# generated using pymatgen
data_Al3Ni5
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   7.67501567
_cell_length_b   19.69442917
_cell_length_c   50.50298816
_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   'Al108 Ni180'
_cell_volume   7633.7818236
_cell_formula_units_Z   36
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  0.497576  0.981504  0.330114  1
  Al  Al2  1  0.497576  0.639311  0.295812  1
  Al  Al3  1  0.497576  0.263195  0.280568  1
  Al  Al4  1  0.771010  0.962482  0.292750  1
  Al  Al5  1  0.778372  0.676301  0.339644  1
  Al  Al6  1  0.773413  0.318355  0.315035  1
  Al  Al7  1  0.224143  0.962482  0.292750  1
  Al  Al8  1  0.216780  0.676301  0.339644  1
  Al  Al9  1  0.221739  0.318355  0.315035  1
  Al  Al10  1  0.997576  0.836896  0.352347  1
  Al  Al11  1  0.997576  0.509470  0.326535  1
  Al  Al12  1  0.997576  0.120437  0.301239  1
  Al  Al13  1  0.273324  0.816869  0.314704  1
  Al  Al14  1  0.271585  0.461596  0.291783  1
  Al  Al15  1  0.275677  0.177952  0.339131  1
  Al  Al16  1  0.721829  0.816869  0.314704  1
  Al  Al17  1  0.723568  0.461596  0.291783  1
  Al  Al18  1  0.719475  0.177952  0.339131  1
  Al  Al19  1  0.497576  0.090771  0.394193  1
  Al  Al20  1  0.497576  0.696958  0.375232  1
  Al  Al21  1  0.497576  0.371511  0.347659  1
  Al  Al22  1  0.776704  0.035413  0.361284  1
  Al  Al23  1  0.774133  0.753051  0.409053  1
  Al  Al24  1  0.775074  0.393582  0.385682  1
  Al  Al25  1  0.218448  0.035413  0.361284  1
  Al  Al26  1  0.221020  0.753051  0.409053  1
  Al  Al27  1  0.220079  0.393582  0.385682  1
  Al  Al28  1  0.997576  0.948987  0.418088  1
  Al  Al29  1  0.997576  0.557455  0.400559  1
  Al  Al30  1  0.997576  0.230992  0.370676  1
  Al  Al31  1  0.275354  0.893758  0.385020  1
  Al  Al32  1  0.280099  0.536235  0.361266  1
  Al  Al33  1  0.276718  0.252277  0.409526  1
  Al  Al34  1  0.719799  0.893758  0.385020  1
  Al  Al35  1  0.715054  0.536235  0.361266  1
  Al  Al36  1  0.718434  0.252277  0.409526  1
  Al  Al37  1  0.497576  0.132986  0.472114  1
  Al  Al38  1  0.497576  0.807603  0.442061  1
  Al  Al39  1  0.497576  0.416093  0.424207  1
  Al  Al40  1  0.777937  0.111504  0.433382  1
  Al  Al41  1  0.778719  0.829103  0.481227  1
  Al  Al42  1  0.775089  0.470769  0.457369  1
  Al  Al43  1  0.217216  0.111504  0.433382  1
  Al  Al44  1  0.216433  0.829103  0.481227  1
  Al  Al45  1  0.220064  0.470769  0.457369  1
  Al  Al46  1  0.997576  0.991781  0.495994  1
  Al  Al47  1  0.997576  0.667312  0.466776  1
  Al  Al48  1  0.997576  0.274479  0.448233  1
  Al  Al49  1  0.278106  0.970568  0.457076  1
  Al  Al50  1  0.275125  0.611707  0.433777  1
  Al  Al51  1  0.275303  0.329499  0.481384  1
  Al  Al52  1  0.717047  0.970568  0.457076  1
  Al  Al53  1  0.720027  0.611707  0.433777  1
