# generated using pymatgen
data_Al3Ni5
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   8.02123251
_cell_length_b   11.96322576
_cell_length_c   49.09388734
_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   'Al72 Ni120'
_cell_volume   4711.04036855
_cell_formula_units_Z   24
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  0.499014  0.943259  0.305263  1
  Al  Al2  1  0.499014  0.374979  0.269371  1
  Al  Al3  1  0.759064  0.994020  0.345177  1
  Al  Al4  1  0.758699  0.439085  0.306108  1
  Al  Al5  1  0.238965  0.994020  0.345177  1
  Al  Al6  1  0.239330  0.439085  0.306108  1
  Al  Al7  1  -0.000986  0.721449  0.327111  1
  Al  Al8  1  -0.000986  0.156430  0.286891  1
  Al  Al9  1  0.250660  0.658046  0.286940  1
  Al  Al10  1  0.260286  0.217105  0.327026  1
  Al  Al11  1  0.747369  0.658046  0.286940  1
  Al  Al12  1  0.737743  0.217105  0.327026  1
  Al  Al13  1  0.499014  0.048868  0.384289  1
  Al  Al14  1  0.499014  0.497749  0.345429  1
  Al  Al15  1  0.757661  0.106322  0.422541  1
  Al  Al16  1  0.757869  0.551284  0.383621  1
  Al  Al17  1  0.240367  0.106322  0.422541  1
  Al  Al18  1  0.240160  0.551284  0.383621  1
  Al  Al19  1  -0.000986  0.827882  0.403878  1
  Al  Al20  1  -0.000986  0.274316  0.365297  1
  Al  Al21  1  0.258733  0.773200  0.363619  1
  Al  Al22  1  0.257974  0.328851  0.403057  1
  Al  Al23  1  0.739296  0.773200  0.363619  1
  Al  Al24  1  0.740054  0.328851  0.403057  1
  Al  Al25  1  0.499014  0.162805  0.461098  1
  Al  Al26  1  0.499014  0.606402  0.422559  1
  Al  Al27  1  0.757483  0.218573  0.499539  1
  Al  Al28  1  0.757237  0.662919  0.460757  1
  Al  Al29  1  0.240546  0.218573  0.499539  1
  Al  Al30  1  0.240792  0.662919  0.460757  1
  Al  Al31  1  -0.000986  0.941303  0.480640  1
  Al  Al32  1  -0.000986  0.385045  0.442109  1
  Al  Al33  1  0.257339  0.884621  0.441660  1
  Al  Al34  1  0.257424  0.440846  0.480182  1
  Al  Al35  1  0.740690  0.884621  0.441660  1
  Al  Al36  1  0.740605  0.440846  0.480182  1
  Al  Al37  1  0.499014  0.274314  0.538117  1
  Al  Al38  1  0.499014  0.718913  0.499482  1
  Al  Al39  1  0.757835  0.330490  0.576465  1
  Al  Al40  1  0.757445  0.774535  0.538113  1
  Al  Al41  1  0.240194  0.330490  0.576465  1
  Al  Al42  1  0.240583  0.774535  0.538113  1
  Al  Al43  1  -0.000986  0.052903  0.557807  1
  Al  Al44  1  -0.000986  0.497164  0.518993  1
  Al  Al45  1  0.257510  0.996440  0.518871  1
  Al  Al46  1  0.257313  0.552837  0.557229  1
  Al  Al47  1  0.740519  0.996440  0.518871  1
  Al  Al48  1  0.740715  0.552837  0.557229  1
  Al  Al49  1  0.499014  0.388462  0.614558  1
  Al  Al50  1  0.499014  0.830698  0.576656  1
  Al  Al51  1  0.759435  0.442600  0.653136  1
  Al  Al52  1  0.757540  0.886048  0.615289  1
  Al  Al53  1  0.238593  0.442600  0.653136  1
  Al  Al54  1  0.240488  0.886048  0.615289  1
  Al  Al55  1  -0.000986  0.164207  0.635647  1
  Al  Al56  1  -0.000986  0.610036  0.596104  1
  Al  Al57  1  0.257651  0.107923  0.595937  1
  Al  Al58  1  0.258175  0.664500  0.634727  1
  Al  Al59  1  0.740378  0.107923  0.595937  1
  Al  Al60  1  0.739854  0.664500  0.634727  1
