# generated using pymatgen
data_Al3Ni5
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   5.59676059
_cell_length_b   14.30509580
_cell_length_c   54.29044805
_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   4346.61251731
_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  0.008424  0.986426  0.263794  1
  Al  Al2  1  0.008424  0.445404  0.350177  1
  Al  Al3  1  0.008424  0.215221  0.308716  1
  Al  Al4  1  0.008424  0.639737  0.338937  1
  Al  Al5  1  0.008424  0.410388  0.296210  1
  Al  Al6  1  0.008424  0.182497  0.254793  1
  Al  Al7  1  0.008424  0.785118  0.279667  1
  Al  Al8  1  0.008424  0.252485  0.360903  1
  Al  Al9  1  0.008424  0.019465  0.318999  1
  Al  Al10  1  0.508424  0.834526  0.328026  1
  Al  Al11  1  0.508424  0.598029  0.288161  1
  Al  Al12  1  0.508424  0.365042  0.246426  1
  Al  Al13  1  0.508424  0.789035  0.278254  1
  Al  Al14  1  0.508424  0.257784  0.359070  1
  Al  Al15  1  0.508424  0.026224  0.316969  1
  Al  Al16  1  0.508424  0.634835  0.341138  1
  Al  Al17  1  0.508424  0.406935  0.297925  1
  Al  Al18  1  0.508424  0.168805  0.256638  1
  Al  Al19  1  0.008424  0.680539  0.391038  1
  Al  Al20  1  0.008424  0.142721  0.475246  1
  Al  Al21  1  0.008424  0.910970  0.433372  1
  Al  Al22  1  0.008424  0.337584  0.463710  1
  Al  Al23  1  0.008424  0.106050  0.421897  1
  Al  Al24  1  0.008424  0.874665  0.380005  1
  Al  Al25  1  0.008424  0.483720  0.403326  1
  Al  Al26  1  0.008424  0.948390  0.486449  1
  Al  Al27  1  0.008424  0.716709  0.444398  1
  Al  Al28  1  0.508424  0.528412  0.453781  1
  Al  Al29  1  0.508424  0.294355  0.412721  1
  Al  Al30  1  0.508424  0.062877  0.370924  1
  Al  Al31  1  0.508424  0.488883  0.401220  1
  Al  Al32  1  0.508424  0.954115  0.484560  1
  Al  Al33  1  0.508424  0.722677  0.442607  1
  Al  Al34  1  0.508424  0.332397  0.465769  1
  Al  Al35  1  0.508424  0.100432  0.423788  1
  Al  Al36  1  0.508424  0.868501  0.381782  1
  Al  Al37  1  0.008424  0.376567  0.516332  1
  Al  Al38  1  0.008424  0.839291  0.600451  1
  Al  Al39  1  0.008424  0.607303  0.558625  1
  Al  Al40  1  0.008424  0.033445  0.588932  1
  Al  Al41  1  0.008424  0.802343  0.547181  1
  Al  Al42  1  0.008424  0.571034  0.505189  1
  Al  Al43  1  0.008424  0.180658  0.528342  1
  Al  Al44  1  0.008424  0.644813  0.611647  1
  Al  Al45  1  0.008424  0.413458  0.569478  1
  Al  Al46  1  0.508424  0.225348  0.578784  1
  Al  Al47  1  0.508424  0.991133  0.537844  1
  Al  Al48  1  0.508424  0.759302  0.495976  1
  Al  Al49  1  0.508424  0.185741  0.526270  1
  Al  Al50  1  0.508424  0.650683  0.609705  1
  Al  Al51  1  0.508424  0.419518  0.567761  1
  Al  Al52  1  0.508424  0.028653  0.591083  1
  Al  Al53  1  0.508424  0.796550  0.549064  1
  Al  Al54  1  0.508424  0.565110  0.506990  1
  Al  Al55  1  0.008424  0.074435  0.641003  1
  Al  Al56  1  0.008424  0.538217  0.726600  1
  Al  Al57  1  0.008424  0.301127  0.684064  1
  Al  Al58  1  0.008424  0.730314  0.714792  1
  Al  Al59  1  0.008424  0.499084  0.671743  1
  Al  Al60  1  0.008424  0.268161  0.630382  1
  Al  Al61  1  0.008424  0.875522  0.654257  1
