# generated using pymatgen
data_Al3Ni5
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   16.28386260
_cell_length_b   9.80577648
_cell_length_c   50.65520193
_cell_angle_alpha   90.00000000
_cell_angle_beta   90.00000000
_cell_angle_gamma   75.78844402
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Al3Ni5
_chemical_formula_sum   'Al120 Ni200'
_cell_volume   7840.87675974
_cell_formula_units_Z   40
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  0.436566  0.282097  0.293596  1
  Al  Al2  1  0.936566  0.782097  0.293596  1
  Al  Al3  1  0.900742  0.096515  0.344476  1
  Al  Al4  1  0.400742  0.596515  0.344476  1
  Al  Al5  1  0.545233  0.394420  0.333400  1
  Al  Al6  1  0.045233  0.894420  0.333400  1
  Al  Al7  1  0.099841  0.576887  0.286108  1
  Al  Al8  1  0.599841  0.076887  0.286108  1
  Al  Al9  1  0.294622  0.496158  0.306304  1
  Al  Al10  1  0.794622  0.996158  0.306304  1
  Al  Al11  1  0.752040  0.312103  0.354081  1
  Al  Al12  1  0.252040  0.812103  0.354081  1
  Al  Al13  1  0.172088  0.192021  0.320726  1
  Al  Al14  1  0.672088  0.692021  0.320726  1
  Al  Al15  1  0.716687  0.329571  0.276844  1
  Al  Al16  1  0.216687  0.829571  0.276844  1
  Al  Al17  1  0.273449  0.302607  0.355372  1
  Al  Al18  1  0.773449  0.802607  0.355372  1
  Al  Al19  1  0.820636  0.476651  0.310091  1
  Al  Al20  1  0.320636  0.976651  0.310091  1
  Al  Al21  1  0.570812  0.583385  0.285174  1
  Al  Al22  1  0.070812  0.083385  0.285174  1
  Al  Al23  1  0.026337  0.401659  0.331261  1
  Al  Al24  1  0.526337  0.901659  0.331261  1
  Al  Al25  1  0.352920  0.918168  0.388617  1
  Al  Al26  1  0.852920  0.418168  0.388617  1
  Al  Al27  1  0.807069  0.732000  0.433721  1
  Al  Al28  1  0.307069  0.232000  0.433721  1
  Al  Al29  1  0.453468  0.025057  0.423588  1
  Al  Al30  1  0.953468  0.525057  0.423588  1
  Al  Al31  1  1.000923  0.207844  0.378399  1
  Al  Al32  1  0.500923  0.707844  0.378399  1
  Al  Al33  1  0.207050  0.124808  0.398691  1
  Al  Al34  1  0.707050  0.624808  0.398691  1
  Al  Al35  1  0.660146  0.939977  0.444042  1
  Al  Al36  1  0.160146  0.439977  0.444042  1
  Al  Al37  1  0.080429  0.823290  0.411283  1
  Al  Al38  1  0.580429  0.323290  0.411283  1
  Al  Al39  1  0.625520  0.011421  0.365198  1
  Al  Al40  1  0.125520  0.511421  0.365198  1
  Al  Al41  1  0.180392  0.931372  0.446525  1
  Al  Al42  1  0.680392  0.431372  0.446525  1
  Al  Al43  1  0.726921  0.116341  0.400409  1
  Al  Al44  1  0.226921  0.616341  0.400409  1
  Al  Al45  1  0.479788  0.217311  0.374972  1
  Al  Al46  1  0.979788  0.717311  0.374972  1
  Al  Al47  1  0.933393  0.032928  0.421605  1
  Al  Al48  1  0.433393  0.532928  0.421605  1
  Al  Al49  1  0.260386  0.546439  0.479154  1
  Al  Al50  1  0.760386  0.046439  0.479154  1
  Al  Al51  1  0.713504  0.361273  0.524920  1
  Al  Al52  1  0.213504  0.861273  0.524920  1
  Al  Al53  1  0.360475  0.653276  0.514515  1
  Al  Al54  1  0.860475  0.153276  0.514515  1
  Al  Al55  1  0.907120  0.838642  0.468668  1
  Al  Al56  1  0.407120  0.338642  0.468668  1
  Al  Al57  1  0.113465  0.754421  0.489614  1