  Al  Al54  1  0.719850  0.329499  0.481384  1
  Al  Al55  1  0.497576  0.243329  0.538502  1
  Al  Al56  1  0.497576  0.850287  0.519704  1
  Al  Al57  1  0.497576  0.526099  0.490575  1
  Al  Al58  1  0.775283  0.188203  0.505258  1
  Al  Al59  1  0.775545  0.906122  0.552495  1
  Al  Al60  1  0.777924  0.547426  0.529361  1
  Al  Al61  1  0.219869  0.188203  0.505258  1
  Al  Al62  1  0.219607  0.906122  0.552495  1
  Al  Al63  1  0.217229  0.547426  0.529361  1
  Al  Al64  1  0.997576  0.102124  0.562408  1
  Al  Al65  1  0.997576  0.710276  0.544620  1
  Al  Al66  1  0.997576  0.384635  0.514459  1
  Al  Al67  1  0.275114  0.047192  0.529164  1
  Al  Al68  1  0.278803  0.688528  0.505454  1
  Al  Al69  1  0.278203  0.406156  0.553101  1
  Al  Al70  1  0.720038  0.047192  0.529164  1
  Al  Al71  1  0.716350  0.688528  0.505454  1
  Al  Al72  1  0.716949  0.406156  0.553101  1
  Al  Al73  1  0.497576  0.286509  0.616395  1
  Al  Al74  1  0.497576  0.960348  0.585367  1
  Al  Al75  1  0.497576  0.568860  0.568612  1
  Al  Al76  1  0.776693  0.265276  0.577379  1
  Al  Al77  1  0.781738  0.981298  0.625023  1
  Al  Al78  1  0.775077  0.624307  0.601735  1
  Al  Al79  1  0.218459  0.265276  0.577379  1
  Al  Al80  1  0.213414  0.981298  0.625023  1
  Al  Al81  1  0.220076  0.624307  0.601735  1
  Al  Al82  1  0.997576  0.146038  0.639393  1
  Al  Al83  1  0.997576  0.820127  0.612044  1
  Al  Al84  1  0.997576  0.427087  0.591986  1
  Al  Al85  1  0.274724  0.124328  0.600926  1
  Al  Al86  1  0.273394  0.764240  0.577939  1
  Al  Al87  1  0.278233  0.483029  0.625036  1
  Al  Al88  1  0.720429  0.124328  0.600926  1
  Al  Al89  1  0.721759  0.764240  0.577939  1
  Al  Al90  1  0.716919  0.483029  0.625036  1
  Al  Al91  1  0.497576  0.400947  0.685445  1
  Al  Al92  1  0.497576  1.006705  0.659010  1
  Al  Al93  1  0.497576  0.682382  0.634649  1
  Al  Al94  1  0.776117  0.339551  0.646757  1
  Al  Al95  1  0.775164  0.055416  0.694443  1
  Al  Al96  1  0.777236  0.702625  0.673064  1
  Al  Al97  1  0.219036  0.339551  0.646757  1
  Al  Al98  1  0.219989  0.055416  0.694443  1
  Al  Al99  1  0.217917  0.702625  0.673064  1
  Al  Al100  1  0.997576  0.257041  0.706223  1
  Al  Al101  1  0.997576  0.889280  0.692203  1
  Al  Al102  1  0.997576  0.533617  0.655450  1
  Al  Al103  1  0.277385  0.200062  0.672487  1
  Al  Al104  1  0.280842  0.841689  0.646050  1
  Al  Al105  1  0.274130  0.553832  0.693534  1
  Al  Al106  1  0.717767  0.200062  0.672487  1
  Al  Al107  1  0.714311  0.841689  0.646050  1
  Al  Al108  1  0.721023  0.553832  0.693534  1
  Ni  Ni109  1  0.497576  0.767834  0.286135  1
  Ni  Ni110  1  0.497576  0.491202  0.325869  1
  Ni  Ni111  1  0.497576  0.149743  0.303700  1
  Ni  Ni112  1  0.235790  0.704662  0.294345  1