  Al  Al61  1  0.499014  0.493848  0.692905  1
  Al  Al62  1  0.499014  0.942809  0.653925  1
  Al  Al63  1  0.765936  0.545108  0.729185  1
  Al  Al64  1  0.757678  0.996655  0.692290  1
  Al  Al65  1  0.232093  0.545108  0.729185  1
  Al  Al66  1  0.240351  0.996655  0.692290  1
  Al  Al67  1  -0.000986  0.293392  0.714468  1
  Al  Al68  1  -0.000986  0.718919  0.672621  1
  Al  Al69  1  0.260799  0.218684  0.671617  1
  Al  Al70  1  0.256454  0.775886  0.711672  1
  Al  Al71  1  0.737229  0.218684  0.671617  1
  Al  Al72  1  0.741575  0.775886  0.711672  1
  Ni  Ni73  1  0.499014  0.715036  0.327233  1
  Ni  Ni74  1  0.499014  0.162769  0.290188  1
  Ni  Ni75  1  0.246525  0.605266  0.335251  1
  Ni  Ni76  1  0.248011  0.051142  0.297695  1
  Ni  Ni77  1  0.751504  0.605266  0.335251  1
  Ni  Ni78  1  0.750018  0.051142  0.297695  1
  Ni  Ni79  1  0.499014  0.548202  0.297929  1
  Ni  Ni80  1  0.499014  0.101273  0.337080  1
  Ni  Ni81  1  0.499014  0.767860  0.280721  1
  Ni  Ni82  1  0.499014  0.333723  0.317194  1
  Ni  Ni83  1  -0.000986  0.944818  0.309712  1
  Ni  Ni84  1  -0.000986  0.382049  0.272040  1
  Ni  Ni85  1  0.746568  0.829156  0.314871  1
  Ni  Ni86  1  0.749377  0.266101  0.279717  1
  Ni  Ni87  1  0.251461  0.829156  0.314871  1
  Ni  Ni88  1  0.248652  0.266101  0.279717  1
  Ni  Ni89  1  -0.000986  0.779342  0.280755  1
  Ni  Ni90  1  -0.000986  0.321459  0.317920  1
  Ni  Ni91  1  -0.000986  0.556278  0.298942  1
  Ni  Ni92  1  -0.000986  0.112829  0.336153  1
  Ni  Ni93  1  0.499014  0.830920  0.402789  1
  Ni  Ni94  1  0.499014  0.272810  0.364969  1
  Ni  Ni95  1  0.250800  0.718308  0.412323  1
  Ni  Ni96  1  0.249438  0.160668  0.374478  1
  Ni  Ni97  1  0.747229  0.718308  0.412323  1
  Ni  Ni98  1  0.748591  0.160668  0.374478  1
  Ni  Ni99  1  0.499014  0.660266  0.374977  1
  Ni  Ni100  1  0.499014  0.214554  0.413152  1
  Ni  Ni101  1  0.499014  0.888264  0.353800  1
  Ni  Ni102  1  0.499014  0.443132  0.393195  1
  Ni  Ni103  1  -0.000986  0.052501  0.384428  1
  Ni  Ni104  1  -0.000986  0.493915  0.346165  1
  Ni  Ni105  1  0.750845  0.939043  0.393315  1
  Ni  Ni106  1  0.747888  0.384953  0.354650  1
  Ni  Ni107  1  0.247184  0.939043  0.393315  1
  Ni  Ni108  1  0.250140  0.384953  0.354650  1
  Ni  Ni109  1  -0.000986  0.882362  0.356762  1
  Ni  Ni110  1  -0.000986  0.438161  0.394385  1
  Ni  Ni111  1  -0.000986  0.665811  0.374172  1
  Ni  Ni112  1  -0.000986  0.221120  0.413029  1
  Ni  Ni113  1  0.499014  0.940288  0.480377  1
  Ni  Ni114  1  0.499014  0.385051  0.441647  1
  Ni  Ni115  1  0.248783  0.829526  0.489874  1
  Ni  Ni116  1  0.249153  0.273681  0.451311  1
  Ni  Ni117  1  0.749246  0.829526  0.489874  1
  Ni  Ni118  1  0.748875  0.273681  0.451311  1
  Ni  Ni119  1  0.499014  0.771439  0.451413  1
  Ni  Ni120  1  0.499014  0.327214  0.490140  1
  Ni  Ni121  1  0.499014  0.998256  0.432135  1
  Ni  Ni122  1  0.499014  0.554516  0.470386  1
  Ni  Ni123  1  -0.000986  0.162986  0.461380  1
  Ni  Ni124  1  -0.000986  0.608729  0.422607  1
  Ni  Ni125  1  0.748807  0.051428  0.470678  1
  Ni  Ni126  1  0.749682  0.495844  0.431902  1
  Ni  Ni127  1  0.249222  0.051428  0.470678  1
