# generated using pymatgen
data_Al3Ni5
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   7.71422260
_cell_length_b   19.27434156
_cell_length_c   49.76138742
_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   7398.84957922
_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  0.488581  0.993910  0.330911  1
  Al  Al2  1  0.488581  0.616464  0.301513  1
  Al  Al3  1  0.488581  0.262125  0.280912  1
  Al  Al4  1  0.774711  0.962101  0.293245  1
  Al  Al5  1  0.760116  0.676424  0.342649  1
  Al  Al6  1  0.762958  0.316689  0.316421  1
  Al  Al7  1  0.202450  0.962101  0.293245  1
  Al  Al8  1  0.217046  0.676424  0.342649  1
  Al  Al9  1  0.214203  0.316689  0.316421  1
  Al  Al10  1  -0.011419  0.762125  0.280912  1
  Al  Al11  1  -0.011419  0.493910  0.330911  1
  Al  Al12  1  -0.011419  0.116464  0.301513  1
  Al  Al13  1  0.262958  0.816689  0.316421  1
  Al  Al14  1  0.274711  0.462101  0.293245  1
  Al  Al15  1  0.260116  0.176424  0.342649  1
  Al  Al16  1  0.714203  0.816689  0.316421  1
  Al  Al17  1  0.702450  0.462101  0.293245  1
  Al  Al18  1  0.717046  0.176424  0.342649  1
  Al  Al19  1  0.488581  0.074580  0.401554  1
  Al  Al20  1  0.488581  0.715029  0.376907  1
  Al  Al21  1  0.488581  0.355836  0.353647  1
  Al  Al22  1  0.760104  0.035290  0.365736  1
  Al  Al23  1  0.758753  0.755927  0.412480  1
  Al  Al24  1  0.758638  0.395745  0.388818  1
  Al  Al25  1  0.217057  0.035290  0.365736  1
  Al  Al26  1  0.218408  0.755927  0.412480  1
  Al  Al27  1  0.218523  0.395745  0.388818  1
  Al  Al28  1  -0.011419  0.855836  0.353647  1
  Al  Al29  1  -0.011419  0.574580  0.401554  1
  Al  Al30  1  -0.011419  0.215029  0.376907  1
  Al  Al31  1  0.258638  0.895745  0.388818  1
  Al  Al32  1  0.260104  0.535290  0.365736  1
  Al  Al33  1  0.258753  0.255927  0.412480  1
  Al  Al34  1  0.718523  0.895745  0.388818  1
  Al  Al35  1  0.717057  0.535290  0.365736  1
  Al  Al36  1  0.718408  0.255927  0.412480  1
  Al  Al37  1  0.488581  0.156127  0.472292  1
  Al  Al38  1  0.488581  0.796255  0.448124  1
  Al  Al39  1  0.488581  0.435653  0.424827  1
  Al  Al40  1  0.759690  0.115520  0.436798  1
  Al  Al41  1  0.759547  0.835223  0.484448  1
  Al  Al42  1  0.759481  0.475191  0.460664  1
  Al  Al43  1  0.217472  0.115520  0.436798  1
  Al  Al44  1  0.217615  0.835223  0.484448  1
  Al  Al45  1  0.217681  0.475191  0.460664  1
  Al  Al46  1  -0.011419  0.935653  0.424827  1
  Al  Al47  1  -0.011419  0.656127  0.472292  1
  Al  Al48  1  -0.011419  0.296255  0.448124  1
  Al  Al49  1  0.259481  0.975191  0.460664  1
  Al  Al50  1  0.259690  0.615520  0.436798  1
  Al  Al51  1  0.259547  0.335223  0.484448  1
  Al  Al52  1  0.717681  0.975191  0.460664  1
  Al  Al53  1  0.717472  0.615520  0.436798  1