  Ni  Ni113  1  0.227238  0.428871  0.337397  1
  Ni  Ni114  1  0.273334  0.070546  0.315096  1
  Ni  Ni115  1  0.759362  0.704662  0.294345  1
  Ni  Ni116  1  0.767914  0.428871  0.337397  1
  Ni  Ni117  1  0.721819  0.070546  0.315096  1
  Ni  Ni118  1  0.497576  0.734534  0.328748  1
  Ni  Ni119  1  0.497576  0.377821  0.301602  1
  Ni  Ni120  1  0.497576  0.033057  0.288091  1
  Ni  Ni121  1  0.497576  0.892650  0.298510  1
  Ni  Ni122  1  0.497576  0.609797  0.341461  1
  Ni  Ni123  1  0.497576  0.259564  0.327303  1
  Ni  Ni124  1  0.997576  1.004966  0.324861  1
  Ni  Ni125  1  0.997576  0.632750  0.307168  1
  Ni  Ni126  1  0.997576  0.284268  0.283759  1
  Ni  Ni127  1  0.774598  0.923540  0.338145  1
  Ni  Ni128  1  0.740038  0.572210  0.313162  1
  Ni  Ni129  1  0.767908  0.205808  0.293695  1
  Ni  Ni130  1  0.220554  0.923540  0.338145  1
  Ni  Ni131  1  0.255114  0.572210  0.313162  1
  Ni  Ni132  1  0.227244  0.205808  0.293695  1
  Ni  Ni133  1  0.997576  0.885366  0.309054  1
  Ni  Ni134  1  0.997576  0.530838  0.282300  1
  Ni  Ni135  1  0.997576  0.231687  0.323645  1
  Ni  Ni136  1  0.997576  0.750821  0.318352  1
  Ni  Ni137  1  0.997576  0.401541  0.304060  1
  Ni  Ni138  1  0.997576  0.118114  0.349350  1
  Ni  Ni139  1  0.497576  0.861742  0.346699  1
  Ni  Ni140  1  0.497576  0.580748  0.396663  1
  Ni  Ni141  1  0.497576  0.207795  0.374540  1
  Ni  Ni142  1  0.278063  0.783041  0.361613  1
  Ni  Ni143  1  0.273670  0.500783  0.409787  1
  Ni  Ni144  1  0.217825  0.145661  0.385148  1
  Ni  Ni145  1  0.717089  0.783041  0.361613  1
  Ni  Ni146  1  0.721482  0.500783  0.409787  1
  Ni  Ni147  1  0.777328  0.145661  0.385148  1
  Ni  Ni148  1  0.497576  0.810584  0.394235  1
  Ni  Ni149  1  0.497576  0.461128  0.379254  1
  Ni  Ni150  1  0.497576  0.094776  0.346668  1
  Ni  Ni151  1  0.497576  0.976900  0.376836  1
  Ni  Ni152  1  0.497576  0.694103  0.423283  1
  Ni  Ni153  1  0.497576  0.326727  0.392136  1
  Ni  Ni154  1  0.997576  0.065575  0.397870  1
  Ni  Ni155  1  0.997576  0.721738  0.372976  1
  Ni  Ni156  1  0.997576  0.349727  0.349519  1
  Ni  Ni157  1  0.721182  1.005524  0.408705  1
  Ni  Ni158  1  0.772840  0.640987  0.386830  1
  Ni  Ni159  1  0.721401  0.288259  0.361382  1
  Ni  Ni160  1  0.273970  1.005524  0.408705  1
  Ni  Ni161  1  0.222313  0.640987  0.386830  1
  Ni  Ni162  1  0.273752  0.288259  0.361382  1
  Ni  Ni163  1  0.997576  0.951290  0.370131  1
  Ni  Ni164  1  0.997576  0.602047  0.356015  1
  Ni  Ni165  1  0.997576  0.319466  0.403313  1
  Ni  Ni166  1  0.997576  0.835622  0.399909  1
  Ni  Ni167  1  0.997576  0.466639  0.369585  1
  Ni  Ni168  1  0.997576  0.186358  0.415606  1
  Ni  Ni169  1  0.497576  0.924910  0.422137  1
  Ni  Ni170  1  0.497576  0.643039  0.470223  1
  Ni  Ni171  1  0.497576  0.298369  0.444459  1
