cell_length_b   17.36112240
_cell_length_c   50.72458053
_cell_angle_alpha   90.00000000
_cell_angle_beta   90.00000000
_cell_angle_gamma   90.00000000
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Al3Ni5
_chemical_formula_sum   'Al108 Ni180'
_cell_volume   7070.41214809
_cell_formula_units_Z   36
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  0.498547  0.867342  0.292207  1
  Al  Al2  1  0.498547  0.554645  0.320101  1
  Al  Al3  1  0.498547  0.176072  0.268585  1
  Al  Al4  1  0.759729  0.894813  0.332818  1
  Al  Al5  1  0.748884  0.525562  0.280494  1
  Al  Al6  1  0.759233  0.210047  0.305544  1
  Al  Al7  1  0.237364  0.894813  0.332818  1
  Al  Al8  1  0.248209  0.525562  0.280494  1
  Al  Al9  1  0.237860  0.210047  0.305544  1
  Al  Al10  1  -0.001453  0.714432  0.304999  1
  Al  Al11  1  -0.001453  0.396881  0.332395  1
  Al  Al12  1  -0.001453  0.021176  0.279721  1
  Al  Al13  1  0.258724  0.736807  0.344615  1
  Al  Al14  1  0.254018  0.367378  0.292289  1
  Al  Al15  1  0.260514  0.051776  0.320327  1
  Al  Al16  1  0.738369  0.736807  0.344615  1
  Al  Al17  1  0.743075  0.367378  0.292289  1
  Al  Al18  1  0.736579  0.051776  0.320327  1
  Al  Al19  1  0.498547  0.920993  0.371271  1
  Al  Al20  1  0.498547  0.604498  0.396702  1
  Al  Al21  1  0.498547  0.238606  0.344991  1
  Al  Al22  1  0.757189  0.947537  0.409366  1
  Al  Al23  1  0.758160  0.579431  0.356591  1
  Al  Al24  1  0.756853  0.263788  0.383027  1
  Al  Al25  1  0.239904  0.947537  0.409366  1
  Al  Al26  1  0.238933  0.579431  0.356591  1
  Al  Al27  1  0.240240  0.263788  0.383027  1
  Al  Al28  1  -0.001453  0.761999  0.383676  1
  Al  Al29  1  -0.001453  0.447161  0.409158  1
  Al  Al30  1  -0.001453  0.079620  0.358137  1
  Al  Al31  1  0.256925  0.789464  0.421993  1
  Al  Al32  1  0.257152  0.421089  0.369926  1
  Al  Al33  1  0.257062  0.106133  0.396196  1
  Al  Al34  1  0.740168  0.789464  0.421993  1
  Al  Al35  1  0.739941  0.421089  0.369926  1
  Al  Al36  1  0.740031  0.106133  0.396196  1
  Al  Al37  1  0.498547  0.974751  0.447830  1
  Al  Al38  1  0.498547  0.659114  0.473533  1
  Al  Al39  1  0.498547  0.289938  0.422093  1
  Al  Al40  1  0.757070  1.001197  0.486125  1
  Al  Al41  1  0.756755  0.631946  0.434593  1
  Al  Al42  1  0.756919  0.316899  0.460323  1
  Al  Al43  1  0.240023  1.001197  0.486125  1
  Al  Al44  1  0.240338  0.631946  0.434593  1
  Al  Al45  1  0.240174  0.316899  0.460323  1
  Al  Al46  1  -0.001453  0.816640  0.460588  1
  Al  Al47  1  -0.001453  0.501433  0.486120  1
  Al  Al48  1  -0.001453  0.132519  0.434802  1
  Al  Al49  1  0.257086  0.843064  0.499026  1
  Al  Al50  1  0.256705  0.474541  0.447325  1
  Al  Al51  1  0.256995  0.159134  0.473241  1
  Al  Al52  1  0.740007  0.843064  0.499026  1
  Al  Al53  1  0.740388  0.474541  0.447325  1
