# generated using pymatgen
data_Al3Ni5
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   5.59494894
_cell_length_b   24.05355410
_cell_length_c   50.87936316
_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   6847.26364174
_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  0.060802  0.263787  0.312228  1
  Al  Al2  1  0.060802  0.588876  0.288556  1
  Al  Al3  1  0.060802  0.914807  0.257883  1
  Al  Al4  1  0.060802  0.336605  0.266615  1
  Al  Al5  1  0.060802  0.688680  0.318937  1
  Al  Al6  1  0.060802  0.012080  0.294528  1
  Al  Al7  1  0.060802  0.164982  0.279937  1
  Al  Al8  1  0.060802  0.497401  0.254144  1
  Al  Al9  1  0.060802  0.839431  0.306950  1
  Al  Al10  1  0.560802  0.081541  0.246952  1
  Al  Al11  1  0.560802  0.426617  0.300263  1
  Al  Al12  1  0.560802  0.749393  0.269689  1
  Al  Al13  1  0.560802  0.172700  0.279611  1
  Al  Al14  1  0.560802  0.502101  0.255105  1
  Al  Al15  1  0.560802  0.850711  0.306152  1
  Al  Al16  1  0.560802  0.330424  0.266641  1
  Al  Al17  1  0.560802  0.677694  0.319714  1
  Al  Al18  1  0.560802  0.001531  0.294877  1
  Al  Al19  1  0.060802  0.290059  0.389099  1
  Al  Al20  1  0.060802  0.615138  0.365167  1
  Al  Al21  1  0.060802  0.938978  0.337953  1
  Al  Al22  1  0.060802  0.363025  0.343835  1
  Al  Al23  1  0.060802  0.714232  0.395764  1
  Al  Al24  1  0.060802  0.038662  0.370503  1
  Al  Al25  1  0.060802  0.190630  0.357370  1
  Al  Al26  1  0.060802  0.515471  0.332876  1
  Al  Al27  1  0.060802  0.866067  0.383419  1
  Al  Al28  1  0.560802  0.101864  0.326294  1
  Al  Al29  1  0.560802  0.452560  0.377105  1
  Al  Al30  1  0.560802  0.776469  0.349928  1
  Al  Al31  1  0.560802  0.200807  0.356625  1
  Al  Al32  1  0.560802  0.525707  0.331913  1
  Al  Al33  1  0.560802  0.876217  0.382606  1
  Al  Al34  1  0.560802  0.352864  0.344684  1
  Al  Al35  1  0.560802  0.704038  0.396438  1
  Al  Al36  1  0.560802  0.028524  0.371390  1
  Al  Al37  1  0.060802  0.316311  0.466040  1
  Al  Al38  1  0.060802  0.641267  0.441676  1
  Al  Al39  1  0.060802  0.965467  0.415058  1
  Al  Al40  1  0.060802  0.389465  0.420964  1
  Al  Al41  1  0.060802  0.740470  0.472511  1
  Al  Al42  1  0.060802  0.065081  0.447255  1
  Al  Al43  1  0.060802  0.216896  0.434368  1
  Al  Al44  1  0.060802  0.541722  0.409743  1
  Al  Al45  1  0.060802  0.892344  0.460253  1
  Al  Al46  1  0.560802  0.128033  0.402682  1
  Al  Al47  1  0.560802  0.478807  0.454017  1
  Al  Al48  1  0.560802  0.803009  0.427282  1
  Al  Al49  1  0.560802  0.227183  0.433621  1
  Al  Al50  1  0.560802  0.551947  0.408988  1
  Al  Al51  1  0.560802  0.902640  0.459467  1
  Al  Al52  1  0.560802  0.379210  0.421747  1
  Al  Al53  1  0.560802  0.730150  0.473265  1
  Al  Al54  1  0.560802  0.054773  0.448009  1