  Ni  Ni172  1  0.220848  0.864230  0.432643  1
  Ni  Ni173  1  0.220456  0.582138  0.481060  1
  Ni  Ni174  1  0.274325  0.217981  0.457907  1
  Ni  Ni175  1  0.774304  0.864230  0.432643  1
  Ni  Ni176  1  0.774697  0.582138  0.481060  1
  Ni  Ni177  1  0.720827  0.217981  0.457907  1
  Ni  Ni178  1  0.497576  0.895279  0.474956  1
  Ni  Ni179  1  0.497576  0.528959  0.442854  1
  Ni  Ni180  1  0.497576  0.177886  0.427394  1
  Ni  Ni181  1  0.497576  0.045552  0.439016  1
  Ni  Ni182  1  0.497576  0.762937  0.486848  1
  Ni  Ni183  1  0.497576  0.412603  0.471934  1
  Ni  Ni184  1  0.997576  0.157128  0.468416  1
  Ni  Ni185  1  0.997576  0.783908  0.445947  1
  Ni  Ni186  1  0.997576  0.439463  0.420539  1
  Ni  Ni187  1  0.774662  0.076712  0.481759  1
  Ni  Ni188  1  0.720775  0.723183  0.456625  1
  Ni  Ni189  1  0.773814  0.359087  0.433984  1
  Ni  Ni190  1  0.220491  0.076712  0.481759  1
  Ni  Ni191  1  0.274377  0.723183  0.456625  1
  Ni  Ni192  1  0.221339  0.359087  0.433984  1
  Ni  Ni193  1  0.997576  0.036481  0.451144  1
  Ni  Ni194  1  0.997576  0.670871  0.419121  1
  Ni  Ni195  1  0.997576  0.387815  0.466822  1
  Ni  Ni196  1  0.997576  0.904259  0.463010  1
  Ni  Ni197  1  0.997576  0.553836  0.448253  1
  Ni  Ni198  1  0.997576  0.271245  0.495925  1
  Ni  Ni199  1  0.497576  1.015990  0.492150  1
  Ni  Ni200  1  0.497576  0.733873  0.540913  1
  Ni  Ni201  1  0.497576  0.360626  0.518144  1
  Ni  Ni202  1  0.274566  0.935816  0.505316  1
  Ni  Ni203  1  0.274241  0.653475  0.554062  1
  Ni  Ni204  1  0.220903  0.299539  0.528782  1
  Ni  Ni205  1  0.720586  0.935816  0.505316  1
  Ni  Ni206  1  0.720911  0.653475  0.554062  1
  Ni  Ni207  1  0.774249  0.299539  0.528782  1
  Ni  Ni208  1  0.497576  0.963955  0.537854  1
  Ni  Ni209  1  0.497576  0.613491  0.523699  1
  Ni  Ni210  1  0.497576  0.246375  0.490776  1
  Ni  Ni211  1  0.497576  0.130166  0.519760  1
  Ni  Ni212  1  0.497576  0.846169  0.567336  1
  Ni  Ni213  1  0.497576  0.481489  0.535449  1
  Ni  Ni214  1  0.997576  0.219453  0.542232  1
  Ni  Ni215  1  0.997576  0.874494  0.516304  1
  Ni  Ni216  1  0.997576  0.501867  0.494316  1
  Ni  Ni217  1  0.721138  0.158858  0.552655  1
  Ni  Ni218  1  0.774247  0.794279  0.530170  1
  Ni  Ni219  1  0.720634  0.441134  0.504780  1
  Ni  Ni220  1  0.274015  0.158858  0.552655  1
  Ni  Ni221  1  0.220906  0.794279  0.530170  1
  Ni  Ni222  1  0.274518  0.441134  0.504780  1
  Ni  Ni223  1  0.997576  0.105183  0.514670  1
  Ni  Ni224  1  0.997576  0.754545  0.499759  1
  Ni  Ni225  1  0.997576  0.472481  0.547293  1
  Ni  Ni226  1  0.997576  0.989237  0.543697  1
  Ni  Ni227  1  0.997576  0.622713  0.511569  1
  Ni  Ni228  1  0.997576  0.339362  0.559160  1
  Ni  Ni229  1  0.497576  0.078620  0.565975  1
