# generated using pymatgen
data_Al3Ni5
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   7.72308620
_cell_length_b   18.13586476
_cell_length_c   49.18465526
_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   6889.0412017
_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  0.488020  0.821572  0.282107  1
  Al  Al2  1  0.488020  0.514985  0.313761  1
  Al  Al3  1  0.488020  0.135734  0.259543  1
  Al  Al4  1  0.759702  0.852671  0.327972  1
  Al  Al5  1  0.763170  0.490437  0.274255  1
  Al  Al6  1  0.760747  0.169685  0.299775  1
  Al  Al7  1  0.216338  0.852671  0.327972  1
  Al  Al8  1  0.212870  0.490437  0.274255  1
  Al  Al9  1  0.215293  0.169685  0.299775  1
  Al  Al10  1  -0.011980  0.680546  0.298312  1
  Al  Al11  1  -0.011980  0.353351  0.326032  1
  Al  Al12  1  -0.011980  0.977493  0.271700  1
  Al  Al13  1  0.275155  0.656447  0.262689  1
  Al  Al14  1  0.263608  0.328718  0.286155  1
  Al  Al15  1  0.261071  1.008960  0.314750  1
  Al  Al16  1  0.700885  0.656447  0.262689  1
  Al  Al17  1  0.712432  0.328718  0.286155  1
  Al  Al18  1  0.714969  1.008960  0.314750  1
  Al  Al19  1  0.488020  0.872766  0.365204  1
  Al  Al20  1  0.488020  0.552919  0.390281  1
  Al  Al21  1  0.488020  0.193090  0.338714  1
  Al  Al22  1  0.759833  0.896908  0.403585  1
  Al  Al23  1  0.760212  0.533895  0.351111  1
  Al  Al24  1  0.758524  0.215615  0.376827  1
  Al  Al25  1  0.216207  0.896908  0.403585  1
  Al  Al26  1  0.215828  0.533895  0.351111  1
  Al  Al27  1  0.217516  0.215615  0.376827  1
  Al  Al28  1  -0.011980  0.711258  0.377974  1
  Al  Al29  1  -0.011980  0.395310  0.402731  1
  Al  Al30  1  -0.011980  0.033333  0.352049  1
  Al  Al31  1  0.260029  0.693048  0.339645  1
  Al  Al32  1  0.258582  0.374107  0.363957  1
  Al  Al33  1  0.259336  0.057089  0.390170  1
  Al  Al34  1  0.716011  0.693048  0.339645  1
  Al  Al35  1  0.717458  0.374107  0.363957  1
  Al  Al36  1  0.716704  0.057089  0.390170  1
  Al  Al37  1  0.488020  0.921068  0.441523  1
  Al  Al38  1  0.488020  0.601340  0.467246  1
  Al  Al39  1  0.488020  0.238384  0.415537  1
  Al  Al40  1  0.759286  0.942691  0.479803  1
  Al  Al41  1  0.758808  0.577808  0.428704  1
  Al  Al42  1  0.758769  0.260822  0.454186  1
  Al  Al43  1  0.216754  0.942691  0.479803  1
  Al  Al44  1  0.217232  0.577808  0.428704  1
  Al  Al45  1  0.217271  0.260822  0.454186  1
  Al  Al46  1  -0.011980  0.760705  0.454546  1
  Al  Al47  1  -0.011980  0.442459  0.479836  1
  Al  Al48  1  -0.011980  0.080908  0.428476  1
  Al  Al49  1  0.259489  0.736859  0.416320  1
  Al  Al50  1  0.258486  0.419368  0.441242  1
  Al  Al51  1  0.259012  0.102068  0.466982  1
  Al  Al52  1  0.716551  0.736859  0.416320  1
  Al  Al53  1  0.717554  0.419368  0.441242  1
  Al  Al54  1  0.717028  0.102068  0.466982  1