  Al  Al55  1  0.060802  0.342656  0.542994  1
  Al  Al56  1  0.060802  0.667587  0.518583  1
  Al  Al57  1  0.060802  -0.008166  0.492094  1
  Al  Al58  1  0.060802  0.415815  0.497923  1
  Al  Al59  1  0.060802  0.766577  0.549253  1
  Al  Al60  1  0.060802  0.091352  0.524165  1
  Al  Al61  1  0.060802  0.243071  0.511114  1
  Al  Al62  1  0.060802  0.567998  0.486641  1
  Al  Al63  1  0.060802  0.918672  0.537195  1
  Al  Al64  1  0.560802  0.154158  0.479408  1
  Al  Al65  1  0.560802  0.505208  0.531072  1
  Al  Al66  1  0.560802  0.829418  0.504366  1
  Al  Al67  1  0.560802  0.253401  0.510382  1
  Al  Al68  1  0.560802  0.578298  0.485857  1
  Al  Al69  1  0.560802  0.928934  0.536430  1
  Al  Al70  1  0.560802  0.405511  0.498714  1
  Al  Al71  1  0.560802  0.756325  0.549925  1
  Al  Al72  1  0.560802  0.081093  0.524923  1
  Al  Al73  1  0.060802  0.369224  0.619961  1
  Al  Al74  1  0.060802  0.693903  0.595746  1
  Al  Al75  1  0.060802  0.018131  0.569030  1
  Al  Al76  1  0.060802  0.442108  0.574708  1
  Al  Al77  1  0.060802  0.792478  0.625652  1
  Al  Al78  1  0.060802  0.117793  0.601335  1
  Al  Al79  1  0.060802  0.269323  0.587641  1
  Al  Al80  1  0.060802  0.594380  0.563459  1
  Al  Al81  1  0.060802  0.945119  0.614310  1
  Al  Al82  1  0.560802  0.180320  0.556228  1
  Al  Al83  1  0.560802  0.531645  0.608229  1
  Al  Al84  1  0.560802  0.855710  0.581221  1
  Al  Al85  1  0.560802  0.279577  0.586751  1
  Al  Al86  1  0.560802  0.604546  0.562685  1
  Al  Al87  1  0.560802  0.955182  0.613425  1
  Al  Al88  1  0.560802  0.431955  0.575579  1
  Al  Al89  1  0.560802  0.781730  0.626539  1
  Al  Al90  1  0.560802  0.107655  0.602079  1
  Al  Al91  1  0.060802  0.391295  0.700048  1
  Al  Al92  1  0.060802  0.720556  0.675543  1
  Al  Al93  1  0.060802  0.044652  0.645678  1
  Al  Al94  1  0.060802  0.468717  0.651257  1
  Al  Al95  1  0.060802  0.815444  0.703646  1
  Al  Al96  1  0.060802  0.143764  0.679017  1
  Al  Al97  1  0.060802  0.297067  0.662793  1
  Al  Al98  1  0.060802  0.619403  0.639993  1
  Al  Al99  1  0.060802  0.970924  0.691545  1
  Al  Al100  1  0.560802  0.206888  0.633127  1
  Al  Al101  1  0.560802  0.556629  0.688302  1
  Al  Al102  1  0.560802  0.882247  0.657571  1
  Al  Al103  1  0.560802  0.306961  0.662647  1
  Al  Al104  1  0.560802  0.630913  0.639188  1
  Al  Al105  1  0.560802  -0.021184  0.691328  1
  Al  Al106  1  0.560802  0.457240  0.651895  1
  Al  Al107  1  0.560802  0.802565  0.703038  1
  Al  Al108  1  0.560802  0.136660  0.679704  1
  Ni  Ni109  1  0.560802  0.263501  0.312364  1
  Ni  Ni110  1  0.560802  0.587551  0.289900  1
  Ni  Ni111  1  0.560802  0.916383  0.260942  1
  Ni  Ni112  1  0.310019  0.182361  0.318433  1
  Ni  Ni113  1  0.306919  0.507153  0.293914  1
