# generated using pymatgen
data_Al3Ni5
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   7.69220303
_cell_length_b   12.77114135
_cell_length_c   48.23152870
_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   4738.17914966
_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  0.486596  0.863502  0.297182  1
  Al  Al2  1  0.492673  0.293205  0.263477  1
  Al  Al3  1  0.778470  0.792238  0.267703  1
  Al  Al4  1  0.772099  0.333093  0.304306  1
  Al  Al5  1  0.217699  0.881877  0.340035  1
  Al  Al6  1  0.222626  0.332476  0.304416  1
  Al  Al7  1  -0.000829  0.596118  0.324800  1
  Al  Al8  1  0.991161  0.076410  0.278435  1
  Al  Al9  1  0.273318  0.558304  0.285339  1
  Al  Al10  1  0.272611  0.108959  0.324409  1
  Al  Al11  1  0.729598  0.556320  0.285194  1
  Al  Al12  1  0.719452  0.108336  0.323956  1
  Al  Al13  1  0.496174  0.896371  0.379930  1
  Al  Al14  1  0.497225  0.359710  0.343922  1
  Al  Al15  1  0.772272  0.881084  0.339644  1
  Al  Al16  1  0.770694  0.422970  0.380676  1
  Al  Al17  1  0.221491  0.971726  0.418356  1
  Al  Al18  1  0.222239  0.423010  0.380685  1
  Al  Al19  1  0.996460  0.693775  0.399088  1
  Al  Al20  1  0.996028  0.127039  0.362604  1
  Al  Al21  1  0.277637  0.655908  0.359807  1
  Al  Al22  1  0.272599  0.195610  0.399473  1
  Al  Al23  1  0.715398  0.654572  0.360449  1
  Al  Al24  1  0.720183  0.195543  0.399434  1
  Al  Al25  1  0.496431  0.040941  0.454730  1
  Al  Al26  1  0.496412  0.484684  0.417477  1
  Al  Al27  1  0.771120  0.971776  0.418253  1
  Al  Al28  1  0.773730  0.516861  0.457129  1
  Al  Al29  1  0.217863  0.062547  0.495966  1
  Al  Al30  1  0.219291  0.517133  0.457027  1
  Al  Al31  1  0.996418  0.807010  0.474721  1
  Al  Al32  1  0.996395  0.267654  0.435732  1
  Al  Al33  1  0.271814  0.746101  0.437085  1
  Al  Al34  1  0.274302  0.289047  0.476781  1
  Al  Al35  1  0.720991  0.746293  0.437025  1
  Al  Al36  1  0.718704  0.289100  0.476761  1
  Al  Al37  1  0.496545  0.083924  0.536865  1
  Al  Al38  1  0.496500  0.561603  0.495957  1
  Al  Al39  1  0.775108  0.062526  0.495970  1
  Al  Al40  1  0.773547  0.609106  0.534653  1
  Al  Al41  1  0.221777  0.154175  0.573084  1
  Al  Al42  1  0.219406  0.609301  0.534569  1
  Al  Al43  1  -0.003432  0.858537  0.556290  1
  Al  Al44  1  -0.003441  0.316831  0.517152  1
  Al  Al45  1  0.274521  0.836668  0.515035  1
  Al  Al46  1  0.271866  0.380283  0.554478  1
  Al  Al47  1  0.718430  0.836699  0.515022  1
  Al  Al48  1  0.721282  0.380396  0.554454  1
  Al  Al49  1  0.496784  0.228807  0.610582  1
  Al  Al50  1  0.496579  0.643491  0.574380  1
  Al  Al51  1  0.771560  0.154305  0.572976  1
  Al  Al52  1  0.769445  0.703245  0.611521  1
  Al  Al53  1  0.219749  0.243622  0.651184  1
  Al  Al54  1  0.223454  0.703346  0.611499  1
  Al  Al55  1  -0.003115  0.996319  0.629810  1
  Al  Al56  1  -0.003478  0.436738  0.591910  1
  Al  Al57  1  0.271366  0.928861  0.592788  1
  Al  Al58  1  0.277615  0.472982  0.631138  1
  Al  Al59  1  0.721708  0.928824  0.592785  1
  Al  Al60  1  0.715227  0.471926  0.631658  1
  Al  Al61  1  0.504512  0.266084  0.693097  1
