# generated using pymatgen
data_Al3Ni5
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   18.72560343
_cell_length_b   8.89265067
_cell_length_c   49.19044610
_cell_angle_alpha   90.00000000
_cell_angle_beta   90.00000000
_cell_angle_gamma   112.31953271
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Al3Ni5
_chemical_formula_sum   'Al108 Ni180'
_cell_volume   7577.52275465
_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  0.875011  0.313031  0.345911  1
  Al  Al2  1  0.511050  0.824766  0.296800  1
  Al  Al3  1  0.198572  0.571788  0.319286  1
  Al  Al4  1  0.863768  1.002249  0.330260  1
  Al  Al5  1  0.544483  0.739425  0.352701  1
  Al  Al6  1  0.179493  0.250362  0.303527  1
  Al  Al7  1  0.842038  0.408047  0.292345  1
  Al  Al8  1  0.521980  0.138062  0.316310  1
  Al  Al9  1  0.203403  0.887160  0.338807  1
  Al  Al10  1  0.698572  0.571788  0.319286  1
  Al  Al11  1  0.375011  0.313031  0.345911  1
  Al  Al12  1  0.011050  0.824766  0.296800  1
  Al  Al13  1  0.679493  0.250362  0.303527  1
  Al  Al14  1  0.363768  1.002249  0.330260  1
  Al  Al15  1  0.044483  0.739425  0.352701  1
  Al  Al16  1  0.703403  0.887160  0.338807  1
  Al  Al17  1  0.342038  0.408047  0.292345  1
  Al  Al18  1  0.021980  0.138062  0.316310  1
  Al  Al19  1  0.915271  0.543656  0.417921  1
  Al  Al20  1  0.553947  0.057373  0.370004  1
  Al  Al21  1  0.235262  0.800148  0.393397  1
  Al  Al22  1  0.905688  0.229709  0.400589  1
  Al  Al23  1  0.587213  0.973601  0.423870  1
  Al  Al24  1  0.225360  0.485984  0.376027  1
  Al  Al25  1  0.883866  0.627274  0.362434  1
  Al  Al26  1  0.566094  0.374453  0.386576  1
  Al  Al27  1  0.245706  0.115740  0.411118  1
  Al  Al28  1  0.735262  0.800148  0.393397  1
  Al  Al29  1  0.415271  0.543656  0.417921  1
  Al  Al30  1  0.053947  0.057373  0.370004  1
  Al  Al31  1  0.725360  0.485984  0.376027  1
  Al  Al32  1  0.405688  0.229709  0.400589  1
  Al  Al33  1  0.087213  0.973601  0.423870  1
  Al  Al34  1  0.745706  0.115740  0.411118  1
  Al  Al35  1  0.383866  0.627274  0.362434  1
  Al  Al36  1  0.066094  0.374453  0.386576  1
  Al  Al37  1  0.960270  0.775702  0.489240  1
  Al  Al38  1  0.597520  0.288313  0.441413  1
  Al  Al39  1  0.278232  0.030781  0.465480  1
  Al  Al40  1  0.949624  0.461092  0.471852  1
  Al  Al41  1  0.630297  0.204062  0.495910  1
  Al  Al42  1  0.268247  0.716863  0.447985  1
  Al  Al43  1  0.927075  0.859057  0.434798  1
  Al  Al44  1  0.608220  0.602611  0.458884  1
  Al  Al45  1  0.288987  0.346056  0.482965  1
  Al  Al46  1  0.778232  0.030781  0.465480  1
  Al  Al47  1  0.460270  0.775702  0.489240  1
  Al  Al48  1  0.097520  0.288313  0.441413  1
  Al  Al49  1  0.768247  0.716863  0.447985  1
  Al  Al50  1  0.449624  0.461092  0.471852  1
  Al  Al51  1  0.130297  0.204062  0.495910  1
