# generated using pymatgen
data_Al3Ni5
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   3.63488327
_cell_length_b   16.16192748
_cell_length_c   50.90727805
_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   2990.63559975
_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  0.502648  0.735298  0.345181  1
  Al  Al2  1  0.502648  0.327462  0.282183  1
  Al  Al3  1  1.002648  0.628760  0.329062  1
  Al  Al4  1  1.002648  0.219818  0.263295  1
  Al  Al5  1  1.002648  0.842334  0.361982  1
  Al  Al6  1  1.002648  0.438087  0.301266  1
  Al  Al7  1  0.502648  0.033347  0.314869  1
  Al  Al8  1  0.502648  0.613667  0.250216  1
  Al  Al9  1  1.002648  0.923748  0.297245  1
  Al  Al10  1  1.002648  0.330771  0.360108  1
  Al  Al11  1  1.002648  0.737308  0.266796  1
  Al  Al12  1  1.002648  0.140329  0.330979  1
  Al  Al13  1  0.502648  0.546586  0.470856  1
  Al  Al14  1  0.502648  0.141013  0.408242  1
  Al  Al15  1  1.002648  0.439346  0.454272  1
  Al  Al16  1  1.002648  0.033674  0.391586  1
  Al  Al17  1  1.002648  0.653816  0.487374  1
  Al  Al18  1  1.002648  0.248232  0.424773  1
  Al  Al19  1  0.502648  0.843745  0.439373  1
  Al  Al20  1  0.502648  0.437972  0.377008  1
  Al  Al21  1  1.002648  0.736646  0.422886  1
  Al  Al22  1  1.002648  0.142148  0.485523  1
  Al  Al23  1  1.002648  0.545671  0.393713  1
  Al  Al24  1  1.002648  0.950948  0.455965  1
  Al  Al25  1  0.502648  0.357741  0.595931  1
  Al  Al26  1  0.502648  0.952150  0.533268  1
  Al  Al27  1  1.002648  0.250548  0.579452  1
  Al  Al28  1  1.002648  0.844869  0.516713  1
  Al  Al29  1  1.002648  0.465150  0.612636  1
  Al  Al30  1  1.002648  0.059451  0.549905  1
  Al  Al31  1  0.502648  0.654901  0.564723  1
  Al  Al32  1  0.502648  0.249392  0.502100  1
  Al  Al33  1  1.002648  0.547768  0.548195  1
  Al  Al34  1  1.002648  0.953078  0.610346  1
  Al  Al35  1  1.002648  0.356638  0.518675  1
  Al  Al36  1  1.002648  0.761976  0.581155  1
  Al  Al37  1  0.502648  0.170314  0.721880  1
  Al  Al38  1  0.502648  0.763129  0.658714  1
  Al  Al39  1  1.002648  0.059926  0.702803  1
  Al  Al40  1  1.002648  0.656347  0.642203  1
  Al  Al41  1  1.002648  0.283381  0.739778  1
  Al  Al42  1  1.002648  0.870109  0.674749  1
  Al  Al43  1  0.502648  0.465622  0.688764  1
  Al  Al44  1  0.502648  0.060872  0.627136  1
  Al  Al45  1  1.002648  0.358243  0.673187  1
  Al  Al46  1  1.002648  0.769638  0.736648  1
  Al  Al47  1  1.002648  0.168157  0.644187  1
  Al  Al48  1  1.002648  0.576008  0.707415  1
  Ni  Ni49  1  0.502648  0.827880  0.284487  1
  Ni  Ni50  1  0.502648  0.235427  0.345459  1
  Ni  Ni51  1  0.502648  0.679633  0.297768  1
  Ni  Ni52  1  0.502648  0.086981  0.361402  1
  Ni  Ni53  1  0.502648  0.884203  0.329962  1
  Ni  Ni54  1  0.502648  0.478242  0.269828  1
  Ni  Ni55  1  1.002648  0.689556  0.376120  1
  Ni  Ni56  1  1.002648  0.283112  0.312777  1
  Ni  Ni57  1  1.002648  0.779795  0.314747  1
  Ni  Ni58  1  1.002648  0.388758  0.255285  1
  Ni  Ni59  1  0.502648  0.115919  0.255745  1
  Ni  Ni60  1  0.502648  0.533721  0.315135  1
  Ni  Ni61  1  0.502648  0.976481  0.269193  1
