# generated using pymatgen
data_Al3Ni5
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   5.57806686
_cell_length_b   16.28167750
_cell_length_c   50.22288711
_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   4561.2569551
_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  0.062500  0.487907  0.305787  1
  Al  Al2  1  0.062500  0.958912  0.263267  1
  Al  Al3  1  0.062500  0.587491  0.257490  1
  Al  Al4  1  0.062500  0.112792  0.297103  1
  Al  Al5  1  0.062500  0.336344  0.276160  1
  Al  Al6  1  0.062500  0.862506  0.316266  1
  Al  Al7  1  0.562500  0.203513  0.246699  1
  Al  Al8  1  0.562500  0.725030  0.288333  1
  Al  Al9  1  0.562500  0.346828  0.276053  1
  Al  Al10  1  0.562500  0.878053  0.315293  1
  Al  Al11  1  0.562500  0.580219  0.257038  1
  Al  Al12  1  0.562500  0.097945  0.297808  1
  Al  Al13  1  0.062500  0.544148  0.382796  1
  Al  Al14  1  0.062500  0.014994  0.343521  1
  Al  Al15  1  0.062500  0.641301  0.334404  1
  Al  Al16  1  0.062500  0.169464  0.373137  1
  Al  Al17  1  0.062500  0.390467  0.354157  1
  Al  Al18  1  0.062500  0.919178  0.393209  1
  Al  Al19  1  0.562500  0.252634  0.325999  1
  Al  Al20  1  0.562500  0.780978  0.364926  1
  Al  Al21  1  0.562500  0.405020  0.353033  1
  Al  Al22  1  0.562500  0.933729  0.392184  1
  Al  Al23  1  0.562500  0.626664  0.335648  1
  Al  Al24  1  0.562500  0.155028  0.374345  1
  Al  Al25  1  0.062500  0.600604  0.459743  1
  Al  Al26  1  0.062500  0.072002  0.420880  1
  Al  Al27  1  0.062500  0.697745  0.411510  1
  Al  Al28  1  0.062500  0.226028  0.449915  1
  Al  Al29  1  0.062500  0.446926  0.431196  1
  Al  Al30  1  0.062500  0.975422  0.470071  1
  Al  Al31  1  0.562500  0.308651  0.402472  1
  Al  Al32  1  0.562500  0.837162  0.441457  1
  Al  Al33  1  0.562500  0.461588  0.430129  1
  Al  Al34  1  0.562500  -0.009851  0.469007  1
  Al  Al35  1  0.562500  0.683163  0.412610  1
  Al  Al36  1  0.562500  0.211339  0.450996  1
  Al  Al37  1  0.062500  0.657201  0.536728  1
  Al  Al38  1  0.062500  0.128680  0.497982  1
  Al  Al39  1  0.062500  0.754354  0.488415  1
  Al  Al40  1  0.062500  0.282524  0.526843  1
  Al  Al41  1  0.062500  0.503246  0.507982  1
  Al  Al42  1  0.062500  0.031721  0.546770  1
  Al  Al43  1  0.562500  0.364865  0.479212  1
  Al  Al44  1  0.562500  0.893691  0.518404  1
  Al  Al45  1  0.562500  0.517989  0.506918  1
  Al  Al46  1  0.562500  0.046348  0.545765  1
  Al  Al47  1  0.562500  0.739655  0.489525  1
  Al  Al48  1  0.562500  0.267903  0.527920  1
  Al  Al49  1  0.062500  0.714089  0.613738  1
  Al  Al50  1  0.062500  0.185219  0.574857  1
  Al  Al51  1  0.062500  0.810730  0.565229  1
  Al  Al52  1  0.062500  0.339063  0.603992  1
  Al  Al53  1  0.062500  0.559461  0.584522  1
  Al  Al54  1  0.062500  0.086842  0.623420  1
  Al  Al55  1  0.562500  0.421189  0.556077  1
  Al  Al56  1  0.562500  0.950461  0.595635  1
  Al  Al57  1  0.562500  0.574051  0.583318  1
  Al  Al58  1  0.562500  0.102249  0.622246  1
  Al  Al59  1  0.562500  0.796272  0.566396  1
  Al  Al60  1  0.562500  0.324621  0.605113  1
  Al  Al61  1  0.062500  0.766147  0.693824  1