  Al  Al55  1  0.488020  0.964061  0.518339  1
  Al  Al56  1  0.488020  0.644183  0.544228  1
  Al  Al57  1  0.488020  0.282866  0.492800  1
  Al  Al58  1  0.758790  0.987925  0.556817  1
  Al  Al59  1  0.759076  0.623029  0.505837  1
  Al  Al60  1  0.758595  0.305385  0.531318  1
  Al  Al61  1  0.217250  0.987925  0.556817  1
  Al  Al62  1  0.216964  0.623029  0.505837  1
  Al  Al63  1  0.217445  0.305385  0.531318  1
  Al  Al64  1  -0.011980  0.804472  0.531160  1
  Al  Al65  1  -0.011980  0.485362  0.557149  1
  Al  Al66  1  -0.011980  0.123225  0.505779  1
  Al  Al67  1  0.259280  0.782745  0.492839  1
  Al  Al68  1  0.258741  0.464049  0.518573  1
  Al  Al69  1  0.258373  0.146590  0.544298  1
  Al  Al70  1  0.716760  0.782745  0.492839  1
  Al  Al71  1  0.717299  0.464049  0.518573  1
  Al  Al72  1  0.717667  0.146590  0.544298  1
  Al  Al73  1  0.488020  1.013754  0.595011  1
  Al  Al74  1  0.488020  0.694487  0.620074  1
  Al  Al75  1  0.488020  0.328340  0.569813  1
  Al  Al76  1  0.760415  0.031427  0.634566  1
  Al  Al77  1  0.759870  0.668848  0.582233  1
  Al  Al78  1  0.758863  0.350494  0.608602  1
  Al  Al79  1  0.215625  0.031427  0.634566  1
  Al  Al80  1  0.216170  0.668848  0.582233  1
  Al  Al81  1  0.217176  0.350494  0.608602  1
  Al  Al82  1  -0.011980  0.855768  0.607628  1
  Al  Al83  1  -0.011980  0.532314  0.633997  1
  Al  Al84  1  -0.011980  0.171354  0.582630  1
  Al  Al85  1  0.259325  0.828873  0.569252  1
  Al  Al86  1  0.259300  0.508861  0.595593  1
  Al  Al87  1  0.259357  0.191805  0.621259  1
  Al  Al88  1  0.716715  0.828873  0.569252  1
  Al  Al89  1  0.716739  0.508861  0.595593  1
  Al  Al90  1  0.716683  0.191805  0.621259  1
  Al  Al91  1  0.488020  0.048267  0.671859  1
  Al  Al92  1  0.488020  0.738126  0.701942  1
  Al  Al93  1  0.488020  0.373959  0.647031  1
  Al  Al94  1  0.758209  0.077976  0.710645  1
  Al  Al95  1  0.759855  0.714295  0.657732  1
  Al  Al96  1  0.763532  0.395434  0.685702  1
  Al  Al97  1  0.217831  0.077976  0.710645  1
  Al  Al98  1  0.216185  0.714295  0.657732  1
  Al  Al99  1  0.212508  0.395434  0.685702  1
  Al  Al100  1  -0.011980  0.884789  0.688169  1
  Al  Al101  1  -0.011980  0.590405  0.714037  1
  Al  Al102  1  -0.011980  0.211782  0.659352  1
  Al  Al103  1  0.258758  0.872973  0.646100  1
  Al  Al104  1  0.261671  0.555886  0.670937  1
  Al  Al105  1  0.263685  0.236923  0.698847  1
  Al  Al106  1  0.717282  0.872973  0.646100  1
  Al  Al107  1  0.714369  0.555886  0.670937  1
  Al  Al108  1  0.712355  0.236923  0.698847  1
  Ni  Ni109  1  0.488020  0.671165  0.301476  1
  Ni  Ni110  1  0.488020  0.350043  0.325318  1
  Ni  Ni111  1  0.488020  0.986363  0.276178  1
  Ni  Ni112  1  0.232524  0.593566  0.306554  1
  Ni  Ni113  1  0.236721  0.272089  0.331625  1
