# generated using pymatgen
data_Al3Ni5
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   20.09709296
_cell_length_b   8.49633035
_cell_length_c   47.30164982
_cell_angle_alpha   90.00000000
_cell_angle_beta   90.00000000
_cell_angle_gamma   109.45348306
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Al3Ni5
_chemical_formula_sum   'Al108 Ni180'
_cell_volume   7615.74107608
_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  0.828349  0.276362  0.345812  1
  Al  Al2  1  0.475066  0.784718  0.293862  1
  Al  Al3  1  0.177006  0.571396  0.310486  1
  Al  Al4  1  0.819885  0.943472  0.334181  1
  Al  Al5  1  0.499214  0.679391  0.352269  1
  Al  Al6  1  0.140562  0.208455  0.306413  1
  Al  Al7  1  0.800076  0.379142  0.291623  1
  Al  Al8  1  0.475204  0.111053  0.314272  1
  Al  Al9  1  0.159910  0.856671  0.337391  1
  Al  Al10  1  0.677006  0.571396  0.310486  1
  Al  Al11  1  0.328349  0.276362  0.345812  1
  Al  Al12  1  0.975066  0.784718  0.293862  1
  Al  Al13  1  0.640562  0.208455  0.306413  1
  Al  Al14  1  0.319885  0.943472  0.334181  1
  Al  Al15  1  0.999214  0.679391  0.352269  1
  Al  Al16  1  0.659910  0.856671  0.337391  1
  Al  Al17  1  0.300076  0.379142  0.291623  1
  Al  Al18  1  0.975204  0.111053  0.314272  1
  Al  Al19  1  0.850579  0.490732  0.417133  1
  Al  Al20  1  0.492429  0.997421  0.369022  1
  Al  Al21  1  0.163437  0.736498  0.391165  1
  Al  Al22  1  0.849730  0.166146  0.401401  1
  Al  Al23  1  0.530546  0.910236  0.424499  1
  Al  Al24  1  0.170875  0.422468  0.375303  1
  Al  Al25  1  0.834840  0.601818  0.361724  1
  Al  Al26  1  0.514249  0.348156  0.383898  1
  Al  Al27  1  0.185305  0.075985  0.409365  1
  Al  Al28  1  0.663437  0.736498  0.391165  1
  Al  Al29  1  0.350579  0.490732  0.417133  1
  Al  Al30  1  0.992429  0.997421  0.369022  1
  Al  Al31  1  0.670875  0.422468  0.375303  1
  Al  Al32  1  0.349730  0.166146  0.401401  1
  Al  Al33  1  0.030546  0.910236  0.424499  1
  Al  Al34  1  0.685305  0.075985  0.409365  1
  Al  Al35  1  0.334840  0.601818  0.361724  1
  Al  Al36  1  0.014249  0.348156  0.383898  1
  Al  Al37  1  0.900278  0.724777  0.487971  1
  Al  Al38  1  0.542446  0.237645  0.440556  1
  Al  Al39  1  0.223238  0.978906  0.464503  1
  Al  Al40  1  0.884562  0.391502  0.472223  1
  Al  Al41  1  0.561078  0.131628  0.497081  1
  Al  Al42  1  0.206584  0.648786  0.448710  1
  Al  Al43  1  0.864651  0.820834  0.432708  1
  Al  Al44  1  0.543652  0.560913  0.457223  1
  Al  Al45  1  0.221464  0.302399  0.481518  1
  Al  Al46  1  0.723238  0.978906  0.464503  1
  Al  Al47  1  0.400278  0.724777  0.487971  1
  Al  Al48  1  0.042446  0.237645  0.440556  1
  Al  Al49  1  0.706584  0.648786  0.448710  1
  Al  Al50  1  0.384562  0.391502  0.472223  1
  Al  Al51  1  0.061078  0.131628  0.497081  1