  Al  Al62  1  0.062500  0.241766  0.651264  1
  Al  Al63  1  0.062500  0.867785  0.641861  1
  Al  Al64  1  0.062500  0.394323  0.681850  1
  Al  Al65  1  0.062500  0.617382  0.659655  1
  Al  Al66  1  0.062500  0.136004  0.700111  1
  Al  Al67  1  0.562500  0.478008  0.633066  1
  Al  Al68  1  0.562500  0.007085  0.675578  1
  Al  Al69  1  0.562500  0.631803  0.659165  1
  Al  Al70  1  0.562500  0.154914  0.700085  1
  Al  Al71  1  0.562500  0.851291  0.642868  1
  Al  Al72  1  0.562500  0.383024  0.682606  1
  Ni  Ni73  1  0.562500  0.487038  0.306234  1
  Ni  Ni74  1  0.562500  0.961383  0.266030  1
  Ni  Ni75  1  0.310679  0.369145  0.314952  1
  Ni  Ni76  1  0.311405  0.841888  0.277031  1
  Ni  Ni77  1  0.315356  0.605520  0.296546  1
  Ni  Ni78  1  0.309351  0.084358  0.258658  1
  Ni  Ni79  1  0.304205  0.462430  0.267062  1
  Ni  Ni80  1  0.294410  -0.013610  0.304384  1
  Ni  Ni81  1  0.820795  0.462430  0.267062  1
  Ni  Ni82  1  0.830589  -0.013610  0.304384  1
  Ni  Ni83  1  0.062500  0.209469  0.248783  1
  Ni  Ni84  1  0.062500  0.723915  0.289645  1
  Ni  Ni85  1  0.809643  0.605520  0.296546  1
  Ni  Ni86  1  0.815649  0.084358  0.258658  1
  Ni  Ni87  1  0.814320  0.369145  0.314952  1
  Ni  Ni88  1  0.813594  0.841888  0.277031  1
  Ni  Ni89  1  0.797754  0.222933  0.288004  1
  Ni  Ni90  1  0.812077  0.709174  0.249610  1
  Ni  Ni91  1  0.327246  0.222933  0.288004  1
  Ni  Ni92  1  0.312923  0.709174  0.249610  1
  Ni  Ni93  1  0.562500  0.544159  0.382751  1
  Ni  Ni94  1  0.562500  0.014633  0.343196  1
  Ni  Ni95  1  0.312591  0.426103  0.392141  1
  Ni  Ni96  1  0.312294  0.898052  0.354262  1
  Ni  Ni97  1  0.312267  0.662272  0.373536  1
  Ni  Ni98  1  0.313677  0.134110  0.335540  1
  Ni  Ni99  1  0.298271  0.515908  0.344325  1
  Ni  Ni100  1  0.299166  0.043600  0.382185  1
  Ni  Ni101  1  0.826728  0.515908  0.344325  1
  Ni  Ni102  1  0.825834  0.043600  0.382185  1
  Ni  Ni103  1  0.062500  0.251933  0.325969  1
  Ni  Ni104  1  0.062500  0.780912  0.364920  1
  Ni  Ni105  1  0.812733  0.662272  0.373536  1
  Ni  Ni106  1  0.811322  0.134110  0.335540  1
  Ni  Ni107  1  0.812408  0.426103  0.392141  1
  Ni  Ni108  1  0.812706  0.898052  0.354262  1
  Ni  Ni109  1  0.799210  0.280433  0.364212  1
  Ni  Ni110  1  0.797163  0.752903  0.326830  1
  Ni  Ni111  1  0.325790  0.280433  0.364212  1
  Ni  Ni112  1  0.327837  0.752903  0.326830  1
  Ni  Ni113  1  0.562500  0.600587  0.459743  1
  Ni  Ni114  1  0.562500  0.072023  0.420825  1
  Ni  Ni115  1  0.312475  0.482463  0.469074  1
  Ni  Ni116  1  0.312436  0.954594  0.431134  1
  Ni  Ni117  1  0.312524  0.718782  0.450508  1
  Ni  Ni118  1  0.312245  0.190598  0.412077  1
  Ni  Ni119  1  0.298904  0.572300  0.421266  1
  Ni  Ni120  1  0.298779  0.100371  0.459447  1
  Ni  Ni121  1  0.826095  0.572300  0.421266  1
  Ni  Ni122  1  0.826220  0.100371  0.459447  1
  Ni  Ni123  1  0.062500  0.308709  0.402524  1
  Ni  Ni124  1  0.062500  0.837187  0.441552  1
  Ni  Ni125  1  0.812475  0.718782  0.450508  1
  Ni  Ni126  1  0.812754  0.190598  0.412077  1
  Ni  Ni127  1  0.812525  0.482463  0.469074  1