  Al  Al52  1  0.788987  0.346056  0.482965  1
  Al  Al53  1  0.427075  0.859057  0.434798  1
  Al  Al54  1  0.108220  0.602611  0.458884  1
  Al  Al55  1  1.002961  0.005735  0.561361  1
  Al  Al56  1  0.640848  0.518384  0.513302  1
  Al  Al57  1  0.322459  0.262867  0.537078  1
  Al  Al58  1  0.992528  0.691517  0.543916  1
  Al  Al59  1  0.673348  0.434454  0.567819  1
  Al  Al60  1  0.311537  0.947850  0.519797  1
  Al  Al61  1  0.970231  0.089709  0.506696  1
  Al  Al62  1  0.651200  0.833314  0.530820  1
  Al  Al63  1  0.332682  0.577310  0.554551  1
  Al  Al64  1  0.822459  0.262867  0.537078  1
  Al  Al65  1  0.502961  0.005735  0.561361  1
  Al  Al66  1  0.140848  0.518384  0.513302  1
  Al  Al67  1  0.811537  0.947850  0.519797  1
  Al  Al68  1  0.492528  0.691517  0.543916  1
  Al  Al69  1  0.173348  0.434454  0.567819  1
  Al  Al70  1  0.832682  0.577310  0.554551  1
  Al  Al71  1  0.470231  0.089709  0.506696  1
  Al  Al72  1  0.151200  0.833314  0.530820  1
  Al  Al73  1  0.043984  0.236067  0.633539  1
  Al  Al74  1  0.684883  0.749753  0.584820  1
  Al  Al75  1  0.363951  0.491788  0.609147  1
  Al  Al76  1  0.035449  0.922019  0.616160  1
  Al  Al77  1  0.717519  0.666890  0.639463  1
  Al  Al78  1  0.354307  0.178840  0.591826  1
  Al  Al79  1  0.013465  0.320130  0.578483  1
  Al  Al80  1  0.694730  0.065223  0.602496  1
  Al  Al81  1  0.375730  0.807878  0.626742  1
  Al  Al82  1  0.863951  0.491788  0.609147  1
  Al  Al83  1  0.543984  0.236067  0.633539  1
  Al  Al84  1  0.184883  0.749753  0.584820  1
  Al  Al85  1  0.854307  0.178840  0.591826  1
  Al  Al86  1  0.535449  0.922019  0.616160  1
  Al  Al87  1  0.217519  0.666890  0.639463  1
  Al  Al88  1  0.875730  0.807878  0.626742  1
  Al  Al89  1  0.513465  0.320130  0.578483  1
  Al  Al90  1  0.194730  0.065223  0.602496  1
  Al  Al91  1  0.099482  0.477807  0.704792  1
  Al  Al92  1  0.727209  0.982038  0.656472  1
  Al  Al93  1  0.405499  0.723959  0.681888  1
  Al  Al94  1  0.080775  0.159889  0.687401  1
  Al  Al95  1  0.758623  0.880802  0.709916  1
  Al  Al96  1  0.398045  0.407280  0.662204  1
  Al  Al97  1  0.055596  0.552275  0.649813  1
  Al  Al98  1  0.734968  0.293466  0.675677  1
  Al  Al99  1  0.419647  0.034530  0.698703  1
  Al  Al100  1  0.905499  0.723959  0.681888  1
  Al  Al101  1  0.599482  0.477807  0.704792  1
  Al  Al102  1  0.227209  0.982038  0.656472  1
  Al  Al103  1  0.898045  0.407280  0.662204  1
  Al  Al104  1  0.580775  0.159889  0.687401  1
  Al  Al105  1  0.258623  0.880802  0.709916  1
  Al  Al106  1  0.919647  0.034530  0.698703  1
  Al  Al107  1  0.555596  0.552275  0.649813  1
  Al  Al108  1  0.234968  0.293466  0.675677  1
  Ni  Ni109  1  0.663631  0.958138  0.289331  1
  Ni  Ni110  1  0.352425  0.691447  0.310445  1
  Ni  Ni111  1  0.031256  0.436010  0.336940  1
