# generated using pymatgen
data_Al3Ni5
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   7.27956183
_cell_length_b   10.06497435
_cell_length_c   45.73183091
_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   'Al48 Ni80'
_cell_volume   3350.70736709
_cell_formula_units_Z   16
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  0.504908  0.678504  0.363850  1
  Al  Al2  1  0.500016  0.421477  0.303756  1
  Al  Al3  1  0.768601  0.547292  0.334581  1
  Al  Al4  1  0.775137  0.284655  0.278619  1
  Al  Al5  1  0.239864  0.548005  0.334430  1
  Al  Al6  1  0.232491  0.263831  0.280576  1
  Al  Al7  1  0.013729  0.918282  0.304719  1
  Al  Al8  1  1.003121  0.179114  0.363831  1
  Al  Al9  1  0.274945  0.771856  0.280338  1
  Al  Al10  1  0.267542  0.049101  0.334683  1
  Al  Al11  1  0.736053  0.779260  0.279145  1
  Al  Al12  1  0.737637  0.047408  0.336865  1
  Al  Al13  1  0.503459  0.196920  0.474366  1
  Al  Al14  1  0.503123  0.937581  0.418660  1
  Al  Al15  1  0.767756  0.067249  0.446647  1
  Al  Al16  1  0.769514  0.808637  0.390561  1
  Al  Al17  1  0.239192  0.067259  0.446501  1
  Al  Al18  1  0.237709  0.808001  0.390842  1
  Al  Al19  1  0.003535  0.437651  0.418418  1
  Al  Al20  1  1.003401  0.696823  0.474246  1
  Al  Al21  1  0.268714  0.308560  0.390699  1
  Al  Al22  1  0.267728  0.567207  0.446294  1
  Al  Al23  1  0.737660  0.308641  0.390569  1
  Al  Al24  1  0.739248  0.567135  0.446332  1
  Al  Al25  1  0.503409  0.715377  0.585649  1
  Al  Al26  1  0.503390  0.456063  0.529824  1
  Al  Al27  1  0.767919  0.585745  0.557602  1
  Al  Al28  1  0.767865  0.326521  0.502091  1
  Al  Al29  1  0.239043  0.585782  0.557578  1
  Al  Al30  1  0.239100  0.326479  0.502129  1
  Al  Al31  1  1.003407  0.956142  0.529987  1
  Al  Al32  1  1.002840  0.215217  0.585814  1
  Al  Al33  1  0.267866  0.826494  0.502157  1
  Al  Al34  1  0.267937  0.085800  0.557740  1
  Al  Al35  1  0.739103  0.826505  0.502116  1
  Al  Al36  1  0.739098  0.085797  0.557950  1
  Al  Al37  1  0.508247  0.241059  0.702634  1
  Al  Al38  1  0.504264  0.973977  0.641068  1
  Al  Al39  1  0.761986  0.105544  0.670718  1
  Al  Al40  1  0.768487  0.844533  0.613685  1
  Al  Al41  1  0.243561  0.105134  0.667048  1
  Al  Al42  1  0.237679  0.844731  0.613786  1
  Al  Al43  1  0.004526  0.473457  0.640965  1
  Al  Al44  1  0.004332  0.743886  0.702518  1
  Al  Al45  1  0.268628  0.343935  0.613760  1
  Al  Al46  1  0.263796  0.605165  0.667430  1
  Al  Al47  1  0.738688  0.344711  0.613607  1
  Al  Al48  1  0.743284  0.605276  0.667448  1
  Ni  Ni49  1  0.500387  0.917834  0.308138  1
  Ni  Ni50  1  0.502364  0.178277  0.363282  1
  Ni  Ni51  1  0.746773  0.036111  0.283492  1
  Ni  Ni52  1  0.750086  0.298498  0.334767  1
  Ni  Ni53  1  0.253446  0.557766  0.390365  1
  Ni  Ni54  1  0.255124  0.298874  0.335202  1
  Ni  Ni55  1  0.508184  0.667207  0.310585  1
  Ni  Ni56  1  0.501854  0.924273  0.363803  1
  Ni  Ni57  1  0.503263  0.431053  0.360956  1
  Ni  Ni58  1  0.507389  0.171073  0.307260  1
  Ni  Ni59  1  1.003331  0.677587  0.362962  1
  Ni  Ni60  1  0.005773  0.416553  0.308140  1
  Ni  Ni61  1  0.252332  0.797299  0.335592  1