  Ni  Ni128  1  0.812564  0.954594  0.431134  1
  Ni  Ni129  1  0.798863  0.336666  0.440848  1
  Ni  Ni130  1  0.799172  0.808956  0.403164  1
  Ni  Ni131  1  0.326136  0.336666  0.440848  1
  Ni  Ni132  1  0.325827  0.808956  0.403164  1
  Ni  Ni133  1  0.562500  0.657084  0.536725  1
  Ni  Ni134  1  0.562500  0.128655  0.497928  1
  Ni  Ni135  1  0.312193  0.538678  0.545710  1
  Ni  Ni136  1  0.312543  0.010977  0.507902  1
  Ni  Ni137  1  0.312682  0.775268  0.527379  1
  Ni  Ni138  1  0.312491  0.246974  0.488903  1
  Ni  Ni139  1  0.298772  0.628853  0.498227  1
  Ni  Ni140  1  0.298924  0.156905  0.536423  1
  Ni  Ni141  1  0.826227  0.628853  0.498227  1
  Ni  Ni142  1  0.826076  0.156905  0.536423  1
  Ni  Ni143  1  0.062500  0.364869  0.479235  1
  Ni  Ni144  1  0.062500  0.893667  0.518455  1
  Ni  Ni145  1  0.812317  0.775268  0.527379  1
  Ni  Ni146  1  0.812509  0.246974  0.488903  1
  Ni  Ni147  1  0.812807  0.538678  0.545710  1
  Ni  Ni148  1  0.812456  0.010977  0.507902  1
  Ni  Ni149  1  0.798865  0.393009  0.517633  1
  Ni  Ni150  1  0.798765  0.865322  0.479919  1
  Ni  Ni151  1  0.326135  0.393009  0.517633  1
  Ni  Ni152  1  0.326234  0.865322  0.479919  1
  Ni  Ni153  1  0.562500  0.714523  0.614013  1
  Ni  Ni154  1  0.562500  0.185048  0.574809  1
  Ni  Ni155  1  0.313785  0.595034  0.621799  1
  Ni  Ni156  1  0.312105  0.067291  0.584514  1
  Ni  Ni157  1  0.311999  0.831899  0.604096  1
  Ni  Ni158  1  0.312681  0.303498  0.565945  1
  Ni  Ni159  1  0.299245  0.685502  0.575251  1
  Ni  Ni160  1  0.299153  0.213018  0.613182  1
  Ni  Ni161  1  0.825754  0.685502  0.575251  1
  Ni  Ni162  1  0.825847  0.213018  0.613182  1
  Ni  Ni163  1  0.062500  0.421137  0.556104  1
  Ni  Ni164  1  0.062500  0.950716  0.595986  1
  Ni  Ni165  1  0.813000  0.831899  0.604096  1
  Ni  Ni166  1  0.812318  0.303498  0.565945  1
  Ni  Ni167  1  0.811214  0.595034  0.621799  1
  Ni  Ni168  1  0.812895  0.067291  0.584514  1
  Ni  Ni169  1  0.798992  0.449366  0.594582  1
  Ni  Ni170  1  0.799232  0.921923  0.557036  1
  Ni  Ni171  1  0.326007  0.449366  0.594582  1
  Ni  Ni172  1  0.325768  0.921923  0.557036  1
  Ni  Ni173  1  0.562500  0.762001  0.690952  1
  Ni  Ni174  1  0.562500  0.242596  0.651432  1
  Ni  Ni175  1  0.310960  0.639427  0.698903  1
  Ni  Ni176  1  0.314771  0.124272  0.660523  1
  Ni  Ni177  1  0.313208  0.884484  0.681067  1
  Ni  Ni178  1  0.312049  0.360723  0.643139  1
  Ni  Ni179  1  0.293719  0.742937  0.652657  1
  Ni  Ni180  1  0.296916  0.266625  0.690047  1
  Ni  Ni181  1  0.831281  0.742937  0.652657  1
  Ni  Ni182  1  0.828084  0.266625  0.690047  1
  Ni  Ni183  1  0.062500  0.478273  0.633122  1
  Ni  Ni184  1  0.062500  0.006120  0.672858  1
  Ni  Ni185  1  0.811791  0.884484  0.681067  1
  Ni  Ni186  1  0.812951  0.360723  0.643139  1
  Ni  Ni187  1  0.814040  0.639427  0.698903  1
  Ni  Ni188  1  0.810229  0.124272  0.660523  1
  Ni  Ni189  1  0.798654  0.507693  0.671774  1
  Ni  Ni190  1  0.793915  -0.021392  0.634803  1
  Ni  Ni191  1  0.326346  0.507693  0.671774  1
  Ni  Ni192  1  0.331085  -0.021392  0.634803  1