  Ni  Ni112  1  0.625697  0.315162  0.345258  1
  Ni  Ni113  1  0.265892  0.842252  0.297897  1
  Ni  Ni114  1  0.946653  0.568473  0.321896  1
  Ni  Ni115  1  0.600054  0.688013  0.310573  1
  Ni  Ni116  1  0.281726  0.434119  0.334571  1
  Ni  Ni117  1  0.915813  0.958619  0.288220  1
  Ni  Ni118  1  0.608131  1.002361  0.329795  1
  Ni  Ni119  1  0.291269  0.746694  0.351733  1
  Ni  Ni120  1  0.931317  0.264788  0.303897  1
  Ni  Ni121  1  0.777497  0.139108  0.315167  1
  Ni  Ni122  1  0.456082  0.877284  0.339383  1
  Ni  Ni123  1  0.083821  0.398105  0.294395  1
  Ni  Ni124  1  0.852425  0.691447  0.310445  1
  Ni  Ni125  1  0.531256  0.436010  0.336940  1
  Ni  Ni126  1  0.163631  0.958138  0.289331  1
  Ni  Ni127  1  0.765892  0.842252  0.297897  1
  Ni  Ni128  1  0.446653  0.568473  0.321896  1
  Ni  Ni129  1  0.125697  0.315162  0.345258  1
  Ni  Ni130  1  0.781726  0.434119  0.334571  1
  Ni  Ni131  1  0.415813  0.958619  0.288220  1
  Ni  Ni132  1  0.100054  0.688013  0.310573  1
  Ni  Ni133  1  0.791269  0.746694  0.351733  1
  Ni  Ni134  1  0.431317  0.264788  0.303897  1
  Ni  Ni135  1  0.108131  1.002361  0.329795  1
  Ni  Ni136  1  0.583821  0.398105  0.294395  1
  Ni  Ni137  1  0.277497  0.139108  0.315167  1
  Ni  Ni138  1  0.956082  0.877284  0.339383  1
  Ni  Ni139  1  0.714111  0.183186  0.357559  1
  Ni  Ni140  1  0.394646  0.926978  0.381506  1
  Ni  Ni141  1  0.077645  0.673405  0.404926  1
  Ni  Ni142  1  0.666938  0.544125  0.417499  1
  Ni  Ni143  1  0.304088  0.057742  0.370228  1
  Ni  Ni144  1  0.985104  0.798475  0.393553  1
  Ni  Ni145  1  0.645387  0.929662  0.381310  1
  Ni  Ni146  1  0.326007  0.672419  0.405329  1
  Ni  Ni147  1  0.963887  0.182914  0.358832  1
  Ni  Ni148  1  0.653919  0.235852  0.399667  1
  Ni  Ni149  1  0.334395  0.977903  0.423646  1
  Ni  Ni150  1  0.971213  0.491356  0.376821  1
  Ni  Ni151  1  0.817343  0.366170  0.387203  1
  Ni  Ni152  1  0.498334  0.111198  0.411278  1
  Ni  Ni153  1  0.139825  0.623992  0.362172  1
  Ni  Ni154  1  0.894646  0.926978  0.381506  1
  Ni  Ni155  1  0.577645  0.673405  0.404926  1
  Ni  Ni156  1  0.214111  0.183186  0.357559  1
  Ni  Ni157  1  0.804088  0.057742  0.370228  1
  Ni  Ni158  1  0.485104  0.798475  0.393553  1
  Ni  Ni159  1  0.166938  0.544125  0.417499  1
  Ni  Ni160  1  0.826007  0.672419  0.405329  1
  Ni  Ni161  1  0.463887  0.182914  0.358832  1
  Ni  Ni162  1  0.145387  0.929662  0.381310  1
  Ni  Ni163  1  0.834395  0.977903  0.423646  1
  Ni  Ni164  1  0.471213  0.491356  0.376821  1
  Ni  Ni165  1  0.153919  0.235852  0.399667  1
  Ni  Ni166  1  0.639825  0.623992  0.362172  1
  Ni  Ni167  1  0.317343  0.366170  0.387203  1
  Ni  Ni168  1  0.998334  0.111198  0.411278  1
  Ni  Ni169  1  0.757481  0.416322  0.429406  1
  Ni  Ni170  1  0.438402  0.160462  0.453255  1