  Ni  Ni114  1  0.310896  0.833486  0.268183  1
  Ni  Ni115  1  0.312434  0.344745  0.305682  1
  Ni  Ni116  1  0.313095  0.668991  0.280823  1
  Ni  Ni117  1  0.307336  -0.000339  0.255959  1
  Ni  Ni118  1  0.299773  0.250885  0.273574  1
  Ni  Ni119  1  0.310677  0.585273  0.250047  1
  Ni  Ni120  1  0.291498  0.925561  0.298993  1
  Ni  Ni121  1  0.821832  0.250885  0.273574  1
  Ni  Ni122  1  0.810928  0.585273  0.250047  1
  Ni  Ni123  1  0.830107  0.925561  0.298993  1
  Ni  Ni124  1  0.060802  0.085428  0.249295  1
  Ni  Ni125  1  0.060802  0.425696  0.300785  1
  Ni  Ni126  1  0.060802  0.749989  0.272726  1
  Ni  Ni127  1  0.809171  0.344745  0.305682  1
  Ni  Ni128  1  0.808510  0.668991  0.280823  1
  Ni  Ni129  1  0.814269  -0.000339  0.255959  1
  Ni  Ni130  1  0.811586  0.182361  0.318433  1
  Ni  Ni131  1  0.814686  0.507153  0.293914  1
  Ni  Ni132  1  0.810709  0.833486  0.268183  1
  Ni  Ni133  1  0.794648  0.087281  0.288216  1
  Ni  Ni134  1  0.803376  0.416953  0.261729  1
  Ni  Ni135  1  0.791362  0.763421  0.310777  1
  Ni  Ni136  1  0.326957  0.087281  0.288216  1
  Ni  Ni137  1  0.318229  0.416953  0.261729  1
  Ni  Ni138  1  0.330243  0.763421  0.310777  1
  Ni  Ni139  1  0.560802  0.290063  0.389085  1
  Ni  Ni140  1  0.560802  0.615167  0.365115  1
  Ni  Ni141  1  0.560802  0.938732  0.337636  1
  Ni  Ni142  1  0.310796  0.208946  0.395512  1
  Ni  Ni143  1  0.311215  0.533758  0.370867  1
  Ni  Ni144  1  0.310581  0.857975  0.344745  1
  Ni  Ni145  1  0.310645  0.371217  0.382809  1
  Ni  Ni146  1  0.310617  0.695923  0.357716  1
  Ni  Ni147  1  0.311994  0.020478  0.332760  1
  Ni  Ni148  1  0.296687  0.276854  0.350644  1
  Ni  Ni149  1  0.294884  0.602141  0.327044  1
  Ni  Ni150  1  0.297210  0.952187  0.376492  1
  Ni  Ni151  1  0.824918  0.276854  0.350644  1
  Ni  Ni152  1  0.826721  0.602141  0.327044  1
  Ni  Ni153  1  0.824395  0.952187  0.376492  1
  Ni  Ni154  1  0.060802  0.101561  0.326110  1
  Ni  Ni155  1  0.060802  0.452626  0.377099  1
  Ni  Ni156  1  0.060802  0.776369  0.349580  1
  Ni  Ni157  1  0.810960  0.371217  0.382809  1
  Ni  Ni158  1  0.810988  0.695923  0.357716  1
  Ni  Ni159  1  0.809610  0.020478  0.332760  1
  Ni  Ni160  1  0.810809  0.208946  0.395512  1
  Ni  Ni161  1  0.810390  0.533758  0.370867  1
  Ni  Ni162  1  0.811024  0.857975  0.344745  1
  Ni  Ni163  1  0.797376  0.114844  0.364433  1
  Ni  Ni164  1  0.796193  0.439437  0.338723  1
  Ni  Ni165  1  0.797124  0.789821  0.388595  1
  Ni  Ni166  1  0.324229  0.114844  0.364433  1
  Ni  Ni167  1  0.325412  0.439437  0.338723  1
  Ni  Ni168  1  0.324481  0.789821  0.388595  1
  Ni  Ni169  1  0.560802  0.316294  0.466034  1
  Ni  Ni170  1  0.560802  0.641259  0.441762  1
  Ni  Ni171  1  0.560802  0.965519  0.415060  1