  Al  Al58  1  0.613465  0.254421  0.489614  1
  Al  Al59  1  0.566900  0.568784  0.535314  1
  Al  Al60  1  0.066900  0.068784  0.535314  1
  Al  Al61  1  0.987000  0.453722  0.502044  1
  Al  Al62  1  0.487000  0.953722  0.502044  1
  Al  Al63  1  0.533614  0.639705  0.456702  1
  Al  Al64  1  0.033614  0.139705  0.456702  1
  Al  Al65  1  0.087136  0.560644  0.536987  1
  Al  Al66  1  0.587136  0.060644  0.536987  1
  Al  Al67  1  0.633789  0.746247  0.491688  1
  Al  Al68  1  0.133789  0.246247  0.491688  1
  Al  Al69  1  0.386860  0.846923  0.467082  1
  Al  Al70  1  0.886860  0.346923  0.467082  1
  Al  Al71  1  0.840149  0.661668  0.512339  1
  Al  Al72  1  0.340149  0.161668  0.512339  1
  Al  Al73  1  0.167035  0.175361  0.570314  1
  Al  Al74  1  0.667035  0.675361  0.570314  1
  Al  Al75  1  0.620356  0.991554  0.615185  1
  Al  Al76  1  0.120356  0.491554  0.615185  1
  Al  Al77  1  0.266901  0.282311  0.605200  1
  Al  Al78  1  0.766901  0.782311  0.605200  1
  Al  Al79  1  0.813722  0.467812  0.560001  1
  Al  Al80  1  0.313722  0.967812  0.560001  1
  Al  Al81  1  0.020329  0.383353  0.580435  1
  Al  Al82  1  0.520329  0.883353  0.580435  1
  Al  Al83  1  0.473448  0.198591  0.625763  1
  Al  Al84  1  0.973448  0.698591  0.625763  1
  Al  Al85  1  0.893891  0.083182  0.592950  1
  Al  Al86  1  0.393891  0.583182  0.592950  1
  Al  Al87  1  0.440152  0.268629  0.547419  1
  Al  Al88  1  0.940152  0.768629  0.547419  1
  Al  Al89  1  0.994556  0.189064  0.628740  1
  Al  Al90  1  0.494556  0.689064  0.628740  1
  Al  Al91  1  0.540288  0.375233  0.582756  1
  Al  Al92  1  0.040288  0.875233  0.582756  1
  Al  Al93  1  0.293582  0.476379  0.557803  1
  Al  Al94  1  0.793582  0.976379  0.557803  1
  Al  Al95  1  0.747046  0.290417  0.603427  1
  Al  Al96  1  0.247046  0.790417  0.603427  1
  Al  Al97  1  0.075229  0.807569  0.660715  1
  Al  Al98  1  0.575229  0.307569  0.660715  1
  Al  Al99  1  0.531880  0.624695  0.709389  1
  Al  Al100  1  0.031880  0.124695  0.709389  1
  Al  Al101  1  0.179528  0.912963  0.697638  1
  Al  Al102  1  0.679528  0.412963  0.697638  1
  Al  Al103  1  0.721282  0.097838  0.650890  1
  Al  Al104  1  0.221282  0.597838  0.650890  1
  Al  Al105  1  0.927535  0.013948  0.671296  1
  Al  Al106  1  0.427535  0.513948  0.671296  1
  Al  Al107  1  0.374053  0.831189  0.716707  1
  Al  Al108  1  0.874053  0.331189  0.716707  1
  Al  Al109  1  0.802108  0.722153  0.681454  1
  Al  Al110  1  0.302108  0.222153  0.681454  1
  Al  Al111  1  0.348168  0.895655  0.638569  1
  Al  Al112  1  0.848168  0.395655  0.638569  1
  Al  Al113  1  0.903558  0.818869  0.718615  1
  Al  Al114  1  0.403558  0.318869  0.718615  1
  Al  Al115  1  0.447847  0.006452  0.672645  1
  Al  Al116  1  0.947847  0.506452  0.672645  1
  Al  Al117  1  0.199532  0.107846  0.648767  1
  Al  Al118  1  0.699532  0.607846  0.648767  1
  Al  Al119  1  0.652361  0.926356  0.693688  1
  Al  Al120  1  0.152361  0.426356  0.693688  1
  Ni  Ni121  1  0.401522  0.098542  0.342955  1
  Ni  Ni122  1  0.901522  0.598542  0.342955  1
  Ni  Ni123  1  0.944560  0.284459  0.297681  1
  Ni  Ni124  1  0.444560  0.784459  0.297681  1