  Al  Al54  1  0.717615  0.335223  0.484448  1
  Al  Al55  1  0.488581  0.234337  0.544411  1
  Al  Al56  1  0.488581  0.874079  0.520400  1
  Al  Al57  1  0.488581  0.515134  0.496274  1
  Al  Al58  1  0.759473  0.195452  0.508043  1
  Al  Al59  1  0.759441  0.915046  0.555772  1
  Al  Al60  1  0.759248  0.555477  0.531739  1
  Al  Al61  1  0.217688  0.195452  0.508043  1
  Al  Al62  1  0.217721  0.915046  0.555772  1
  Al  Al63  1  0.217913  0.555477  0.531739  1
  Al  Al64  1  -0.011419  1.015134  0.496274  1
  Al  Al65  1  -0.011419  0.734337  0.544411  1
  Al  Al66  1  -0.011419  0.374079  0.520400  1
  Al  Al67  1  0.259248  0.055477  0.531739  1
  Al  Al68  1  0.259473  0.695452  0.508043  1
  Al  Al69  1  0.259441  0.415046  0.555772  1
  Al  Al70  1  0.717913  0.055477  0.531739  1
  Al  Al71  1  0.717688  0.695452  0.508043  1
  Al  Al72  1  0.717721  0.415046  0.555772  1
  Al  Al73  1  0.488581  0.315583  0.615738  1
  Al  Al74  1  0.488581  0.956818  0.590598  1
  Al  Al75  1  0.488581  0.595424  0.567484  1
  Al  Al76  1  0.758543  0.274595  0.580140  1
  Al  Al77  1  0.760969  0.995328  0.626368  1
  Al  Al78  1  0.758577  0.635112  0.603565  1
  Al  Al79  1  0.218618  0.274595  0.580140  1
  Al  Al80  1  0.216193  0.995328  0.626368  1
  Al  Al81  1  0.218584  0.635112  0.603565  1
  Al  Al82  1  -0.011419  0.095424  0.567484  1
  Al  Al83  1  -0.011419  0.815583  0.615738  1
  Al  Al84  1  -0.011419  0.456818  0.590598  1
  Al  Al85  1  0.258577  0.135112  0.603565  1
  Al  Al86  1  0.258543  0.774595  0.580140  1
  Al  Al87  1  0.260969  0.495328  0.626368  1
  Al  Al88  1  0.718584  0.135112  0.603565  1
  Al  Al89  1  0.718618  0.774595  0.580140  1
  Al  Al90  1  0.716193  0.495328  0.626368  1
  Al  Al91  1  0.488581  0.417795  0.690833  1
  Al  Al92  1  0.488581  0.037103  0.661291  1
  Al  Al93  1  0.488581  0.677286  0.638831  1
  Al  Al94  1  0.762196  0.353502  0.649884  1
  Al  Al95  1  0.775889  0.067423  0.698860  1
  Al  Al96  1  0.766707  0.713222  0.676270  1
  Al  Al97  1  0.214965  0.353502  0.649884  1
  Al  Al98  1  0.201273  0.067423  0.698860  1
  Al  Al99  1  0.210454  0.713222  0.676270  1
  Al  Al100  1  -0.011419  0.177286  0.638831  1
  Al  Al101  1  -0.011419  0.917795  0.690833  1
  Al  Al102  1  -0.011419  0.537103  0.661291  1
  Al  Al103  1  0.266707  0.213222  0.676270  1
  Al  Al104  1  0.262196  0.853502  0.649884  1
  Al  Al105  1  0.275889  0.567423  0.698860  1
  Al  Al106  1  0.710454  0.213222  0.676270  1
  Al  Al107  1  0.714965  0.853502  0.649884  1
  Al  Al108  1  0.701273  0.567423  0.698860  1
  Ni  Ni109  1  0.488581  0.779101  0.283042  1
  Ni  Ni110  1  0.488581  0.497754  0.329166  1
  Ni  Ni111  1  0.488581  0.140700  0.307610  1
  Ni  Ni112  1  0.251454  0.698865  0.295462  1