  Al  Al62  1  0.495833  0.769595  0.648730  1
  Al  Al63  1  0.776041  0.243139  0.650923  1
  Al  Al64  1  0.773105  0.795224  0.688991  1
  Al  Al65  1  0.213493  0.331723  0.723788  1
  Al  Al66  1  0.217010  0.794873  0.689011  1
  Al  Al67  1  0.002187  0.063746  0.714463  1
  Al  Al68  1  0.994452  0.519367  0.666364  1
  Al  Al69  1  0.278391  1.017593  0.666654  1
  Al  Al70  1  0.262184  0.565989  0.706148  1
  Al  Al71  1  0.715119  1.017187  0.666144  1
  Al  Al72  1  0.719903  0.564456  0.706088  1
  Ni  Ni73  1  0.497220  0.600503  0.322266  1
  Ni  Ni74  1  0.494836  0.059469  0.288744  1
  Ni  Ni75  1  0.261628  0.488634  0.332712  1
  Ni  Ni76  1  0.224626  0.964110  0.293523  1
  Ni  Ni77  1  0.733807  0.489654  0.332758  1
  Ni  Ni78  1  0.759580  0.960075  0.293287  1
  Ni  Ni79  1  0.498474  0.434694  0.298662  1
  Ni  Ni80  1  0.495764  0.984640  0.335147  1
  Ni  Ni81  1  0.508678  0.688621  0.281883  1
  Ni  Ni82  1  0.496228  0.228053  0.308981  1
  Ni  Ni83  1  0.996221  0.833786  0.303441  1
  Ni  Ni84  1  -0.003276  0.272009  0.272365  1
  Ni  Ni85  1  0.750076  0.717921  0.312520  1
  Ni  Ni86  1  0.725821  0.174039  0.277669  1
  Ni  Ni87  1  0.249094  0.724286  0.310238  1
  Ni  Ni88  1  0.261268  0.171826  0.278077  1
  Ni  Ni89  1  0.001434  0.667540  0.280551  1
  Ni  Ni90  1  -0.003350  0.205204  0.316181  1
  Ni  Ni91  1  0.000209  0.455919  0.291554  1
  Ni  Ni92  1  0.994393  1.004363  0.324834  1
  Ni  Ni93  1  0.496170  0.700286  0.398809  1
  Ni  Ni94  1  0.496604  0.165338  0.359897  1
  Ni  Ni95  1  0.241764  0.585753  0.408413  1
  Ni  Ni96  1  0.271776  0.032333  0.370775  1
  Ni  Ni97  1  0.751867  0.585248  0.408751  1
  Ni  Ni98  1  0.720399  0.032146  0.370531  1
  Ni  Ni99  1  0.495677  0.524222  0.369063  1
  Ni  Ni100  1  0.496371  0.064182  0.404951  1
  Ni  Ni101  1  0.496881  0.774205  0.340815  1
  Ni  Ni102  1  0.496378  0.323130  0.392691  1
  Ni  Ni103  1  0.995902  0.935043  0.378007  1
  Ni  Ni104  1  -0.002918  0.390048  0.339615  1
  Ni  Ni105  1  0.767170  0.812952  0.388660  1
  Ni  Ni106  1  0.772061  0.263703  0.351712  1
  Ni  Ni107  1  0.225675  0.812827  0.388847  1
  Ni  Ni108  1  0.221183  0.264223  0.351867  1
  Ni  Ni109  1  0.995498  0.756967  0.351401  1
  Ni  Ni110  1  0.996376  0.294897  0.386557  1
  Ni  Ni111  1  -0.003413  0.544269  0.371456  1
  Ni  Ni112  1  0.996452  0.099693  0.412075  1
  Ni  Ni113  1  0.496506  0.781930  0.477303  1
  Ni  Ni114  1  0.496499  0.231807  0.439173  1
  Ni  Ni115  1  0.238279  0.678513  0.485630  1
  Ni  Ni116  1  0.219846  0.133257  0.447528  1
  Ni  Ni117  1  0.754683  0.678475  0.485624  1
  Ni  Ni118  1  0.773004  0.133202  0.447519  1
  Ni  Ni119  1  0.496684  0.624749  0.448994  1
  Ni  Ni120  1  0.496527  0.167456  0.491645  1
  Ni  Ni121  1  0.496277  0.874310  0.429949  1
  Ni  Ni122  1  0.496406  0.413362  0.463963  1
  Ni  Ni123  1  0.996406  1.003555  0.458471  1
  Ni  Ni124  1  -0.003333  0.464800  0.419453  1
  Ni  Ni125  1  0.723972  0.906789  0.466264  1
  Ni  Ni126  1  0.723684  0.358305  0.428567  1
  Ni  Ni127  1  0.268931  0.906695  0.466303  1