  Al  Al54  1  0.740098  0.159134  0.473241  1
  Al  Al55  1  0.498547  0.027665  0.524792  1
  Al  Al56  1  0.498547  0.711514  0.550668  1
  Al  Al57  1  0.498547  0.343631  0.499058  1
  Al  Al58  1  0.756762  0.054541  0.563241  1
  Al  Al59  1  0.757025  0.685086  0.511855  1
  Al  Al60  1  0.757047  0.369753  0.537535  1
  Al  Al61  1  0.240331  0.054541  0.563241  1
  Al  Al62  1  0.240068  0.685086  0.511855  1
  Al  Al63  1  0.240046  0.369753  0.537535  1
  Al  Al64  1  -0.001453  0.869592  0.537509  1
  Al  Al65  1  -0.001453  0.553765  0.563394  1
  Al  Al66  1  -0.001453  0.185488  0.511855  1
  Al  Al67  1  0.256948  0.896697  0.575842  1
  Al  Al68  1  0.257010  0.527352  0.524667  1
  Al  Al69  1  0.256983  0.212139  0.550474  1
  Al  Al70  1  0.740145  0.896697  0.575842  1
  Al  Al71  1  0.740083  0.527352  0.524667  1
  Al  Al72  1  0.740110  0.212139  0.550474  1
  Al  Al73  1  0.498547  0.081277  0.601872  1
  Al  Al74  1  0.498547  0.766642  0.627345  1
  Al  Al75  1  0.498547  0.396612  0.576284  1
  Al  Al76  1  0.757649  0.107304  0.640689  1
  Al  Al77  1  0.757344  0.738364  0.588703  1
  Al  Al78  1  0.756690  0.422827  0.614850  1
  Al  Al79  1  0.239444  0.107304  0.640689  1
  Al  Al80  1  0.239749  0.738364  0.588703  1
  Al  Al81  1  0.240403  0.422827  0.614850  1
  Al  Al82  1  -0.001453  0.924573  0.614224  1
  Al  Al83  1  -0.001453  0.605791  0.640945  1
  Al  Al84  1  -0.001453  0.239244  0.588913  1
  Al  Al85  1  0.258341  0.949499  0.652976  1
  Al  Al86  1  0.256989  0.580113  0.601715  1
  Al  Al87  1  0.256967  0.265425  0.627783  1
  Al  Al88  1  0.738752  0.949499  0.652976  1
  Al  Al89  1  0.740104  0.580113  0.601715  1
  Al  Al90  1  0.740126  0.265425  0.627783  1
  Al  Al91  1  0.498547  0.133164  0.678089  1
  Al  Al92  1  0.498547  0.821290  0.707453  1
  Al  Al93  1  0.498547  0.449977  0.653566  1
  Al  Al94  1  0.755163  0.160426  0.717445  1
  Al  Al95  1  0.759841  0.790986  0.664800  1
  Al  Al96  1  0.756850  0.475294  0.691674  1
  Al  Al97  1  0.241930  0.160426  0.717445  1
  Al  Al98  1  0.237252  0.790986  0.664800  1
  Al  Al99  1  0.240243  0.475294  0.691674  1
  Al  Al100  1  -0.001453  0.971760  0.692430  1
  Al  Al101  1  -0.001453  0.669440  0.718456  1
  Al  Al102  1  -0.001453  0.290988  0.665557  1
  Al  Al103  1  0.264238  0.998023  0.728499  1
  Al  Al104  1  0.261305  0.634427  0.677602  1
  Al  Al105  1  0.254441  0.318298  0.704964  1
  Al  Al106  1  0.732855  0.998023  0.728499  1
  Al  Al107  1  0.735788  0.634427  0.677602  1
  Al  Al108  1  0.742652  0.318298  0.704964  1
  Ni  Ni109  1  0.498547  0.714090  0.309078  1
  Ni  Ni110  1  0.498547  0.393200  0.332705  1
  Ni  Ni111  1  0.498547  0.025193  0.283321  1
  Ni  Ni112  1  0.246586  0.633476  0.311368  1