  Ni  Ni113  1  0.241026  0.425626  0.340910  1
  Ni  Ni114  1  0.248055  0.067251  0.318977  1
  Ni  Ni115  1  0.725707  0.698865  0.295462  1
  Ni  Ni116  1  0.736136  0.425626  0.340910  1
  Ni  Ni117  1  0.729106  0.067251  0.318977  1
  Ni  Ni118  1  0.488581  0.734161  0.329851  1
  Ni  Ni119  1  0.488581  0.376560  0.306800  1
  Ni  Ni120  1  0.488581  0.026268  0.284751  1
  Ni  Ni121  1  0.488581  0.898207  0.302459  1
  Ni  Ni122  1  0.488581  0.611497  0.351520  1
  Ni  Ni123  1  0.488581  0.253921  0.328812  1
  Ni  Ni124  1  -0.011419  0.997754  0.329166  1
  Ni  Ni125  1  -0.011419  0.640700  0.307610  1
  Ni  Ni126  1  -0.011419  0.279101  0.283042  1
  Ni  Ni127  1  0.741026  0.925626  0.340910  1
  Ni  Ni128  1  0.748055  0.567251  0.318977  1
  Ni  Ni129  1  0.751454  0.198865  0.295462  1
  Ni  Ni130  1  0.236136  0.925626  0.340910  1
  Ni  Ni131  1  0.229106  0.567251  0.318977  1
  Ni  Ni132  1  0.225707  0.198865  0.295462  1
  Ni  Ni133  1  -0.011419  0.876560  0.306800  1
  Ni  Ni134  1  -0.011419  0.526268  0.284751  1
  Ni  Ni135  1  -0.011419  0.234161  0.329851  1
  Ni  Ni136  1  -0.011419  0.753921  0.328812  1
  Ni  Ni137  1  -0.011419  0.398207  0.302459  1
  Ni  Ni138  1  -0.011419  0.111497  0.351520  1
  Ni  Ni139  1  0.488581  0.856341  0.351705  1
  Ni  Ni140  1  0.488581  0.575513  0.400830  1
  Ni  Ni141  1  0.488581  0.217161  0.377228  1
  Ni  Ni142  1  0.240724  0.786980  0.364577  1
  Ni  Ni143  1  0.238976  0.505150  0.413163  1
  Ni  Ni144  1  0.239565  0.145179  0.389492  1
  Ni  Ni145  1  0.736438  0.786980  0.364577  1
  Ni  Ni146  1  0.738186  0.505150  0.413163  1
  Ni  Ni147  1  0.737596  0.145179  0.389492  1
  Ni  Ni148  1  0.488581  0.820492  0.401135  1
  Ni  Ni149  1  0.488581  0.459860  0.377979  1
  Ni  Ni150  1  0.488581  0.099404  0.355381  1
  Ni  Ni151  1  0.488581  0.970258  0.376752  1
  Ni  Ni152  1  0.488581  0.691530  0.423612  1
  Ni  Ni153  1  0.488581  0.331732  0.400150  1
  Ni  Ni154  1  -0.011419  0.075513  0.400830  1
  Ni  Ni155  1  -0.011419  0.717161  0.377228  1
  Ni  Ni156  1  -0.011419  0.356341  0.351705  1
  Ni  Ni157  1  0.738976  1.005150  0.413163  1
  Ni  Ni158  1  0.739565  0.645179  0.389492  1
  Ni  Ni159  1  0.740724  0.286980  0.364577  1
  Ni  Ni160  1  0.238186  1.005150  0.413163  1
  Ni  Ni161  1  0.237596  0.645179  0.389492  1
  Ni  Ni162  1  0.236438  0.286980  0.364577  1
  Ni  Ni163  1  -0.011419  0.959860  0.377979  1
  Ni  Ni164  1  -0.011419  0.599404  0.355381  1
  Ni  Ni165  1  -0.011419  0.320492  0.401135  1
  Ni  Ni166  1  -0.011419  0.831732  0.400150  1
  Ni  Ni167  1  -0.011419  0.470258  0.376752  1
  Ni  Ni168  1  -0.011419  0.191530  0.423612  1
  Ni  Ni169  1  0.488581  0.934927  0.425047  1