  Ni  Ni128  1  0.269230  0.358229  0.428589  1
  Ni  Ni129  1  0.996257  0.847797  0.426188  1
  Ni  Ni130  1  -0.003291  0.395624  0.471729  1
  Ni  Ni131  1  0.996217  0.645109  0.447565  1
  Ni  Ni132  1  0.996447  0.184914  0.481240  1
  Ni  Ni133  1  0.496487  0.893187  0.552949  1
  Ni  Ni134  1  0.496469  0.345706  0.514180  1
  Ni  Ni135  1  0.268039  0.767415  0.563336  1
  Ni  Ni136  1  0.270183  0.219084  0.525275  1
  Ni  Ni137  1  0.725017  0.767500  0.563335  1
  Ni  Ni138  1  0.722843  0.219202  0.525228  1
  Ni  Ni139  1  0.496549  0.711742  0.527470  1
  Ni  Ni140  1  0.496631  0.251996  0.560902  1
  Ni  Ni141  1  0.496455  0.957936  0.499962  1
  Ni  Ni142  1  0.496391  0.502348  0.543219  1
  Ni  Ni143  1  -0.003439  0.121589  0.533389  1
  Ni  Ni144  1  -0.003513  0.564231  0.495642  1
  Ni  Ni145  1  0.772815  0.991656  0.544530  1
  Ni  Ni146  1  0.757804  0.447472  0.506029  1
  Ni  Ni147  1  0.220255  0.991717  0.544525  1
  Ni  Ni148  1  0.235221  0.447547  0.506007  1
  Ni  Ni149  1  -0.003487  0.939918  0.510580  1
  Ni  Ni150  1  -0.003302  0.480662  0.543181  1
  Ni  Ni151  1  0.996322  0.730728  0.520351  1
  Ni  Ni152  1  -0.003239  0.279337  0.565917  1
  Ni  Ni153  1  0.496188  0.959255  0.631524  1
  Ni  Ni154  1  0.496745  0.425430  0.593041  1
  Ni  Ni155  1  0.217952  0.860451  0.641055  1
  Ni  Ni156  1  0.224447  0.314336  0.602669  1
  Ni  Ni157  1  0.774684  0.859916  0.640958  1
  Ni  Ni158  1  0.768819  0.314409  0.602570  1
  Ni  Ni159  1  0.496566  0.802844  0.599667  1
  Ni  Ni160  1  0.496588  0.351551  0.649021  1
  Ni  Ni161  1  0.496596  0.058993  0.586472  1
  Ni  Ni162  1  0.497014  0.604627  0.623215  1
  Ni  Ni163  1  -0.002890  0.188637  0.613153  1
  Ni  Ni164  1  0.996310  0.660313  0.572586  1
  Ni  Ni165  1  0.722001  0.093095  0.620235  1
  Ni  Ni166  1  0.748181  0.541449  0.583220  1
  Ni  Ni167  1  0.271812  0.092959  0.620479  1
  Ni  Ni168  1  0.244296  0.541863  0.582933  1
  Ni  Ni169  1  -0.003527  0.026183  0.580235  1
  Ni  Ni170  1  0.996365  0.583693  0.620863  1
  Ni  Ni171  1  0.996460  0.829585  0.605419  1
  Ni  Ni172  1  -0.002532  0.365343  0.638372  1
  Ni  Ni173  1  0.498492  0.072512  0.701404  1
  Ni  Ni174  1  0.495704  0.524594  0.669368  1
  Ni  Ni175  1  0.266491  0.964861  0.712885  1
  Ni  Ni176  1  0.249036  0.404289  0.678927  1
  Ni  Ni177  1  0.734036  0.966867  0.712303  1
  Ni  Ni178  1  0.741346  0.399403  0.681114  1
  Ni  Ni179  1  0.497131  0.895905  0.686249  1
  Ni  Ni180  1  0.484944  0.437357  0.710286  1
  Ni  Ni181  1  0.497071  0.143634  0.655430  1
  Ni  Ni182  1  0.493742  0.689054  0.692881  1
  Ni  Ni183  1  -0.002625  0.292428  0.687520  1
  Ni  Ni184  1  0.995884  0.737905  0.652471  1
  Ni  Ni185  1  0.764355  0.162959  0.697068  1
  Ni  Ni186  1  0.735901  0.638872  0.659790  1
  Ni  Ni187  1  0.236792  0.166462  0.697285  1
  Ni  Ni188  1  0.254941  0.638174  0.659679  1
  Ni  Ni189  1  -0.001548  0.119795  0.667037  1
  Ni  Ni190  1  0.992048  0.660704  0.697318  1
  Ni  Ni191  1  0.995779  0.927367  0.678348  1
  Ni  Ni192  1  0.990677  0.457238  0.711419  1