  Ni  Ni114  1  0.242137  0.905424  0.282920  1
  Ni  Ni115  1  0.743516  0.593566  0.306554  1
  Ni  Ni116  1  0.739319  0.272089  0.331625  1
  Ni  Ni117  1  0.733903  0.905424  0.282920  1
  Ni  Ni118  1  0.488020  0.560363  0.269368  1
  Ni  Ni119  1  0.488020  0.238315  0.293888  1
  Ni  Ni120  1  0.488020  0.919484  0.320092  1
  Ni  Ni121  1  0.488020  0.780678  0.331356  1
  Ni  Ni122  1  0.488020  0.420720  0.280644  1
  Ni  Ni123  1  0.488020  0.097120  0.306294  1
  Ni  Ni124  1  -0.011980  0.829569  0.289119  1
  Ni  Ni125  1  -0.011980  0.509380  0.312772  1
  Ni  Ni126  1  -0.011980  0.146876  0.263807  1
  Ni  Ni127  1  0.734997  0.754371  0.296094  1
  Ni  Ni128  1  0.735558  0.431148  0.319057  1
  Ni  Ni129  1  0.743987  0.060624  0.270141  1
  Ni  Ni130  1  0.241043  0.754371  0.296094  1
  Ni  Ni131  1  0.240482  0.431148  0.319057  1
  Ni  Ni132  1  0.232053  0.060624  0.270141  1
  Ni  Ni133  1  -0.011980  0.765897  0.334481  1
  Ni  Ni134  1  -0.011980  0.398983  0.281254  1
  Ni  Ni135  1  -0.011980  0.077997  0.307143  1
  Ni  Ni136  1  -0.011980  0.582105  0.267970  1
  Ni  Ni137  1  -0.011980  0.259712  0.292808  1
  Ni  Ni138  1  -0.011980  0.938503  0.319334  1
  Ni  Ni139  1  0.488020  0.717169  0.377541  1
  Ni  Ni140  1  0.488020  0.397895  0.402592  1
  Ni  Ni141  1  0.488020  0.033023  0.351717  1
  Ni  Ni142  1  0.241799  0.634714  0.384005  1
  Ni  Ni143  1  0.238929  0.317406  0.409077  1
  Ni  Ni144  1  0.239097  0.954057  0.359168  1
  Ni  Ni145  1  0.734241  0.634714  0.384005  1
  Ni  Ni146  1  0.737111  0.317406  0.409077  1
  Ni  Ni147  1  0.736943  0.954057  0.359168  1
  Ni  Ni148  1  0.488020  0.607119  0.346602  1
  Ni  Ni149  1  0.488020  0.288804  0.371104  1
  Ni  Ni150  1  0.488020  0.970088  0.397215  1
  Ni  Ni151  1  0.488020  0.823973  0.409619  1
  Ni  Ni152  1  0.488020  0.459659  0.356917  1
  Ni  Ni153  1  0.488020  0.142849  0.382978  1
  Ni  Ni154  1  -0.011980  0.875873  0.365335  1
  Ni  Ni155  1  -0.011980  0.557992  0.389443  1
  Ni  Ni156  1  -0.011980  0.191475  0.338020  1
  Ni  Ni157  1  0.740950  0.794141  0.371935  1
  Ni  Ni158  1  0.740838  0.476213  0.396188  1
  Ni  Ni159  1  0.737808  0.113354  0.344977  1
  Ni  Ni160  1  0.235090  0.794141  0.371935  1
  Ni  Ni161  1  0.235202  0.476213  0.396188  1
  Ni  Ni162  1  0.238232  0.113354  0.344977  1
  Ni  Ni163  1  -0.011980  0.809287  0.410160  1
  Ni  Ni164  1  -0.011980  0.447612  0.358595  1
  Ni  Ni165  1  -0.011980  0.130190  0.383958  1
  Ni  Ni166  1  -0.011980  0.621117  0.343092  1
  Ni  Ni167  1  -0.011980  0.300577  0.369806  1
  Ni  Ni168  1  -0.011980  0.984355  0.396531  1
  Ni  Ni169  1  0.488020  0.758491  0.454639  1
  Ni  Ni170  1  0.488020  0.441259  0.480027  1
  Ni  Ni171  1  0.488020  0.079133  0.428538  1
  Ni  Ni172  1  0.236664  0.679768  0.461012  1