  Ni  Ni113  1  0.246385  0.315623  0.337676  1
  Ni  Ni114  1  0.249188  0.946750  0.288510  1
  Ni  Ni115  1  0.750507  0.633476  0.311368  1
  Ni  Ni116  1  0.750709  0.315623  0.337676  1
  Ni  Ni117  1  0.747905  0.946750  0.288510  1
  Ni  Ni118  1  0.498547  0.609859  0.277145  1
  Ni  Ni119  1  0.498547  0.287039  0.300371  1
  Ni  Ni120  1  0.498547  0.968356  0.326624  1
  Ni  Ni121  1  0.498547  0.820773  0.338627  1
  Ni  Ni122  1  0.498547  0.448473  0.289011  1
  Ni  Ni123  1  0.498547  0.134826  0.313630  1
  Ni  Ni124  1  -0.001453  0.869601  0.295612  1
  Ni  Ni125  1  -0.001453  0.551730  0.320514  1
  Ni  Ni126  1  -0.001453  0.180465  0.271155  1
  Ni  Ni127  1  0.747042  0.790788  0.300311  1
  Ni  Ni128  1  0.746086  0.472775  0.325020  1
  Ni  Ni129  1  0.749281  0.098943  0.275993  1
  Ni  Ni130  1  0.250051  0.790788  0.300311  1
  Ni  Ni131  1  0.251007  0.472775  0.325020  1
  Ni  Ni132  1  0.247812  0.098943  0.275993  1
  Ni  Ni133  1  -0.001453  0.812793  0.339488  1
  Ni  Ni134  1  -0.001453  0.447805  0.288314  1
  Ni  Ni135  1  -0.001453  0.125149  0.313708  1
  Ni  Ni136  1  -0.001453  0.602017  0.277088  1
  Ni  Ni137  1  -0.001453  0.293838  0.300702  1
  Ni  Ni138  1  -0.001453  0.977387  0.325884  1
  Ni  Ni139  1  0.498547  0.764545  0.383672  1
  Ni  Ni140  1  0.498547  0.449212  0.409152  1
  Ni  Ni141  1  0.498547  0.078423  0.357985  1
  Ni  Ni142  1  0.250563  0.684018  0.389457  1
  Ni  Ni143  1  0.249683  0.369105  0.415160  1
  Ni  Ni144  1  0.248304  0.999857  0.364706  1
  Ni  Ni145  1  0.746530  0.684018  0.389457  1
  Ni  Ni146  1  0.747410  0.369105  0.415160  1
  Ni  Ni147  1  0.748789  0.999857  0.364706  1
  Ni  Ni148  1  0.498547  0.656251  0.352675  1
  Ni  Ni149  1  0.498547  0.341122  0.377632  1
  Ni  Ni150  1  0.498547  0.025177  0.403112  1
  Ni  Ni151  1  0.498547  0.870580  0.415901  1
  Ni  Ni152  1  0.498547  0.502466  0.363976  1
  Ni  Ni153  1  0.498547  0.186860  0.389609  1
  Ni  Ni154  1  -0.001453  0.921256  0.370755  1
  Ni  Ni155  1  -0.001453  0.607275  0.395935  1
  Ni  Ni156  1  -0.001453  0.235830  0.344884  1
  Ni  Ni157  1  0.749594  0.841657  0.377167  1
  Ni  Ni158  1  0.750561  0.526859  0.402023  1
  Ni  Ni159  1  0.747516  0.158708  0.350946  1
  Ni  Ni160  1  0.247499  0.841657  0.377167  1
  Ni  Ni161  1  0.246532  0.526859  0.402023  1
  Ni  Ni162  1  0.249577  0.158708  0.350946  1
  Ni  Ni163  1  -0.001453  0.866422  0.415737  1
  Ni  Ni164  1  -0.001453  0.498889  0.364855  1
  Ni  Ni165  1  -0.001453  0.183463  0.390138  1
  Ni  Ni166  1  -0.001453  0.661695  0.350291  1
  Ni  Ni167  1  -0.001453  0.344208  0.376631  1
  Ni  Ni168  1  -0.001453  0.028676  0.402673  1
  Ni  Ni169  1  0.498547  0.816051  0.460811  1
  Ni  Ni170  1  0.498547  0.500765  0.486422  1
  Ni  Ni171  1  0.498547  0.132875  0.434857  1