  Ni  Ni172  1  0.310801  0.235136  0.472389  1
  Ni  Ni173  1  0.310755  0.560000  0.447801  1
  Ni  Ni174  1  0.310890  0.884338  0.421442  1
  Ni  Ni175  1  0.310820  0.397494  0.459845  1
  Ni  Ni176  1  0.310954  0.722162  0.434512  1
  Ni  Ni177  1  0.310551  0.046873  0.409265  1
  Ni  Ni178  1  0.296757  0.303163  0.427568  1
  Ni  Ni179  1  0.297142  0.628164  0.403384  1
  Ni  Ni180  1  0.296669  -0.021348  0.453592  1
  Ni  Ni181  1  0.824848  0.303163  0.427568  1
  Ni  Ni182  1  0.824463  0.628164  0.403384  1
  Ni  Ni183  1  0.824936  -0.021348  0.453592  1
  Ni  Ni184  1  0.060802  0.128061  0.402745  1
  Ni  Ni185  1  0.060802  0.478817  0.454043  1
  Ni  Ni186  1  0.060802  0.802991  0.427241  1
  Ni  Ni187  1  0.810785  0.397494  0.459845  1
  Ni  Ni188  1  0.810651  0.722162  0.434512  1
  Ni  Ni189  1  0.811054  0.046873  0.409265  1
  Ni  Ni190  1  0.810804  0.235136  0.472389  1
  Ni  Ni191  1  0.810850  0.560000  0.447801  1
  Ni  Ni192  1  0.810715  0.884338  0.421442  1
  Ni  Ni193  1  0.796740  0.141056  0.441049  1
  Ni  Ni194  1  0.796815  0.465651  0.415552  1
  Ni  Ni195  1  0.796670  0.816245  0.465843  1
  Ni  Ni196  1  0.324864  0.141056  0.441049  1
  Ni  Ni197  1  0.324790  0.465651  0.415552  1
  Ni  Ni198  1  0.324935  0.816245  0.465843  1
  Ni  Ni199  1  0.560802  0.342574  0.542980  1
  Ni  Ni200  1  0.560802  0.667595  0.518614  1
  Ni  Ni201  1  0.560802  -0.008159  0.492080  1
  Ni  Ni202  1  0.310494  0.261276  0.549003  1
  Ni  Ni203  1  0.310790  0.586324  0.524648  1
  Ni  Ni204  1  0.310841  0.910670  0.498336  1
  Ni  Ni205  1  0.310993  0.423814  0.536734  1
  Ni  Ni206  1  0.310688  0.748431  0.511239  1
  Ni  Ni207  1  0.310795  0.073091  0.486068  1
  Ni  Ni208  1  0.296688  0.329461  0.504506  1
  Ni  Ni209  1  0.296670  0.654383  0.480113  1
  Ni  Ni210  1  0.296738  0.004977  0.530565  1
  Ni  Ni211  1  0.824917  0.329461  0.504506  1
  Ni  Ni212  1  0.824935  0.654383  0.480113  1
  Ni  Ni213  1  0.824867  0.004977  0.530565  1
  Ni  Ni214  1  0.060802  0.154163  0.479423  1
  Ni  Ni215  1  0.060802  0.505189  0.531079  1
  Ni  Ni216  1  0.060802  0.829414  0.504314  1
  Ni  Ni217  1  0.810612  0.423814  0.536734  1
  Ni  Ni218  1  0.810917  0.748431  0.511239  1
  Ni  Ni219  1  0.810810  0.073091  0.486068  1
  Ni  Ni220  1  0.811111  0.261276  0.549003  1
  Ni  Ni221  1  0.810815  0.586324  0.524648  1
  Ni  Ni222  1  0.810764  0.910670  0.498336  1
  Ni  Ni223  1  0.796778  0.167244  0.517807  1
  Ni  Ni224  1  0.796655  0.491993  0.492530  1
  Ni  Ni225  1  0.796814  0.842535  0.542796  1
  Ni  Ni226  1  0.324827  0.167244  0.517807  1
  Ni  Ni227  1  0.324950  0.491993  0.492530  1
  Ni  Ni228  1  0.324791  0.842535  0.542796  1
  Ni  Ni229  1  0.560802  0.369523  0.620249  1
  Ni  Ni230  1  0.560802  0.693964  0.596095  1