  Ni  Ni125  1  0.264215  0.056370  0.353980  1
  Ni  Ni126  1  0.764215  0.556370  0.353980  1
  Ni  Ni127  1  0.811837  0.232883  0.311747  1
  Ni  Ni128  1  0.311837  0.732883  0.311747  1
  Ni  Ni129  1  0.572160  0.334483  0.287661  1
  Ni  Ni130  1  0.072160  0.834483  0.287661  1
  Ni  Ni131  1  0.035800  0.147102  0.331831  1
  Ni  Ni132  1  0.535800  0.647102  0.331831  1
  Ni  Ni133  1  0.440357  0.527766  0.300210  1
  Ni  Ni134  1  0.940357  0.027766  0.300210  1
  Ni  Ni135  1  0.898672  0.340792  0.345685  1
  Ni  Ni136  1  0.398672  0.840792  0.345685  1
  Ni  Ni137  1  0.400842  0.357082  0.339282  1
  Ni  Ni138  1  0.900842  0.857082  0.339282  1
  Ni  Ni139  1  0.950842  0.536421  0.295098  1
  Ni  Ni140  1  0.450842  0.036421  0.295098  1
  Ni  Ni141  1  0.222773  0.365747  0.276135  1
  Ni  Ni142  1  0.722773  0.865747  0.276135  1
  Ni  Ni143  1  0.672209  0.196425  0.319804  1
  Ni  Ni144  1  0.172209  0.696425  0.319804  1
  Ni  Ni145  1  0.535068  0.151570  0.329520  1
  Ni  Ni146  1  0.035068  0.651570  0.329520  1
  Ni  Ni147  1  0.083011  0.329372  0.286694  1
  Ni  Ni148  1  0.583011  0.829372  0.286694  1
  Ni  Ni149  1  0.308747  0.229437  0.309848  1
  Ni  Ni150  1  0.808747  0.729437  0.309848  1
  Ni  Ni151  1  0.762690  0.057328  0.353420  1
  Ni  Ni152  1  0.262690  0.557328  0.353420  1
  Ni  Ni153  1  0.169978  0.435125  0.322489  1
  Ni  Ni154  1  0.669978  0.935125  0.322489  1
  Ni  Ni155  1  0.717793  0.605356  0.277749  1
  Ni  Ni156  1  0.217793  0.105356  0.277749  1
  Ni  Ni157  1  0.128779  0.267987  0.363966  1
  Ni  Ni158  1  0.628779  0.767987  0.363966  1
  Ni  Ni159  1  0.674388  0.450291  0.318168  1
  Ni  Ni160  1  0.174388  0.950291  0.318168  1
  Ni  Ni161  1  0.306946  0.731730  0.434083  1
  Ni  Ni162  1  0.806946  0.231730  0.434083  1
  Ni  Ni163  1  0.853445  0.918794  0.387447  1
  Ni  Ni164  1  0.353445  0.418794  0.387447  1
  Ni  Ni165  1  0.170460  0.685383  0.445111  1
  Ni  Ni166  1  0.670460  0.185383  0.445111  1
  Ni  Ni167  1  0.716809  0.871316  0.399582  1
  Ni  Ni168  1  0.216809  0.371316  0.399582  1
  Ni  Ni169  1  0.489869  0.962126  0.377540  1
  Ni  Ni170  1  0.989869  0.462126  0.377540  1
  Ni  Ni171  1  0.943397  0.779587  0.421761  1
  Ni  Ni172  1  0.443397  0.279587  0.421761  1
  Ni  Ni173  1  0.351726  0.160148  0.390128  1
  Ni  Ni174  1  0.851726  0.660148  0.390128  1
  Ni  Ni175  1  0.804978  0.974245  0.435417  1
  Ni  Ni176  1  0.304978  0.474245  0.435417  1
  Ni  Ni177  1  0.308759  0.989716  0.432134  1
  Ni  Ni178  1  0.808759  0.489716  0.432134  1
  Ni  Ni179  1  0.855203  0.175981  0.386938  1
  Ni  Ni180  1  0.355203  0.675981  0.386938  1
  Ni  Ni181  1  0.127294  0.010347  0.365749  1
  Ni  Ni182  1  0.627294  0.510347  0.365749  1
  Ni  Ni183  1  0.580484  0.824020  0.411343  1
  Ni  Ni184  1  0.080484  0.324020  0.411343  1
  Ni  Ni185  1  0.443555  0.778947  0.422617  1
  Ni  Ni186  1  0.943555  0.278947  0.422617  1
  Ni  Ni187  1  0.991027  0.961403  0.377679  1
  Ni  Ni188  1  0.491027  0.461403  0.377679  1
  Ni  Ni189  1  0.216405  0.870636  0.400219  1