  Al  Al62  1  0.008424  0.343270  0.735645  1
  Al  Al63  1  0.008424  0.108725  0.693311  1
  Al  Al64  1  0.508424  0.925792  0.702556  1
  Al  Al65  1  0.508424  0.687650  0.663226  1
  Al  Al66  1  0.508424  0.455279  0.621428  1
  Al  Al67  1  0.508424  0.880312  0.651865  1
  Al  Al68  1  0.508424  0.349627  0.733160  1
  Al  Al69  1  0.508424  0.115617  0.692674  1
  Al  Al70  1  0.508424  0.721431  0.717693  1
  Al  Al71  1  0.508424  0.493081  0.674287  1
  Al  Al72  1  0.508424  0.261767  0.631855  1
  Ni  Ni73  1  0.508424  0.988775  0.264928  1
  Ni  Ni74  1  0.508424  0.445712  0.350480  1
  Ni  Ni75  1  0.508424  0.211968  0.308945  1
  Ni  Ni76  1  0.257913  0.910282  0.296086  1
  Ni  Ni77  1  0.255246  0.672192  0.256760  1
  Ni  Ni78  1  0.257205  0.137353  0.339699  1
  Ni  Ni79  1  0.257323  0.757070  0.359402  1
  Ni  Ni80  1  0.259555  0.521178  0.319255  1
  Ni  Ni81  1  0.265406  0.288427  0.278347  1
  Ni  Ni82  1  0.258707  0.857850  0.247567  1
  Ni  Ni83  1  0.255274  0.332181  0.328487  1
  Ni  Ni84  1  0.247458  0.100220  0.287390  1
  Ni  Ni85  1  0.758140  0.857850  0.247567  1
  Ni  Ni86  1  0.761574  0.332181  0.328487  1
  Ni  Ni87  1  0.769390  0.100220  0.287390  1
  Ni  Ni88  1  0.008424  0.834440  0.327817  1
  Ni  Ni89  1  0.008424  0.599991  0.289320  1
  Ni  Ni90  1  0.008424  0.361564  0.247910  1
  Ni  Ni91  1  0.759525  0.757070  0.359402  1
  Ni  Ni92  1  0.757292  0.521178  0.319255  1
  Ni  Ni93  1  0.751442  0.288427  0.278347  1
  Ni  Ni94  1  0.758935  0.910282  0.296086  1
  Ni  Ni95  1  0.761601  0.672192  0.256760  1
  Ni  Ni96  1  0.759642  0.137353  0.339699  1
  Ni  Ni97  1  0.751210  0.713440  0.309617  1
  Ni  Ni98  1  0.759169  0.488020  0.265704  1
  Ni  Ni99  1  0.752861  0.948099  0.349642  1
  Ni  Ni100  1  0.265638  0.713440  0.309617  1
  Ni  Ni101  1  0.257679  0.488020  0.265704  1
  Ni  Ni102  1  0.263987  0.948099  0.349642  1
  Ni  Ni103  1  0.508424  0.680619  0.390786  1
  Ni  Ni104  1  0.508424  0.142621  0.475351  1
  Ni  Ni105  1  0.508424  0.910874  0.433453  1
  Ni  Ni106  1  0.259417  0.604394  0.422300  1
  Ni  Ni107  1  0.257702  0.369766  0.381517  1
  Ni  Ni108  1  0.258090  0.835048  0.464690  1
  Ni  Ni109  1  0.257521  0.452555  0.484980  1
  Ni  Ni110  1  0.258997  0.218511  0.444041  1
  Ni  Ni111  1  0.258971  0.986723  0.402170  1
  Ni  Ni112  1  0.251858  0.561759  0.371161  1
  Ni  Ni113  1  0.253089  0.027232  0.454164  1
  Ni  Ni114  1  0.253331  0.795648  0.412208  1
  Ni  Ni115  1  0.764990  0.561759  0.371161  1
  Ni  Ni116  1  0.763759  0.027232  0.454164  1
  Ni  Ni117  1  0.763517  0.795648  0.412208  1
  Ni  Ni118  1  0.008424  0.528573  0.453602  1
  Ni  Ni119  1  0.008424  0.294388  0.412876  1
  Ni  Ni120  1  0.008424  0.062532  0.371056  1
  Ni  Ni121  1  0.759327  0.452555  0.484980  1
  Ni  Ni122  1  0.757851  0.218511  0.444041  1
  Ni  Ni123  1  0.757877  0.986723  0.402170  1
  Ni  Ni124  1  0.757431  0.604394  0.422300  1
  Ni  Ni125  1  0.759145  0.369766  0.381517  1
  Ni  Ni126  1  0.758758  0.835048  0.464690  1
  Ni  Ni127  1  0.752444  0.410753  0.433532  1