  Al  Al52  1  0.721464  0.302399  0.481518  1
  Al  Al53  1  0.364651  0.820834  0.432708  1
  Al  Al54  1  0.043652  0.560913  0.457223  1
  Al  Al55  1  0.916170  0.939433  0.561910  1
  Al  Al56  1  0.565680  0.456419  0.513917  1
  Al  Al57  1  0.238969  0.198537  0.537793  1
  Al  Al58  1  0.916996  0.617580  0.545184  1
  Al  Al59  1  0.596259  0.357988  0.569757  1
  Al  Al60  1  0.239965  0.875554  0.520699  1
  Al  Al61  1  0.900175  0.046541  0.505348  1
  Al  Al62  1  0.577172  0.787172  0.529738  1
  Al  Al63  1  0.255830  0.529933  0.553116  1
  Al  Al64  1  0.738969  0.198537  0.537793  1
  Al  Al65  1  0.416170  0.939433  0.561910  1
  Al  Al66  1  0.065680  0.456419  0.513917  1
  Al  Al67  1  0.739965  0.875554  0.520699  1
  Al  Al68  1  0.416996  0.617580  0.545184  1
  Al  Al69  1  0.096259  0.357988  0.569757  1
  Al  Al70  1  0.755830  0.529933  0.553116  1
  Al  Al71  1  0.400175  0.046541  0.505348  1
  Al  Al72  1  0.077172  0.787172  0.529738  1
  Al  Al73  1  0.965373  0.169663  0.632877  1
  Al  Al74  1  0.604148  0.685107  0.585099  1
  Al  Al75  1  0.292527  0.436287  0.611172  1
  Al  Al76  1  0.947046  0.833612  0.617679  1
  Al  Al77  1  0.631220  0.583392  0.639488  1
  Al  Al78  1  0.274398  0.105316  0.593482  1
  Al  Al79  1  0.930692  0.267903  0.578053  1
  Al  Al80  1  0.612345  0.015155  0.600824  1
  Al  Al81  1  0.289115  0.750831  0.627498  1
  Al  Al82  1  0.792527  0.436287  0.611172  1
  Al  Al83  1  0.465373  0.169663  0.632877  1
  Al  Al84  1  0.104148  0.685107  0.585099  1
  Al  Al85  1  0.774398  0.105316  0.593482  1
  Al  Al86  1  0.447046  0.833612  0.617679  1
  Al  Al87  1  0.131220  0.583392  0.639488  1
  Al  Al88  1  0.789115  0.750831  0.627498  1
  Al  Al89  1  0.430692  0.267903  0.578053  1
  Al  Al90  1  0.112345  0.015155  0.600824  1
  Al  Al91  1  0.996926  0.423917  0.705724  1
  Al  Al92  1  0.640258  0.912678  0.654151  1
  Al  Al93  1  0.297759  0.642586  0.686947  1
  Al  Al94  1  0.988281  0.078959  0.687802  1
  Al  Al95  1  0.660662  0.801756  0.710058  1
  Al  Al96  1  0.308225  0.321510  0.665860  1
  Al  Al97  1  0.964014  0.498251  0.648679  1
  Al  Al98  1  0.635098  0.226639  0.672386  1
  Al  Al99  1  0.321751  0.987537  0.695876  1
  Al  Al100  1  0.797759  0.642586  0.686947  1
  Al  Al101  1  0.496926  0.423917  0.705724  1
  Al  Al102  1  0.140258  0.912678  0.654151  1
  Al  Al103  1  0.808225  0.321510  0.665860  1
  Al  Al104  1  0.488281  0.078959  0.687802  1
  Al  Al105  1  0.160662  0.801756  0.710058  1
  Al  Al106  1  0.821751  0.987537  0.695876  1
  Al  Al107  1  0.464014  0.498251  0.648679  1
  Al  Al108  1  0.135098  0.226639  0.672386  1
  Ni  Ni109  1  0.634359  0.925532  0.291503  1
  Ni  Ni110  1  0.307414  0.663932  0.312078  1
  Ni  Ni111  1  0.970693  0.390815  0.332992  1