  Ni  Ni171  1  0.119141  0.903187  0.477375  1
  Ni  Ni172  1  0.709644  0.774841  0.489434  1
  Ni  Ni173  1  0.347144  0.287255  0.441806  1
  Ni  Ni174  1  0.028793  0.031862  0.465282  1
  Ni  Ni175  1  0.687992  0.159984  0.453467  1
  Ni  Ni176  1  0.369350  0.903440  0.477295  1
  Ni  Ni177  1  0.007689  0.418037  0.429186  1
  Ni  Ni178  1  0.697025  0.465804  0.471495  1
  Ni  Ni179  1  0.378183  0.209571  0.495296  1
  Ni  Ni180  1  0.016316  0.722439  0.447295  1
  Ni  Ni181  1  0.860243  0.597472  0.459523  1
  Ni  Ni182  1  0.541469  0.340820  0.483232  1
  Ni  Ni183  1  0.179212  0.853292  0.435243  1
  Ni  Ni184  1  0.938402  0.160462  0.453255  1
  Ni  Ni185  1  0.619141  0.903187  0.477375  1
  Ni  Ni186  1  0.257481  0.416322  0.429406  1
  Ni  Ni187  1  0.847144  0.287255  0.441806  1
  Ni  Ni188  1  0.528793  0.031862  0.465282  1
  Ni  Ni189  1  0.209644  0.774841  0.489434  1
  Ni  Ni190  1  0.869350  0.903440  0.477295  1
  Ni  Ni191  1  0.507689  0.418037  0.429186  1
  Ni  Ni192  1  0.187992  0.159984  0.453467  1
  Ni  Ni193  1  0.878183  0.209571  0.495296  1
  Ni  Ni194  1  0.516316  0.722439  0.447295  1
  Ni  Ni195  1  0.197025  0.465804  0.471495  1
  Ni  Ni196  1  0.679212  0.853292  0.435243  1
  Ni  Ni197  1  0.360243  0.597472  0.459523  1
  Ni  Ni198  1  0.041469  0.340820  0.483232  1
  Ni  Ni199  1  0.800233  0.646828  0.501385  1
  Ni  Ni200  1  0.481191  0.390302  0.525303  1
  Ni  Ni201  1  0.161811  0.133531  0.549437  1
  Ni  Ni202  1  0.753209  0.006995  0.561096  1
  Ni  Ni203  1  0.391230  0.519548  0.513204  1
  Ni  Ni204  1  0.071761  0.262007  0.537219  1
  Ni  Ni205  1  0.731220  0.390002  0.525425  1
  Ni  Ni206  1  0.412417  0.133913  0.549232  1
  Ni  Ni207  1  0.050363  0.646840  0.501418  1
  Ni  Ni208  1  0.740338  0.696385  0.543271  1
  Ni  Ni209  1  0.421158  0.440189  0.567444  1
  Ni  Ni210  1  0.059066  0.953144  0.519508  1
  Ni  Ni211  1  0.903886  0.828352  0.531056  1
  Ni  Ni212  1  0.584670  0.571431  0.555049  1
  Ni  Ni213  1  0.222357  0.084221  0.507305  1
  Ni  Ni214  1  0.981191  0.390302  0.525303  1
  Ni  Ni215  1  0.661811  0.133531  0.549437  1
  Ni  Ni216  1  0.300233  0.646828  0.501385  1
  Ni  Ni217  1  0.891230  0.519548  0.513204  1
  Ni  Ni218  1  0.571761  0.262007  0.537219  1
  Ni  Ni219  1  0.253209  0.006995  0.561096  1
  Ni  Ni220  1  0.912417  0.133913  0.549232  1
  Ni  Ni221  1  0.550363  0.646840  0.501418  1
  Ni  Ni222  1  0.231220  0.390002  0.525425  1
  Ni  Ni223  1  0.921158  0.440189  0.567444  1
  Ni  Ni224  1  0.559066  0.953144  0.519508  1
  Ni  Ni225  1  0.240338  0.696385  0.543271  1
  Ni  Ni226  1  0.722357  0.084221  0.507305  1
  Ni  Ni227  1  0.403886  0.828352  0.531056  1
  Ni  Ni228  1  0.084670  0.571431  0.555049  1
  Ni  Ni229  1  0.843641  0.878241  0.573131  1