  Ni  Ni173  1  0.237751  0.362547  0.486314  1
  Ni  Ni174  1  0.236692  1.000131  0.435049  1
  Ni  Ni175  1  0.739376  0.679768  0.461012  1
  Ni  Ni176  1  0.738289  0.362547  0.486314  1
  Ni  Ni177  1  0.739348  1.000131  0.435049  1
  Ni  Ni178  1  0.488020  0.650203  0.422659  1
  Ni  Ni179  1  0.488020  0.333692  0.448229  1
  Ni  Ni180  1  0.488020  1.015986  0.474152  1
  Ni  Ni181  1  0.488020  0.869305  0.485516  1
  Ni  Ni182  1  0.488020  0.505042  0.434790  1
  Ni  Ni183  1  0.488020  0.188086  0.459953  1
  Ni  Ni184  1  -0.011980  0.918812  0.441639  1
  Ni  Ni185  1  -0.011980  0.599288  0.467419  1
  Ni  Ni186  1  -0.011980  0.238417  0.415581  1
  Ni  Ni187  1  0.736601  0.839637  0.448148  1
  Ni  Ni188  1  0.736952  0.521010  0.473628  1
  Ni  Ni189  1  0.737420  0.159355  0.422013  1
  Ni  Ni190  1  0.239439  0.839637  0.448148  1
  Ni  Ni191  1  0.239088  0.521010  0.473628  1
  Ni  Ni192  1  0.238620  0.159355  0.422013  1
  Ni  Ni193  1  -0.011980  0.856217  0.487106  1
  Ni  Ni194  1  -0.011980  0.492096  0.435107  1
  Ni  Ni195  1  -0.011980  0.175056  0.461347  1
  Ni  Ni196  1  -0.011980  0.663771  0.422353  1
  Ni  Ni197  1  -0.011980  0.346611  0.447295  1
  Ni  Ni198  1  -0.011980  1.029125  0.472653  1
  Ni  Ni199  1  0.488020  0.807317  0.530911  1
  Ni  Ni200  1  0.488020  0.486903  0.557109  1
  Ni  Ni201  1  0.488020  0.125164  0.505408  1
  Ni  Ni202  1  0.239782  0.725792  0.537560  1
  Ni  Ni203  1  0.238235  0.406973  0.563519  1
  Ni  Ni204  1  0.239589  0.044913  0.511909  1
  Ni  Ni205  1  0.736258  0.725792  0.537560  1
  Ni  Ni206  1  0.737805  0.406973  0.563519  1
  Ni  Ni207  1  0.736451  0.044913  0.511909  1
  Ni  Ni208  1  0.488020  0.696210  0.500122  1
  Ni  Ni209  1  0.488020  0.378282  0.525446  1
  Ni  Ni210  1  0.488020  0.060908  0.550547  1
  Ni  Ni211  1  0.488020  0.915522  0.562949  1
  Ni  Ni212  1  0.488020  0.549766  0.511473  1
  Ni  Ni213  1  0.488020  0.232295  0.537390  1
  Ni  Ni214  1  -0.011980  0.966800  0.518120  1
  Ni  Ni215  1  -0.011980  0.646956  0.544160  1
  Ni  Ni216  1  -0.011980  0.283289  0.492733  1
  Ni  Ni217  1  0.739860  0.885851  0.524580  1
  Ni  Ni218  1  0.739474  0.565724  0.550669  1
  Ni  Ni219  1  0.738854  0.203578  0.499212  1
  Ni  Ni220  1  0.236180  0.885851  0.524580  1
  Ni  Ni221  1  0.236566  0.565724  0.550669  1
  Ni  Ni222  1  0.237186  0.203578  0.499212  1
  Ni  Ni223  1  -0.011980  0.901917  0.563107  1
  Ni  Ni224  1  -0.011980  0.536936  0.512915  1
  Ni  Ni225  1  -0.011980  0.219618  0.538100  1
  Ni  Ni226  1  -0.011980  0.709198  0.498603  1
  Ni  Ni227  1  -0.011980  0.391077  0.524284  1
  Ni  Ni228  1  -0.011980  0.073735  0.550547  1
  Ni  Ni229  1  0.488020  0.847892  0.607954  1
  Ni  Ni230  1  0.488020  0.530759  0.634432  1