  Ni  Ni190  1  0.716405  0.370636  0.400219  1
  Ni  Ni191  1  0.670527  0.685429  0.445289  1
  Ni  Ni192  1  0.170527  0.185429  0.445289  1
  Ni  Ni193  1  0.078651  0.066065  0.413305  1
  Ni  Ni194  1  0.578651  0.566065  0.413305  1
  Ni  Ni195  1  0.624477  0.251617  0.367494  1
  Ni  Ni196  1  0.124477  0.751617  0.367494  1
  Ni  Ni197  1  0.035568  0.897384  0.454697  1
  Ni  Ni198  1  0.535568  0.397384  0.454697  1
  Ni  Ni199  1  0.581938  0.082095  0.408865  1
  Ni  Ni200  1  0.081938  0.582095  0.408865  1
  Ni  Ni201  1  0.213678  0.361497  0.524585  1
  Ni  Ni202  1  0.713678  0.861497  0.524585  1
  Ni  Ni203  1  0.760274  0.546390  0.479457  1
  Ni  Ni204  1  0.260274  0.046390  0.479457  1
  Ni  Ni205  1  0.077115  0.314634  0.536104  1
  Ni  Ni206  1  0.577115  0.814634  0.536104  1
  Ni  Ni207  1  0.623524  0.500298  0.490845  1
  Ni  Ni208  1  0.123524  1.000298  0.490845  1
  Ni  Ni209  1  0.397036  0.592642  0.468075  1
  Ni  Ni210  1  0.897036  0.092642  0.468075  1
  Ni  Ni211  1  0.850311  0.407300  0.513555  1
  Ni  Ni212  1  0.350311  0.907300  0.513555  1
  Ni  Ni213  1  0.258318  0.788612  0.481394  1
  Ni  Ni214  1  0.758318  0.288612  0.481394  1
  Ni  Ni215  1  0.711641  0.603584  0.526739  1
  Ni  Ni216  1  0.211641  0.103584  0.526739  1
  Ni  Ni217  1  0.215672  0.618990  0.522790  1
  Ni  Ni218  1  0.715672  0.118990  0.522790  1
  Ni  Ni219  1  0.762340  0.804218  0.477285  1
  Ni  Ni220  1  0.262340  0.304218  0.477285  1
  Ni  Ni221  1  0.033399  0.640251  0.456234  1
  Ni  Ni222  1  0.533399  0.140251  0.456234  1
  Ni  Ni223  1  0.487029  0.453586  0.502110  1
  Ni  Ni224  1  0.987029  0.953586  0.502110  1
  Ni  Ni225  1  0.350366  0.407583  0.513254  1
  Ni  Ni226  1  0.850366  0.907583  0.513254  1
  Ni  Ni227  1  0.896906  0.592851  0.467983  1
  Ni  Ni228  1  0.396906  0.092851  0.467983  1
  Ni  Ni229  1  0.123528  0.500683  0.490459  1
  Ni  Ni230  1  0.623528  1.000683  0.490459  1
  Ni  Ni231  1  0.576969  0.314512  0.536232  1
  Ni  Ni232  1  0.076969  0.814512  0.536232  1
  Ni  Ni233  1  0.984912  0.696216  0.503800  1
  Ni  Ni234  1  0.484912  0.196216  0.503800  1
  Ni  Ni235  1  0.531633  0.882068  0.458505  1
  Ni  Ni236  1  0.031633  0.382068  0.458505  1
  Ni  Ni237  1  0.942249  0.526091  0.545509  1
  Ni  Ni238  1  0.442249  0.026091  0.545509  1
  Ni  Ni239  1  0.489020  0.711347  0.500273  1
  Ni  Ni240  1  0.989020  0.211347  0.500273  1
  Ni  Ni241  1  0.119723  0.990407  0.616194  1
  Ni  Ni242  1  0.619723  0.490407  0.616194  1
  Ni  Ni243  1  0.667184  0.175239  0.570308  1
  Ni  Ni244  1  0.167184  0.675239  0.570308  1
  Ni  Ni245  1  0.982964  0.943890  0.627243  1
  Ni  Ni246  1  0.482964  0.443890  0.627243  1
  Ni  Ni247  1  0.530207  0.129736  0.581342  1
  Ni  Ni248  1  0.030207  0.629736  0.581342  1
  Ni  Ni249  1  0.303531  0.222313  0.558718  1
  Ni  Ni250  1  0.803531  0.722313  0.558718  1
  Ni  Ni251  1  0.757491  0.035907  0.604498  1
  Ni  Ni252  1  0.257491  0.535907  0.604498  1
  Ni  Ni253  1  0.165168  0.417771  0.571901  1
  Ni  Ni254  1  0.665168  0.917771  0.571901  1
  Ni  Ni255  1  0.618702  0.232736  0.617569  1