  Ni  Ni231  1  0.560802  0.018062  0.569001  1
  Ni  Ni232  1  0.312185  0.287656  0.625086  1
  Ni  Ni233  1  0.310857  0.612570  0.601364  1
  Ni  Ni234  1  0.310484  0.936958  0.575337  1
  Ni  Ni235  1  0.310106  0.450262  0.613398  1
  Ni  Ni236  1  0.311362  0.774547  0.587837  1
  Ni  Ni237  1  0.310852  0.099365  0.563107  1
  Ni  Ni238  1  0.297174  0.355907  0.581488  1
  Ni  Ni239  1  0.297167  0.680702  0.557172  1
  Ni  Ni240  1  0.296987  0.031300  0.607406  1
  Ni  Ni241  1  0.824431  0.355907  0.581488  1
  Ni  Ni242  1  0.824438  0.680702  0.557172  1
  Ni  Ni243  1  0.824618  0.031300  0.607406  1
  Ni  Ni244  1  0.060802  0.180299  0.556245  1
  Ni  Ni245  1  0.060802  0.531848  0.608560  1
  Ni  Ni246  1  0.060802  0.855558  0.581166  1
  Ni  Ni247  1  0.811499  0.450262  0.613398  1
  Ni  Ni248  1  0.810243  0.774547  0.587837  1
  Ni  Ni249  1  0.810753  0.099365  0.563107  1
  Ni  Ni250  1  0.809420  0.287656  0.625086  1
  Ni  Ni251  1  0.810748  0.612570  0.601364  1
  Ni  Ni252  1  0.811121  0.936958  0.575337  1
  Ni  Ni253  1  0.796939  0.193544  0.594682  1
  Ni  Ni254  1  0.797190  0.518451  0.569666  1
  Ni  Ni255  1  0.797210  0.868596  0.619515  1
  Ni  Ni256  1  0.324666  0.193544  0.594682  1
  Ni  Ni257  1  0.324415  0.518451  0.569666  1
  Ni  Ni258  1  0.324395  0.868596  0.619515  1
  Ni  Ni259  1  0.560802  0.388763  0.697053  1
  Ni  Ni260  1  0.560802  0.720675  0.672634  1
  Ni  Ni261  1  0.560802  0.044813  0.645625  1
  Ni  Ni262  1  0.309128  0.305167  0.701978  1
  Ni  Ni263  1  0.311711  0.637907  0.678029  1
  Ni  Ni264  1  0.311847  0.963807  0.652375  1
  Ni  Ni265  1  0.312229  0.472509  0.690136  1
  Ni  Ni266  1  0.307803  0.801814  0.663794  1
  Ni  Ni267  1  0.310831  0.126125  0.640327  1
  Ni  Ni268  1  0.291501  0.382715  0.658890  1
  Ni  Ni269  1  0.291607  0.706857  0.634834  1
  Ni  Ni270  1  0.298912  0.057129  0.684159  1
  Ni  Ni271  1  0.830104  0.382715  0.658890  1
  Ni  Ni272  1  0.829998  0.706857  0.634834  1
  Ni  Ni273  1  0.822693  0.057129  0.684159  1
  Ni  Ni274  1  0.060802  0.206988  0.633202  1
  Ni  Ni275  1  0.060802  0.555509  0.685085  1
  Ni  Ni276  1  0.060802  0.883028  0.657792  1
  Ni  Ni277  1  0.809376  0.472509  0.690136  1
  Ni  Ni278  1  0.813802  0.801814  0.663794  1
  Ni  Ni279  1  0.810774  0.126125  0.640327  1
  Ni  Ni280  1  0.812477  0.305167  0.701978  1
  Ni  Ni281  1  0.809894  0.637907  0.678029  1
  Ni  Ni282  1  0.809758  0.963807  0.652375  1
  Ni  Ni283  1  0.796789  0.221508  0.671758  1
  Ni  Ni284  1  0.790710  0.544560  0.647242  1
  Ni  Ni285  1  0.794476  0.891895  0.696406  1
  Ni  Ni286  1  0.324816  0.221508  0.671758  1
  Ni  Ni287  1  0.330895  0.544560  0.647242  1
  Ni  Ni288  1  0.327129  0.891895  0.696406  1