  Ni  Ni172  1  0.247961  0.737297  0.466903  1
  Ni  Ni173  1  0.248107  0.422189  0.492450  1
  Ni  Ni174  1  0.248510  0.053603  0.441189  1
  Ni  Ni175  1  0.749132  0.737297  0.466903  1
  Ni  Ni176  1  0.748986  0.422189  0.492450  1
  Ni  Ni177  1  0.748583  0.053603  0.441189  1
  Ni  Ni178  1  0.498547  0.709049  0.428664  1
  Ni  Ni179  1  0.498547  0.394109  0.454194  1
  Ni  Ni180  1  0.498547  0.078450  0.480004  1
  Ni  Ni181  1  0.498547  0.924076  0.492525  1
  Ni  Ni182  1  0.498547  0.555274  0.441499  1
  Ni  Ni183  1  0.498547  0.239966  0.466862  1
  Ni  Ni184  1  -0.001453  0.974192  0.447678  1
  Ni  Ni185  1  -0.001453  0.658172  0.473465  1
  Ni  Ni186  1  -0.001453  0.290947  0.421893  1
  Ni  Ni187  1  0.748101  0.895217  0.454151  1
  Ni  Ni188  1  0.747924  0.579695  0.479629  1
  Ni  Ni189  1  0.749089  0.211563  0.428193  1
  Ni  Ni190  1  0.248992  0.895217  0.454151  1
  Ni  Ni191  1  0.249169  0.579695  0.479629  1
  Ni  Ni192  1  0.248004  0.211563  0.428193  1
  Ni  Ni193  1  -0.001453  0.920332  0.492793  1
  Ni  Ni194  1  -0.001453  0.551613  0.441144  1
  Ni  Ni195  1  -0.001453  0.236215  0.467019  1
  Ni  Ni196  1  -0.001453  0.712673  0.428507  1
  Ni  Ni197  1  -0.001453  0.397660  0.453995  1
  Ni  Ni198  1  -0.001453  0.082020  0.479507  1
  Ni  Ni199  1  0.498547  0.870352  0.537629  1
  Ni  Ni200  1  0.498547  0.554146  0.563567  1
  Ni  Ni201  1  0.498547  0.185798  0.511927  1
  Ni  Ni202  1  0.248947  0.790735  0.543883  1
  Ni  Ni203  1  0.248524  0.474904  0.569673  1
  Ni  Ni204  1  0.248912  0.106799  0.518245  1
  Ni  Ni205  1  0.748147  0.790735  0.543883  1
  Ni  Ni206  1  0.748569  0.474904  0.569673  1
  Ni  Ni207  1  0.748181  0.106799  0.518245  1
  Ni  Ni208  1  0.498547  0.762367  0.505929  1
  Ni  Ni209  1  0.498547  0.446860  0.531507  1
  Ni  Ni210  1  0.498547  0.131465  0.556986  1
  Ni  Ni211  1  0.498547  0.977475  0.569723  1
  Ni  Ni212  1  0.498547  0.608200  0.518324  1
  Ni  Ni213  1  0.498547  0.293006  0.543904  1
  Ni  Ni214  1  -0.001453  0.028233  0.524571  1
  Ni  Ni215  1  -0.001453  0.711927  0.550560  1
  Ni  Ni216  1  -0.001453  0.343248  0.499029  1
  Ni  Ni217  1  0.749065  0.949003  0.531018  1
  Ni  Ni218  1  0.748837  0.632626  0.556761  1
  Ni  Ni219  1  0.748500  0.264465  0.505389  1
  Ni  Ni220  1  0.248028  0.949003  0.531018  1
  Ni  Ni221  1  0.248256  0.632626  0.556761  1
  Ni  Ni222  1  0.248593  0.264465  0.505389  1
  Ni  Ni223  1  -0.001453  0.973895  0.569478  1
  Ni  Ni224  1  -0.001453  0.604471  0.518629  1
  Ni  Ni225  1  -0.001453  0.289086  0.544102  1
  Ni  Ni226  1  -0.001453  0.765871  0.505333  1
  Ni  Ni227  1  -0.001453  0.450526  0.530959  1
  Ni  Ni228  1  -0.001453  0.135126  0.556772  1
  Ni  Ni229  1  0.498547  0.922242  0.615043  1