  Ni  Ni112  1  0.572576  0.251295  0.346009  1
  Ni  Ni113  1  0.242356  0.853925  0.296195  1
  Ni  Ni114  1  0.896866  0.540369  0.320978  1
  Ni  Ni115  1  0.564193  0.663831  0.309059  1
  Ni  Ni116  1  0.239222  0.403274  0.334172  1
  Ni  Ni117  1  0.873195  0.910008  0.291058  1
  Ni  Ni118  1  0.560043  0.954494  0.328341  1
  Ni  Ni119  1  0.236747  0.695293  0.353007  1
  Ni  Ni120  1  0.870141  0.186273  0.304137  1
  Ni  Ni121  1  0.740021  0.105685  0.314472  1
  Ni  Ni122  1  0.414476  0.827606  0.334611  1
  Ni  Ni123  1  0.060395  0.386896  0.305057  1
  Ni  Ni124  1  0.807414  0.663932  0.312078  1
  Ni  Ni125  1  0.470693  0.390815  0.332992  1
  Ni  Ni126  1  0.134359  0.925532  0.291503  1
  Ni  Ni127  1  0.742356  0.853925  0.296195  1
  Ni  Ni128  1  0.396866  0.540369  0.320978  1
  Ni  Ni129  1  0.072576  0.251295  0.346009  1
  Ni  Ni130  1  0.739222  0.403274  0.334172  1
  Ni  Ni131  1  0.373195  0.910008  0.291058  1
  Ni  Ni132  1  0.064193  0.663831  0.309059  1
  Ni  Ni133  1  0.736747  0.695293  0.353007  1
  Ni  Ni134  1  0.370141  0.186273  0.304137  1
  Ni  Ni135  1  0.060043  0.954494  0.328341  1
  Ni  Ni136  1  0.560395  0.386896  0.305057  1
  Ni  Ni137  1  0.240021  0.105685  0.314472  1
  Ni  Ni138  1  0.914476  0.827606  0.334611  1
  Ni  Ni139  1  0.668280  0.141094  0.354960  1
  Ni  Ni140  1  0.349850  0.884796  0.381855  1
  Ni  Ni141  1  0.026913  0.630651  0.404568  1
  Ni  Ni142  1  0.609886  0.488899  0.417640  1
  Ni  Ni143  1  0.251540  0.007610  0.370891  1
  Ni  Ni144  1  0.933363  0.739606  0.394137  1
  Ni  Ni145  1  0.589835  0.899202  0.378307  1
  Ni  Ni146  1  0.263748  0.628832  0.403277  1
  Ni  Ni147  1  0.915281  0.149004  0.357995  1
  Ni  Ni148  1  0.590834  0.176503  0.396823  1
  Ni  Ni149  1  0.265002  0.908729  0.419617  1
  Ni  Ni150  1  0.916813  0.446512  0.377318  1
  Ni  Ni151  1  0.764252  0.316596  0.385802  1
  Ni  Ni152  1  0.447311  0.072579  0.411898  1
  Ni  Ni153  1  0.093819  0.550750  0.350023  1
  Ni  Ni154  1  0.849850  0.884796  0.381855  1
  Ni  Ni155  1  0.526913  0.630651  0.404568  1
  Ni  Ni156  1  0.168280  0.141094  0.354960  1
  Ni  Ni157  1  0.751540  0.007610  0.370891  1
  Ni  Ni158  1  0.433363  0.739606  0.394137  1
  Ni  Ni159  1  0.109886  0.488899  0.417640  1
  Ni  Ni160  1  0.763748  0.628832  0.403277  1
  Ni  Ni161  1  0.415281  0.149004  0.357995  1
  Ni  Ni162  1  0.089835  0.899202  0.378307  1
  Ni  Ni163  1  0.765002  0.908729  0.419617  1
  Ni  Ni164  1  0.416813  0.446512  0.377318  1
  Ni  Ni165  1  0.090834  0.176503  0.396823  1
  Ni  Ni166  1  0.593819  0.550750  0.350023  1
  Ni  Ni167  1  0.264252  0.316596  0.385802  1
  Ni  Ni168  1  0.947311  0.072579  0.411898  1
  Ni  Ni169  1  0.696623  0.363132  0.428814  1
  Ni  Ni170  1  0.369881  0.102334  0.453304  1