  Ni  Ni62  1  0.253167  0.057741  0.390704  1
  Ni  Ni63  1  0.757605  0.800711  0.334678  1
  Ni  Ni64  1  0.753547  0.058110  0.391356  1
  Ni  Ni65  1  0.003678  0.425068  0.363446  1
  Ni  Ni66  1  0.994718  0.163529  0.310389  1
  Ni  Ni67  1  1.002540  0.670416  0.307329  1
  Ni  Ni68  1  0.004679  0.931139  0.361244  1
  Ni  Ni69  1  0.503430  0.438210  0.418322  1
  Ni  Ni70  1  0.503539  0.696860  0.474280  1
  Ni  Ni71  1  0.753952  0.557648  0.390484  1
  Ni  Ni72  1  0.753703  0.817356  0.446400  1
  Ni  Ni73  1  0.253439  0.076491  0.502148  1
  Ni  Ni74  1  0.253261  0.817258  0.446507  1
  Ni  Ni75  1  0.503135  0.185094  0.419475  1
  Ni  Ni76  1  0.503458  0.444219  0.474869  1
  Ni  Ni77  1  0.503455  0.949545  0.473595  1
  Ni  Ni78  1  0.503696  0.690738  0.418118  1
  Ni  Ni79  1  1.003499  0.196935  0.474374  1
  Ni  Ni80  1  0.003726  0.937926  0.418574  1
  Ni  Ni81  1  0.253696  0.317435  0.446439  1
  Ni  Ni82  1  0.253469  0.576480  0.501974  1
  Ni  Ni83  1  0.753189  0.317345  0.446370  1
  Ni  Ni84  1  0.753469  0.576463  0.502006  1
  Ni  Ni85  1  0.003523  0.944143  0.475039  1
  Ni  Ni86  1  1.003260  0.684707  0.419322  1
  Ni  Ni87  1  0.003600  0.190834  0.418241  1
  Ni  Ni88  1  1.003481  0.449471  0.473437  1
  Ni  Ni89  1  0.503568  0.956116  0.529984  1
  Ni  Ni90  1  0.504058  0.215319  0.585748  1
  Ni  Ni91  1  0.753475  0.076543  0.502245  1
  Ni  Ni92  1  0.753479  0.335794  0.557789  1
  Ni  Ni93  1  0.252125  0.595034  0.612884  1
  Ni  Ni94  1  0.253469  0.335580  0.557876  1
  Ni  Ni95  1  0.503457  0.703423  0.530676  1
  Ni  Ni96  1  0.503829  0.962292  0.586304  1
  Ni  Ni97  1  0.503322  0.467830  0.584649  1
  Ni  Ni98  1  0.503605  0.208853  0.529306  1
  Ni  Ni99  1  1.003453  0.715644  0.585543  1
  Ni  Ni100  1  0.003543  0.456059  0.529851  1
  Ni  Ni101  1  0.253491  0.835877  0.557890  1
  Ni  Ni102  1  0.254437  0.094815  0.612982  1
  Ni  Ni103  1  0.753357  0.835700  0.557821  1
  Ni  Ni104  1  0.752288  0.095424  0.614056  1
  Ni  Ni105  1  0.003649  0.462151  0.586109  1
  Ni  Ni106  1  1.003408  0.203489  0.530783  1
  Ni  Ni107  1  1.003476  0.708951  0.529174  1
  Ni  Ni108  1  1.002837  0.968132  0.584864  1
  Ni  Ni109  1  0.503631  0.475302  0.640483  1
  Ni  Ni110  1  0.502135  0.732939  0.695817  1
  Ni  Ni111  1  0.755138  0.595067  0.612944  1
  Ni  Ni112  1  0.754496  0.852837  0.670129  1
  Ni  Ni113  1  0.247618  0.097380  0.719071  1
  Ni  Ni114  1  0.250687  0.854512  0.670458  1
  Ni  Ni115  1  0.505475  0.223434  0.643470  1
  Ni  Ni116  1  0.503103  0.480886  0.695144  1
  Ni  Ni117  1  0.498586  0.978318  0.695116  1
  Ni  Ni118  1  0.503108  0.727954  0.640572  1
  Ni  Ni119  1  0.009781  0.236776  0.695297  1
  Ni  Ni120  1  1.001297  0.975764  0.640916  1
  Ni  Ni121  1  0.256824  0.353452  0.670397  1
  Ni  Ni122  1  0.260736  0.596668  0.719801  1
  Ni  Ni123  1  0.754058  0.355870  0.670008  1
  Ni  Ni124  1  0.747179  0.596329  0.719617  1
  Ni  Ni125  1  0.004317  0.983423  0.695119  1
  Ni  Ni126  1  1.003466  0.723573  0.643418  1
  Ni  Ni127  1  1.001073  0.226766  0.640773  1
  Ni  Ni128  1  0.005541  0.482767  0.695269  1