  Ni  Ni230  1  0.497576  0.795705  0.613202  1
  Ni  Ni231  1  0.497576  0.452358  0.588512  1
  Ni  Ni232  1  0.221079  1.017167  0.576701  1
  Ni  Ni233  1  0.213434  0.733866  0.625929  1
  Ni  Ni234  1  0.277916  0.372572  0.601248  1
  Ni  Ni235  1  0.774074  1.017167  0.576701  1
  Ni  Ni236  1  0.781719  0.733866  0.625929  1
  Ni  Ni237  1  0.717236  0.372572  0.601248  1
  Ni  Ni238  1  0.497576  0.051053  0.616401  1
  Ni  Ni239  1  0.497576  0.681819  0.586853  1
  Ni  Ni240  1  0.497576  0.331181  0.571197  1
  Ni  Ni241  1  0.497576  0.198450  0.583491  1
  Ni  Ni242  1  0.497576  0.915538  0.629392  1
  Ni  Ni243  1  0.497576  0.568234  0.616713  1
  Ni  Ni244  1  0.997576  0.309379  0.611885  1
  Ni  Ni245  1  0.997576  0.936740  0.589702  1
  Ni  Ni246  1  0.997576  0.593079  0.564306  1
  Ni  Ni247  1  0.772774  0.228424  0.625879  1
  Ni  Ni248  1  0.723852  0.876879  0.599191  1
  Ni  Ni249  1  0.773841  0.512503  0.577624  1
  Ni  Ni250  1  0.222378  0.228424  0.625879  1
  Ni  Ni251  1  0.271300  0.876879  0.599191  1
  Ni  Ni252  1  0.221312  0.512503  0.577624  1
  Ni  Ni253  1  0.997576  0.190879  0.594919  1
  Ni  Ni254  1  0.997576  0.823723  0.563761  1
  Ni  Ni255  1  0.997576  0.541261  0.609101  1
  Ni  Ni256  1  0.997576  0.057258  0.607300  1
  Ni  Ni257  1  0.997576  0.706964  0.592441  1
  Ni  Ni258  1  0.997576  0.421670  0.639089  1
  Ni  Ni259  1  0.497576  0.167882  0.637182  1
  Ni  Ni260  1  0.497576  0.886309  0.678661  1
  Ni  Ni261  1  0.497576  0.514146  0.661155  1
  Ni  Ni262  1  0.268826  0.089138  0.649120  1
  Ni  Ni263  1  0.257251  0.820291  0.691160  1
  Ni  Ni264  1  0.221500  0.446361  0.671026  1
  Ni  Ni265  1  0.726326  0.089138  0.649120  1
  Ni  Ni266  1  0.737901  0.820291  0.691160  1
  Ni  Ni267  1  0.773653  0.446361  0.671026  1
  Ni  Ni268  1  0.497576  0.111446  0.681403  1
  Ni  Ni269  1  0.497576  0.767957  0.668976  1
  Ni  Ni270  1  0.497576  0.399564  0.637511  1
  Ni  Ni271  1  0.497576  0.287745  0.664066  1
  Ni  Ni272  1  0.497576  0.988922  0.703482  1
  Ni  Ni273  1  0.497576  0.633862  0.677774  1
  Ni  Ni274  1  0.997576  0.369391  0.682202  1
  Ni  Ni275  1  0.997576  0.026005  0.660455  1
  Ni  Ni276  1  0.997576  0.655180  0.640241  1
  Ni  Ni277  1  0.734108  0.317093  0.692033  1
  Ni  Ni278  1  0.753026  0.945617  0.672790  1
  Ni  Ni279  1  0.723225  0.596269  0.648820  1
  Ni  Ni280  1  0.261045  0.317093  0.692033  1
  Ni  Ni281  1  0.242126  0.945617  0.672790  1
  Ni  Ni282  1  0.271928  0.596269  0.648820  1
  Ni  Ni283  1  0.997576  0.258260  0.659694  1
  Ni  Ni284  1  0.997576  0.907212  0.645714  1
  Ni  Ni285  1  0.997576  0.618863  0.686818  1
  Ni  Ni286  1  0.997576  0.141882  0.685426  1
  Ni  Ni287  1  0.997576  0.788452  0.660947  1
  Ni  Ni288  1  0.997576  0.485667  0.698027  1