  Ni  Ni128  1  0.753475  0.179522  0.391460  1
  Ni  Ni129  1  0.753247  0.643966  0.474813  1
  Ni  Ni130  1  0.264404  0.410753  0.433532  1
  Ni  Ni131  1  0.263373  0.179522  0.391460  1
  Ni  Ni132  1  0.263601  0.643966  0.474813  1
  Ni  Ni133  1  0.508424  0.376804  0.516149  1
  Ni  Ni134  1  0.508424  0.839096  0.600592  1
  Ni  Ni135  1  0.508424  0.607209  0.558724  1
  Ni  Ni136  1  0.259662  0.301028  0.547451  1
  Ni  Ni137  1  0.257756  0.066808  0.506586  1
  Ni  Ni138  1  0.257756  0.531123  0.590068  1
  Ni  Ni139  1  0.256236  0.149992  0.609709  1
  Ni  Ni140  1  0.259391  0.914997  0.569185  1
  Ni  Ni141  1  0.258716  0.683250  0.527324  1
  Ni  Ni142  1  0.252688  0.259074  0.496026  1
  Ni  Ni143  1  0.252889  0.723657  0.579402  1
  Ni  Ni144  1  0.253278  0.492236  0.537343  1
  Ni  Ni145  1  0.764160  0.259074  0.496026  1
  Ni  Ni146  1  0.763959  0.723657  0.579402  1
  Ni  Ni147  1  0.763570  0.492236  0.537343  1
  Ni  Ni148  1  0.008424  0.225745  0.578502  1
  Ni  Ni149  1  0.008424  0.990976  0.537961  1
  Ni  Ni150  1  0.008424  0.759242  0.496040  1
  Ni  Ni151  1  0.760612  0.149992  0.609709  1
  Ni  Ni152  1  0.757457  0.914997  0.569185  1
  Ni  Ni153  1  0.758132  0.683250  0.527324  1
  Ni  Ni154  1  0.757186  0.301028  0.547451  1
  Ni  Ni155  1  0.759091  0.066808  0.506586  1
  Ni  Ni156  1  0.759092  0.531123  0.590068  1
  Ni  Ni157  1  0.752714  0.107286  0.558698  1
  Ni  Ni158  1  0.753027  0.875448  0.516827  1
  Ni  Ni159  1  0.753771  0.340890  0.599890  1
  Ni  Ni160  1  0.264134  0.107286  0.558698  1
  Ni  Ni161  1  0.263821  0.875448  0.516827  1
  Ni  Ni162  1  0.263077  0.340890  0.599890  1
  Ni  Ni163  1  0.508424  0.075087  0.640500  1
  Ni  Ni164  1  0.508424  0.532592  0.725224  1
  Ni  Ni165  1  0.508424  0.302072  0.684872  1
  Ni  Ni166  1  0.262142  0.999122  0.671314  1
  Ni  Ni167  1  0.257388  0.763113  0.631796  1
  Ni  Ni168  1  0.255886  0.223380  0.715749  1
  Ni  Ni169  1  0.254457  0.855433  0.733256  1
  Ni  Ni170  1  0.256999  0.611293  0.693963  1
  Ni  Ni171  1  0.260580  0.378358  0.652990  1
  Ni  Ni172  1  0.252472  0.954677  0.621564  1
  Ni  Ni173  1  0.245368  0.421165  0.703442  1
  Ni  Ni174  1  0.255414  0.189109  0.662259  1
  Ni  Ni175  1  0.764375  0.954677  0.621564  1
  Ni  Ni176  1  0.771480  0.421165  0.703442  1
  Ni  Ni177  1  0.761433  0.189109  0.662259  1
  Ni  Ni178  1  0.008424  0.924127  0.701139  1
  Ni  Ni179  1  0.008424  0.688458  0.663257  1
  Ni  Ni180  1  0.008424  0.455254  0.621720  1
  Ni  Ni181  1  0.762391  0.855433  0.733256  1
  Ni  Ni182  1  0.759849  0.611293  0.693963  1
  Ni  Ni183  1  0.756268  0.378358  0.652990  1
  Ni  Ni184  1  0.754706  0.999122  0.671314  1
  Ni  Ni185  1  0.759460  0.763113  0.631796  1
  Ni  Ni186  1  0.760961  0.223380  0.715749  1
  Ni  Ni187  1  0.748681  0.801872  0.684658  1
  Ni  Ni188  1  0.751800  0.572652  0.641946  1
  Ni  Ni189  1  0.760613  0.038112  0.724944  1
  Ni  Ni190  1  0.268167  0.801872  0.684658  1
  Ni  Ni191  1  0.265047  0.572652  0.641946  1
  Ni  Ni192  1  0.256235  0.038112  0.724944  1