  Ni  Ni128  1  0.248347  0.495844  0.431902  1
  Ni  Ni129  1  -0.000986  0.993262  0.432717  1
  Ni  Ni130  1  -0.000986  0.549975  0.471019  1
  Ni  Ni131  1  -0.000986  0.776933  0.451676  1
  Ni  Ni132  1  -0.000986  0.332637  0.490027  1
  Ni  Ni133  1  0.499014  0.052388  0.557486  1
  Ni  Ni134  1  0.499014  0.497035  0.518683  1
  Ni  Ni135  1  0.248915  0.941266  0.567035  1
  Ni  Ni136  1  0.249090  0.385670  0.528355  1
  Ni  Ni137  1  0.749114  0.941266  0.567035  1
  Ni  Ni138  1  0.748938  0.385670  0.528355  1
  Ni  Ni139  1  0.499014  0.882888  0.528749  1
  Ni  Ni140  1  0.499014  0.439368  0.566877  1
  Ni  Ni141  1  0.499014  0.110063  0.509007  1
  Ni  Ni142  1  0.499014  0.666287  0.547520  1
  Ni  Ni143  1  -0.000986  0.275026  0.538577  1
  Ni  Ni144  1  -0.000986  0.719117  0.499876  1
  Ni  Ni145  1  0.749018  0.163266  0.547721  1
  Ni  Ni146  1  0.749029  0.607919  0.509028  1
  Ni  Ni147  1  0.249011  0.163266  0.547721  1
  Ni  Ni148  1  0.249000  0.607919  0.509028  1
  Ni  Ni149  1  -0.000986  0.105478  0.509844  1
  Ni  Ni150  1  -0.000986  0.661550  0.548155  1
  Ni  Ni151  1  -0.000986  0.888632  0.528598  1
  Ni  Ni152  1  -0.000986  0.445108  0.567097  1
  Ni  Ni153  1  0.499014  0.162539  0.635008  1
  Ni  Ni154  1  0.499014  0.607949  0.596126  1
  Ni  Ni155  1  0.249021  0.051566  0.643983  1
  Ni  Ni156  1  0.247548  0.498128  0.605282  1
  Ni  Ni157  1  0.749008  0.051566  0.643983  1
  Ni  Ni158  1  0.750480  0.498128  0.605282  1
  Ni  Ni159  1  0.499014  0.994471  0.605983  1
  Ni  Ni160  1  0.499014  0.549910  0.644872  1
  Ni  Ni161  1  0.499014  0.222027  0.586209  1
  Ni  Ni162  1  0.499014  0.778474  0.624542  1
  Ni  Ni163  1  -0.000986  0.386078  0.615792  1
  Ni  Ni164  1  -0.000986  0.830913  0.577046  1
  Ni  Ni165  1  0.747899  0.275090  0.624346  1
  Ni  Ni166  1  0.748333  0.719381  0.586360  1
  Ni  Ni167  1  0.250130  0.275090  0.624346  1
  Ni  Ni168  1  0.249696  0.719381  0.586360  1
  Ni  Ni169  1  -0.000986  0.216840  0.587255  1
  Ni  Ni170  1  -0.000986  0.774034  0.625424  1
  Ni  Ni171  1  -0.000986  1.000766  0.605937  1
  Ni  Ni172  1  -0.000986  0.556296  0.643976  1
  Ni  Ni173  1  0.499014  0.282474  0.709076  1
  Ni  Ni174  1  0.499014  0.720935  0.672575  1
  Ni  Ni175  1  0.247906  0.170509  0.718696  1
  Ni  Ni176  1  0.250884  0.608786  0.682463  1
  Ni  Ni177  1  0.750122  0.170509  0.718696  1
  Ni  Ni178  1  0.747145  0.608786  0.682463  1
  Ni  Ni179  1  0.499014  0.103581  0.684587  1
  Ni  Ni180  1  0.499014  0.660101  0.719654  1
  Ni  Ni181  1  0.499014  0.336052  0.661631  1
  Ni  Ni182  1  0.499014  0.888906  0.701154  1
  Ni  Ni183  1  -0.000986  0.498724  0.692788  1
  Ni  Ni184  1  -0.000986  0.945424  0.654602  1
  Ni  Ni185  1  0.749710  0.384241  0.699695  1
  Ni  Ni186  1  0.749729  0.831112  0.663408  1
  Ni  Ni187  1  0.248318  0.384241  0.699695  1
  Ni  Ni188  1  0.248299  0.831112  0.663408  1
  Ni  Ni189  1  -0.000986  0.327800  0.664761  1
  Ni  Ni190  1  -0.000986  0.882305  0.701830  1
  Ni  Ni191  1  -0.000986  0.117621  0.684701  1
  Ni  Ni192  1  -0.000986  0.670684  0.719605  1