  Ni  Ni231  1  0.488020  0.167493  0.583025  1
  Ni  Ni232  1  0.233751  0.772252  0.613723  1
  Ni  Ni233  1  0.237443  0.452122  0.640586  1
  Ni  Ni234  1  0.234065  0.089420  0.589335  1
  Ni  Ni235  1  0.742289  0.772252  0.613723  1
  Ni  Ni236  1  0.738597  0.452122  0.640586  1
  Ni  Ni237  1  0.741975  0.089420  0.589335  1
  Ni  Ni238  1  0.488020  0.741818  0.575764  1
  Ni  Ni239  1  0.488020  0.423074  0.602605  1
  Ni  Ni240  1  0.488020  0.105565  0.628824  1
  Ni  Ni241  1  0.488020  0.958362  0.638293  1
  Ni  Ni242  1  0.488020  0.595526  0.588730  1
  Ni  Ni243  1  0.488020  0.278071  0.614226  1
  Ni  Ni244  1  -0.011980  1.006872  0.596219  1
  Ni  Ni245  1  -0.011980  0.689647  0.620485  1
  Ni  Ni246  1  -0.011980  0.327586  0.569981  1
  Ni  Ni247  1  0.733030  0.931061  0.601558  1
  Ni  Ni248  1  0.735703  0.611706  0.626737  1
  Ni  Ni249  1  0.736319  0.248837  0.576332  1
  Ni  Ni250  1  0.243010  0.931061  0.601558  1
  Ni  Ni251  1  0.240337  0.611706  0.626737  1
  Ni  Ni252  1  0.239721  0.248837  0.576332  1
  Ni  Ni253  1  -0.011980  0.944635  0.642929  1
  Ni  Ni254  1  -0.011980  0.581379  0.589343  1
  Ni  Ni255  1  -0.011980  0.265428  0.615733  1
  Ni  Ni256  1  -0.011980  0.756620  0.575660  1
  Ni  Ni257  1  -0.011980  0.436050  0.601702  1
  Ni  Ni258  1  -0.011980  0.118137  0.626563  1
  Ni  Ni259  1  0.488020  0.895229  0.683149  1
  Ni  Ni260  1  0.488020  0.583075  0.708760  1
  Ni  Ni261  1  0.488020  0.216992  0.659731  1
  Ni  Ni262  1  0.244783  0.814012  0.690686  1
  Ni  Ni263  1  0.234954  0.503110  0.715413  1
  Ni  Ni264  1  0.242551  0.134948  0.665937  1
  Ni  Ni265  1  0.731257  0.814012  0.690686  1
  Ni  Ni266  1  0.741086  0.503110  0.715413  1
  Ni  Ni267  1  0.733489  0.134948  0.665937  1
  Ni  Ni268  1  0.488020  0.785455  0.654069  1
  Ni  Ni269  1  0.488020  0.467074  0.681393  1
  Ni  Ni270  1  0.488020  0.144836  0.704078  1
  Ni  Ni271  1  0.488020  0.998147  0.715878  1
  Ni  Ni272  1  0.488020  0.645611  0.664487  1
  Ni  Ni273  1  0.488020  0.327579  0.691659  1
  Ni  Ni274  1  -0.011980  0.057740  0.672177  1
  Ni  Ni275  1  -0.011980  0.738337  0.696062  1
  Ni  Ni276  1  -0.011980  0.374598  0.647652  1
  Ni  Ni277  1  0.745109  0.970845  0.680020  1
  Ni  Ni278  1  0.737723  0.659958  0.702203  1
  Ni  Ni279  1  0.739679  0.293749  0.653485  1
  Ni  Ni280  1  0.230931  0.970845  0.680020  1
  Ni  Ni281  1  0.238317  0.659958  0.702203  1
  Ni  Ni282  1  0.236361  0.293749  0.653485  1
  Ni  Ni283  1  -0.011980  0.989607  0.716178  1
  Ni  Ni284  1  -0.011980  0.627520  0.666379  1
  Ni  Ni285  1  -0.011980  0.305968  0.692784  1
  Ni  Ni286  1  -0.011980  0.800814  0.651041  1
  Ni  Ni287  1  -0.011980  0.487348  0.679499  1
  Ni  Ni288  1  -0.011980  0.166325  0.704112  1