  Ni  Ni256  1  0.118702  0.732736  0.617569  1
  Ni  Ni257  1  0.122018  0.248669  0.613795  1
  Ni  Ni258  1  0.622018  0.748669  0.613795  1
  Ni  Ni259  1  0.668839  0.433154  0.568570  1
  Ni  Ni260  1  0.168839  0.933154  0.568570  1
  Ni  Ni261  1  0.940457  0.268067  0.547655  1
  Ni  Ni262  1  0.440457  0.768067  0.547655  1
  Ni  Ni263  1  0.393659  0.082886  0.592698  1
  Ni  Ni264  1  0.893659  0.582886  0.592698  1
  Ni  Ni265  1  0.256811  0.035755  0.604517  1
  Ni  Ni266  1  0.756811  0.535755  0.604517  1
  Ni  Ni267  1  0.803657  0.222146  0.558923  1
  Ni  Ni268  1  0.303657  0.722146  0.558923  1
  Ni  Ni269  1  0.030448  0.129146  0.581906  1
  Ni  Ni270  1  0.530448  0.629146  0.581906  1
  Ni  Ni271  1  0.484477  0.943635  0.626737  1
  Ni  Ni272  1  0.984477  0.443635  0.626737  1
  Ni  Ni273  1  0.892087  0.324902  0.595028  1
  Ni  Ni274  1  0.392087  0.824902  0.595028  1
  Ni  Ni275  1  0.438395  0.510587  0.549460  1
  Ni  Ni276  1  0.938395  0.010587  0.549460  1
  Ni  Ni277  1  0.849596  0.155009  0.636353  1
  Ni  Ni278  1  0.349596  0.655009  0.636353  1
  Ni  Ni279  1  0.395246  0.341096  0.591120  1
  Ni  Ni280  1  0.895246  0.841096  0.591120  1
  Ni  Ni281  1  0.027978  0.620371  0.706253  1
  Ni  Ni282  1  0.527978  0.120371  0.706253  1
  Ni  Ni283  1  0.574088  0.805778  0.661561  1
  Ni  Ni284  1  0.074088  0.305778  0.661561  1
  Ni  Ni285  1  0.885538  0.576917  0.716666  1
  Ni  Ni286  1  0.385538  0.076917  0.716666  1
  Ni  Ni287  1  0.439236  0.757700  0.673353  1
  Ni  Ni288  1  0.939236  0.257700  0.673353  1
  Ni  Ni289  1  0.210549  0.853960  0.649791  1
  Ni  Ni290  1  0.710549  0.353960  0.649791  1
  Ni  Ni291  1  0.667620  0.670024  0.695940  1
  Ni  Ni292  1  0.167620  0.170024  0.695940  1
  Ni  Ni293  1  0.072668  0.048739  0.664489  1
  Ni  Ni294  1  0.572668  0.548739  0.664489  1
  Ni  Ni295  1  0.521809  0.869389  0.708782  1
  Ni  Ni296  1  0.021809  0.369389  0.708782  1
  Ni  Ni297  1  0.032386  0.878635  0.704299  1
  Ni  Ni298  1  0.532386  0.378635  0.704299  1
  Ni  Ni299  1  0.575800  0.065669  0.658517  1
  Ni  Ni300  1  0.075800  0.565669  0.658517  1
  Ni  Ni301  1  0.846015  0.896885  0.639118  1
  Ni  Ni302  1  0.346015  0.396885  0.639118  1
  Ni  Ni303  1  0.301666  0.716253  0.682895  1
  Ni  Ni304  1  0.801666  0.216253  0.682895  1
  Ni  Ni305  1  0.165233  0.669157  0.695372  1
  Ni  Ni306  1  0.665233  0.169157  0.695372  1
  Ni  Ni307  1  0.708667  0.854903  0.649229  1
  Ni  Ni308  1  0.208667  0.354903  0.649229  1
  Ni  Ni309  1  0.939450  0.760894  0.672016  1
  Ni  Ni310  1  0.439450  0.260894  0.672016  1
  Ni  Ni311  1  0.392385  0.572172  0.717196  1
  Ni  Ni312  1  0.892385  0.072172  0.717196  1
  Ni  Ni313  1  0.797177  0.961904  0.687625  1
  Ni  Ni314  1  0.297177  0.461904  0.687625  1
  Ni  Ni315  1  0.345406  0.138603  0.639588  1
  Ni  Ni316  1  0.845406  0.638603  0.639588  1
  Ni  Ni317  1  0.756825  0.790951  0.725322  1
  Ni  Ni318  1  0.256825  0.290951  0.725322  1
  Ni  Ni319  1  0.303174  0.976815  0.681019  1
  Ni  Ni320  1  0.803174  0.476815  0.681019  1