  Ni  Ni171  1  0.046967  0.842935  0.477382  1
  Ni  Ni172  1  0.640827  0.720188  0.488881  1
  Ni  Ni173  1  0.284007  0.236683  0.440821  1
  Ni  Ni174  1  0.963505  0.985736  0.463660  1
  Ni  Ni175  1  0.627231  0.097259  0.454422  1
  Ni  Ni176  1  0.305774  0.838741  0.477997  1
  Ni  Ni177  1  0.948445  0.367232  0.428004  1
  Ni  Ni178  1  0.627289  0.409688  0.472913  1
  Ni  Ni179  1  0.305789  0.156125  0.497646  1
  Ni  Ni180  1  0.948986  0.660262  0.444615  1
  Ni  Ni181  1  0.801882  0.550280  0.460422  1
  Ni  Ni182  1  0.478948  0.285228  0.481149  1
  Ni  Ni183  1  0.125401  0.808554  0.436535  1
  Ni  Ni184  1  0.869881  0.102334  0.453304  1
  Ni  Ni185  1  0.546967  0.842935  0.477382  1
  Ni  Ni186  1  0.196623  0.363132  0.428814  1
  Ni  Ni187  1  0.784007  0.236683  0.440821  1
  Ni  Ni188  1  0.463505  0.985736  0.463660  1
  Ni  Ni189  1  0.140827  0.720188  0.488881  1
  Ni  Ni190  1  0.805774  0.838741  0.477997  1
  Ni  Ni191  1  0.448445  0.367232  0.428004  1
  Ni  Ni192  1  0.127231  0.097259  0.454422  1
  Ni  Ni193  1  0.805789  0.156125  0.497646  1
  Ni  Ni194  1  0.448986  0.660262  0.444615  1
  Ni  Ni195  1  0.127289  0.409688  0.472913  1
  Ni  Ni196  1  0.625401  0.808554  0.436535  1
  Ni  Ni197  1  0.301882  0.550280  0.460422  1
  Ni  Ni198  1  0.978948  0.285228  0.481149  1
  Ni  Ni199  1  0.729331  0.588375  0.501192  1
  Ni  Ni200  1  0.412379  0.333490  0.525098  1
  Ni  Ni201  1  0.092263  0.076693  0.549008  1
  Ni  Ni202  1  0.677393  0.938390  0.561706  1
  Ni  Ni203  1  0.320783  0.460632  0.512789  1
  Ni  Ni204  1  0.997705  0.194640  0.538611  1
  Ni  Ni205  1  0.656472  0.337043  0.524701  1
  Ni  Ni206  1  0.333549  0.082395  0.548171  1
  Ni  Ni207  1  0.980979  0.586315  0.501564  1
  Ni  Ni208  1  0.660329  0.630891  0.543287  1
  Ni  Ni209  1  0.336016  0.370487  0.566384  1
  Ni  Ni210  1  0.982692  0.895138  0.522038  1
  Ni  Ni211  1  0.834522  0.767037  0.528206  1
  Ni  Ni212  1  0.510778  0.513020  0.556152  1
  Ni  Ni213  1  0.155878  0.022801  0.504400  1
  Ni  Ni214  1  0.912379  0.333490  0.525098  1
  Ni  Ni215  1  0.592263  0.076693  0.549008  1
  Ni  Ni216  1  0.229331  0.588375  0.501192  1
  Ni  Ni217  1  0.820783  0.460632  0.512789  1
  Ni  Ni218  1  0.497705  0.194640  0.538611  1
  Ni  Ni219  1  0.177393  0.938390  0.561706  1
  Ni  Ni220  1  0.833549  0.082395  0.548171  1
  Ni  Ni221  1  0.480979  0.586315  0.501564  1
  Ni  Ni222  1  0.156472  0.337043  0.524701  1
  Ni  Ni223  1  0.836016  0.370487  0.566384  1
  Ni  Ni224  1  0.482692  0.895138  0.522038  1
  Ni  Ni225  1  0.160329  0.630891  0.543287  1
  Ni  Ni226  1  0.655878  0.022801  0.504400  1
  Ni  Ni227  1  0.334522  0.767037  0.528206  1
  Ni  Ni228  1  0.010778  0.513020  0.556152  1
  Ni  Ni229  1  0.768152  0.818921  0.572793  1