  Ni  Ni230  1  0.524257  0.621240  0.597124  1
  Ni  Ni231  1  0.206481  0.366749  0.620594  1
  Ni  Ni232  1  0.794688  0.236867  0.633381  1
  Ni  Ni233  1  0.433888  0.749363  0.585395  1
  Ni  Ni234  1  0.114933  0.492920  0.609113  1
  Ni  Ni235  1  0.775076  0.622450  0.596908  1
  Ni  Ni236  1  0.455607  0.365524  0.620484  1
  Ni  Ni237  1  0.093393  0.877439  0.573507  1
  Ni  Ni238  1  0.784021  0.928409  0.615287  1
  Ni  Ni239  1  0.461614  0.669232  0.639168  1
  Ni  Ni240  1  0.101657  0.183614  0.591718  1
  Ni  Ni241  1  0.946447  0.058798  0.603099  1
  Ni  Ni242  1  0.629285  0.802031  0.625919  1
  Ni  Ni243  1  0.265881  0.315236  0.578672  1
  Ni  Ni244  1  0.024257  0.621240  0.597124  1
  Ni  Ni245  1  0.706481  0.366749  0.620594  1
  Ni  Ni246  1  0.343641  0.878241  0.573131  1
  Ni  Ni247  1  0.933888  0.749363  0.585395  1
  Ni  Ni248  1  0.614933  0.492920  0.609113  1
  Ni  Ni249  1  0.294688  0.236867  0.633381  1
  Ni  Ni250  1  0.955607  0.365524  0.620484  1
  Ni  Ni251  1  0.593393  0.877439  0.573507  1
  Ni  Ni252  1  0.275076  0.622450  0.596908  1
  Ni  Ni253  1  0.961614  0.669232  0.639168  1
  Ni  Ni254  1  0.601657  0.183614  0.591718  1
  Ni  Ni255  1  0.284021  0.928409  0.615287  1
  Ni  Ni256  1  0.765881  0.315236  0.578672  1
  Ni  Ni257  1  0.446447  0.058798  0.603099  1
  Ni  Ni258  1  0.129285  0.802031  0.625919  1
  Ni  Ni259  1  0.887720  0.112810  0.645419  1
  Ni  Ni260  1  0.567192  0.851398  0.665456  1
  Ni  Ni261  1  0.248678  0.595311  0.692260  1
  Ni  Ni262  1  0.843836  0.458676  0.703719  1
  Ni  Ni263  1  0.476767  0.980761  0.657461  1
  Ni  Ni264  1  0.155982  0.727095  0.679442  1
  Ni  Ni265  1  0.818432  0.855918  0.667810  1
  Ni  Ni266  1  0.500038  0.595797  0.692447  1
  Ni  Ni267  1  0.137163  0.113418  0.644723  1
  Ni  Ni268  1  0.825908  0.158029  0.687586  1
  Ni  Ni269  1  0.517431  0.893169  0.707967  1
  Ni  Ni270  1  0.145129  0.416597  0.661667  1
  Ni  Ni271  1  0.990673  0.294599  0.675930  1
  Ni  Ni272  1  0.667198  0.016209  0.697948  1
  Ni  Ni273  1  0.308538  0.543840  0.650981  1
  Ni  Ni274  1  0.067192  0.851398  0.665456  1
  Ni  Ni275  1  0.748678  0.595311  0.692260  1
  Ni  Ni276  1  0.387720  0.112810  0.645419  1
  Ni  Ni277  1  0.976767  0.980761  0.657461  1
  Ni  Ni278  1  0.655982  0.727095  0.679442  1
  Ni  Ni279  1  0.343836  0.458676  0.703719  1
  Ni  Ni280  1  1.000038  0.595797  0.692447  1
  Ni  Ni281  1  0.637163  0.113418  0.644723  1
  Ni  Ni282  1  0.318432  0.855918  0.667810  1
  Ni  Ni283  1  0.017431  0.893169  0.707967  1
  Ni  Ni284  1  0.645129  0.416597  0.661667  1
  Ni  Ni285  1  0.325908  0.158029  0.687586  1
  Ni  Ni286  1  0.808538  0.543840  0.650981  1
  Ni  Ni287  1  0.490673  0.294599  0.675930  1
  Ni  Ni288  1  0.167198  0.016209  0.697948  1