  Ni  Ni230  1  0.498547  0.607270  0.641288  1
  Ni  Ni231  1  0.498547  0.238622  0.588987  1
  Ni  Ni232  1  0.246705  0.844536  0.620507  1
  Ni  Ni233  1  0.249288  0.527789  0.646712  1
  Ni  Ni234  1  0.247773  0.159834  0.595596  1
  Ni  Ni235  1  0.750388  0.844536  0.620507  1
  Ni  Ni236  1  0.747805  0.527789  0.646712  1
  Ni  Ni237  1  0.749320  0.159834  0.595596  1
  Ni  Ni238  1  0.498547  0.815939  0.582601  1
  Ni  Ni239  1  0.498547  0.500107  0.608829  1
  Ni  Ni240  1  0.498547  0.184594  0.633921  1
  Ni  Ni241  1  0.498547  0.029771  0.646718  1
  Ni  Ni242  1  0.498547  0.661433  0.595690  1
  Ni  Ni243  1  0.498547  0.346203  0.621021  1
  Ni  Ni244  1  -0.001453  0.079929  0.601984  1
  Ni  Ni245  1  -0.001453  0.764512  0.627401  1
  Ni  Ni246  1  -0.001453  0.396268  0.576157  1
  Ni  Ni247  1  0.747020  1.002128  0.608159  1
  Ni  Ni248  1  0.748204  0.685611  0.633300  1
  Ni  Ni249  1  0.748171  0.317615  0.582631  1
  Ni  Ni250  1  0.250073  1.002128  0.608159  1
  Ni  Ni251  1  0.248889  0.685611  0.633300  1
  Ni  Ni252  1  0.248922  0.317615  0.582631  1
  Ni  Ni253  1  -0.001453  0.025462  0.647566  1
  Ni  Ni254  1  -0.001453  0.657080  0.595820  1
  Ni  Ni255  1  -0.001453  0.342912  0.621363  1
  Ni  Ni256  1  -0.001453  0.819730  0.582362  1
  Ni  Ni257  1  -0.001453  0.503298  0.608281  1
  Ni  Ni258  1  -0.001453  0.188021  0.633369  1
  Ni  Ni259  1  0.498547  0.974991  0.692441  1
  Ni  Ni260  1  0.498547  0.665843  0.715090  1
  Ni  Ni261  1  0.498547  0.292032  0.665688  1
  Ni  Ni262  1  0.249902  0.893926  0.696674  1
  Ni  Ni263  1  0.247960  0.586013  0.721425  1
  Ni  Ni264  1  0.249175  0.213162  0.672641  1
  Ni  Ni265  1  0.747192  0.893926  0.696674  1
  Ni  Ni266  1  0.749133  0.586013  0.721425  1
  Ni  Ni267  1  0.747918  0.213162  0.672641  1
  Ni  Ni268  1  0.498547  0.867758  0.660782  1
  Ni  Ni269  1  0.498547  0.550984  0.687247  1
  Ni  Ni270  1  0.498547  0.236661  0.709726  1
  Ni  Ni271  1  0.498547  0.085804  0.722076  1
  Ni  Ni272  1  0.498547  0.719461  0.671843  1
  Ni  Ni273  1  0.498547  0.398253  0.697593  1
  Ni  Ni274  1  -0.001453  0.134299  0.678113  1
  Ni  Ni275  1  -0.001453  0.818001  0.702687  1
  Ni  Ni276  1  -0.001453  0.451242  0.653761  1
  Ni  Ni277  1  0.750247  0.054662  0.685136  1
  Ni  Ni278  1  0.748038  0.741111  0.709134  1
  Ni  Ni279  1  0.749158  0.370446  0.659776  1
  Ni  Ni280  1  0.246846  0.054662  0.685136  1
  Ni  Ni281  1  0.249055  0.741111  0.709134  1
  Ni  Ni282  1  0.247935  0.370446  0.659776  1
  Ni  Ni283  1  -0.001453  0.079130  0.721899  1
  Ni  Ni284  1  -0.001453  0.708831  0.672367  1
  Ni  Ni285  1  -0.001453  0.394245  0.697746  1
  Ni  Ni286  1  -0.001453  0.873323  0.658401  1
  Ni  Ni287  1  -0.001453  0.559712  0.686823  1
  Ni  Ni288  1  -0.001453  0.239943  0.709620  1