  Ni  Ni230  1  0.436097  0.550692  0.597928  1
  Ni  Ni231  1  0.113387  0.292656  0.622141  1
  Ni  Ni232  1  0.709656  0.180744  0.633782  1
  Ni  Ni233  1  0.350871  0.685003  0.585318  1
  Ni  Ni234  1  0.028900  0.431798  0.608955  1
  Ni  Ni235  1  0.696743  0.555226  0.597332  1
  Ni  Ni236  1  0.371624  0.283477  0.623569  1
  Ni  Ni237  1  0.012308  0.817134  0.573426  1
  Ni  Ni238  1  0.697862  0.855459  0.613851  1
  Ni  Ni239  1  0.368528  0.612172  0.647465  1
  Ni  Ni240  1  0.014168  0.106310  0.589862  1
  Ni  Ni241  1  0.866659  0.998050  0.605454  1
  Ni  Ni242  1  0.545359  0.737886  0.626172  1
  Ni  Ni243  1  0.194918  0.269538  0.582007  1
  Ni  Ni244  1  0.936097  0.550692  0.597928  1
  Ni  Ni245  1  0.613387  0.292656  0.622141  1
  Ni  Ni246  1  0.268152  0.818921  0.572793  1
  Ni  Ni247  1  0.850871  0.685003  0.585318  1
  Ni  Ni248  1  0.528900  0.431798  0.608955  1
  Ni  Ni249  1  0.209656  0.180744  0.633782  1
  Ni  Ni250  1  0.871624  0.283477  0.623569  1
  Ni  Ni251  1  0.512308  0.817134  0.573426  1
  Ni  Ni252  1  0.196743  0.555226  0.597332  1
  Ni  Ni253  1  0.868528  0.612172  0.647465  1
  Ni  Ni254  1  0.514168  0.106310  0.589862  1
  Ni  Ni255  1  0.197862  0.855459  0.613851  1
  Ni  Ni256  1  0.694918  0.269538  0.582007  1
  Ni  Ni257  1  0.366659  0.998050  0.605454  1
  Ni  Ni258  1  0.045359  0.737886  0.626172  1
  Ni  Ni259  1  0.793452  0.037354  0.646704  1
  Ni  Ni260  1  0.479400  0.780645  0.667834  1
  Ni  Ni261  1  0.153779  0.522470  0.689150  1
  Ni  Ni262  1  0.731502  0.366455  0.701196  1
  Ni  Ni263  1  0.387064  0.912298  0.658563  1
  Ni  Ni264  1  0.066783  0.658077  0.677757  1
  Ni  Ni265  1  0.723108  0.784752  0.668402  1
  Ni  Ni266  1  0.402871  0.536743  0.691505  1
  Ni  Ni267  1  0.046254  0.024912  0.644770  1
  Ni  Ni268  1  0.719374  0.080864  0.687398  1
  Ni  Ni269  1  0.409800  0.813720  0.702857  1
  Ni  Ni270  1  0.047468  0.357156  0.664006  1
  Ni  Ni271  1  0.908021  0.231970  0.673875  1
  Ni  Ni272  1  0.576109  0.940512  0.694297  1
  Ni  Ni273  1  0.222681  0.468741  0.651651  1
  Ni  Ni274  1  0.979400  0.780645  0.667834  1
  Ni  Ni275  1  0.653779  0.522470  0.689150  1
  Ni  Ni276  1  0.293452  0.037354  0.646704  1
  Ni  Ni277  1  0.887064  0.912298  0.658563  1
  Ni  Ni278  1  0.566783  0.658077  0.677757  1
  Ni  Ni279  1  0.231502  0.366455  0.701196  1
  Ni  Ni280  1  0.902871  0.536743  0.691505  1
  Ni  Ni281  1  0.546254  0.024912  0.644770  1
  Ni  Ni282  1  0.223108  0.784752  0.668402  1
  Ni  Ni283  1  0.909800  0.813720  0.702857  1
  Ni  Ni284  1  0.547468  0.357156  0.664006  1
  Ni  Ni285  1  0.219374  0.080864  0.687398  1
  Ni  Ni286  1  0.722681  0.468741  0.651651  1
  Ni  Ni287  1  0.408021  0.231970  0.673875  1
  Ni  Ni288  1  0.076109  0.940512  0.694297  1