  Ni  Ni62  1  0.502648  0.383190  0.329753  1
  Ni  Ni63  1  0.502648  0.587465  0.361606  1
  Ni  Ni64  1  0.502648  0.181478  0.298702  1
  Ni  Ni65  1  1.002648  0.986242  0.344698  1
  Ni  Ni66  1  1.002648  0.580779  0.282499  1
  Ni  Ni67  1  1.002648  0.076747  0.284504  1
  Ni  Ni68  1  1.002648  0.485089  0.347053  1
  Ni  Ni69  1  0.502648  0.641199  0.408325  1
  Ni  Ni70  1  0.502648  0.046553  0.470750  1
  Ni  Ni71  1  0.502648  0.492389  0.423926  1
  Ni  Ni72  1  0.502648  0.897916  0.486339  1
  Ni  Ni73  1  0.502648  0.695260  0.455165  1
  Ni  Ni74  1  0.502648  0.289548  0.392510  1
  Ni  Ni75  1  1.002648  0.500592  0.501427  1
  Ni  Ni76  1  1.002648  0.094944  0.438763  1
  Ni  Ni77  1  1.002648  0.592752  0.440340  1
  Ni  Ni78  1  1.002648  0.187182  0.377678  1
  Ni  Ni79  1  0.502648  0.938128  0.376821  1
  Ni  Ni80  1  0.502648  0.343769  0.439500  1
  Ni  Ni81  1  0.502648  0.789445  0.392362  1
  Ni  Ni82  1  0.502648  0.195196  0.455159  1
  Ni  Ni83  1  0.502648  0.397992  0.486475  1
  Ni  Ni84  1  0.502648  0.992335  0.423780  1
  Ni  Ni85  1  1.002648  0.797731  0.469991  1
  Ni  Ni86  1  1.002648  0.392090  0.407486  1
  Ni  Ni87  1  1.002648  0.889664  0.408769  1
  Ni  Ni88  1  1.002648  0.295405  0.471528  1
  Ni  Ni89  1  0.502648  0.452214  0.533444  1
  Ni  Ni90  1  0.502648  0.857441  0.595703  1
  Ni  Ni91  1  0.502648  0.303570  0.549037  1
  Ni  Ni92  1  0.502648  0.709096  0.611678  1
  Ni  Ni93  1  0.502648  0.506448  0.580436  1
  Ni  Ni94  1  0.502648  0.100802  0.517724  1
  Ni  Ni95  1  1.002648  0.311490  0.626535  1
  Ni  Ni96  1  1.002648  0.905943  0.563744  1
  Ni  Ni97  1  1.002648  0.403839  0.565437  1
  Ni  Ni98  1  1.002648  0.998158  0.502730  1
  Ni  Ni99  1  0.502648  0.749330  0.502037  1
  Ni  Ni100  1  0.502648  0.155058  0.564730  1
  Ni  Ni101  1  0.502648  0.600774  0.517776  1
  Ni  Ni102  1  0.502648  0.006384  0.580206  1
  Ni  Ni103  1  0.502648  0.209357  0.611805  1
  Ni  Ni104  1  0.502648  0.803400  0.548897  1
  Ni  Ni105  1  1.002648  0.609024  0.595389  1
  Ni  Ni106  1  1.002648  0.203393  0.532680  1
  Ni  Ni107  1  1.002648  0.700929  0.534090  1
  Ni  Ni108  1  1.002648  0.106756  0.596713  1
  Ni  Ni109  1  0.502648  0.263505  0.659124  1
  Ni  Ni110  1  0.502648  0.672320  0.719870  1
  Ni  Ni111  1  0.502648  0.115379  0.674458  1
  Ni  Ni112  1  0.502648  0.516843  0.734199  1
  Ni  Ni113  1  0.502648  0.319065  0.706125  1
  Ni  Ni114  1  0.502648  0.911176  0.642363  1
  Ni  Ni115  1  1.002648  0.109191  0.748035  1
  Ni  Ni116  1  1.002648  0.718860  0.689327  1
  Ni  Ni117  1  1.002648  0.215435  0.691467  1
  Ni  Ni118  1  1.002648  0.809062  0.627860  1
  Ni  Ni119  1  0.502648  0.560657  0.627487  1
  Ni  Ni120  1  0.502648  0.965241  0.688662  1
  Ni  Ni121  1  0.502648  0.411514  0.642698  1
  Ni  Ni122  1  0.502648  0.820175  0.705682  1
  Ni  Ni123  1  0.502648  0.014921  0.734008  1
  Ni  Ni124  1  0.502648  0.614885  0.674552  1
  Ni  Ni125  1  1.002648  0.421829  0.719275  1
  Ni  Ni126  1  1.002648  0.013674  0.657008  1
  Ni  Ni127  1  1.002648  0.512831  0.659587  1
  Ni  Ni128  1  1.002648  0.918222  0.721494  1