  Ni  Ni170  1  0.488581  0.655416  0.472242  1
  Ni  Ni171  1  0.488581  0.295271  0.448737  1
  Ni  Ni172  1  0.237765  0.865460  0.436651  1
  Ni  Ni173  1  0.238563  0.585533  0.484268  1
  Ni  Ni174  1  0.237804  0.225893  0.460307  1
  Ni  Ni175  1  0.739397  0.865460  0.436651  1
  Ni  Ni176  1  0.738599  0.585533  0.484268  1
  Ni  Ni177  1  0.739358  0.225893  0.460307  1
  Ni  Ni178  1  0.488581  0.899300  0.473668  1
  Ni  Ni179  1  0.488581  0.539528  0.449658  1
  Ni  Ni180  1  0.488581  0.180131  0.425694  1
  Ni  Ni181  1  0.488581  0.051188  0.447870  1
  Ni  Ni182  1  0.488581  0.771034  0.494981  1
  Ni  Ni183  1  0.488581  0.410965  0.471501  1
  Ni  Ni184  1  -0.011419  0.155416  0.472242  1
  Ni  Ni185  1  -0.011419  0.795271  0.448737  1
  Ni  Ni186  1  -0.011419  0.434927  0.425047  1
  Ni  Ni187  1  0.738563  0.085533  0.484268  1
  Ni  Ni188  1  0.737804  0.725893  0.460307  1
  Ni  Ni189  1  0.737765  0.365460  0.436651  1
  Ni  Ni190  1  0.238599  0.085533  0.484268  1
  Ni  Ni191  1  0.239358  0.725893  0.460307  1
  Ni  Ni192  1  0.239397  0.365460  0.436651  1
  Ni  Ni193  1  -0.011419  0.039528  0.449658  1
  Ni  Ni194  1  -0.011419  0.680131  0.425694  1
  Ni  Ni195  1  -0.011419  0.399300  0.473668  1
  Ni  Ni196  1  -0.011419  0.910965  0.471501  1
  Ni  Ni197  1  -0.011419  0.551188  0.447870  1
  Ni  Ni198  1  -0.011419  0.271034  0.494981  1
  Ni  Ni199  1  0.488581  1.015478  0.496156  1
  Ni  Ni200  1  0.488581  0.735479  0.543756  1
  Ni  Ni201  1  0.488581  0.375390  0.520228  1
  Ni  Ni202  1  0.239175  0.945023  0.508215  1
  Ni  Ni203  1  0.239287  0.665286  0.555779  1
  Ni  Ni204  1  0.239722  0.304684  0.532247  1
  Ni  Ni205  1  0.737986  0.945023  0.508215  1
  Ni  Ni206  1  0.737875  0.665286  0.555779  1
  Ni  Ni207  1  0.737440  0.304684  0.532247  1
  Ni  Ni208  1  0.488581  0.979563  0.544398  1
  Ni  Ni209  1  0.488581  0.619728  0.520874  1
  Ni  Ni210  1  0.488581  0.259604  0.497533  1
  Ni  Ni211  1  0.488581  0.131297  0.518885  1
  Ni  Ni212  1  0.488581  0.850131  0.567196  1
  Ni  Ni213  1  0.488581  0.491050  0.542891  1
  Ni  Ni214  1  -0.011419  0.235479  0.543756  1
  Ni  Ni215  1  -0.011419  0.875390  0.520228  1
  Ni  Ni216  1  -0.011419  0.515478  0.496156  1
  Ni  Ni217  1  0.739287  0.165286  0.555779  1
  Ni  Ni218  1  0.739722  0.804684  0.532247  1
  Ni  Ni219  1  0.739175  0.445023  0.508215  1
  Ni  Ni220  1  0.237875  0.165286  0.555779  1
  Ni  Ni221  1  0.237440  0.804684  0.532247  1
  Ni  Ni222  1  0.237986  0.445023  0.508215  1
  Ni  Ni223  1  -0.011419  0.119728  0.520874  1
  Ni  Ni224  1  -0.011419  0.759604  0.497533  1
  Ni  Ni225  1  -0.011419  0.479563  0.544398  1
  Ni  Ni226  1  -0.011419  0.991050  0.542891  1
  Ni  Ni227  1  -0.011419  0.631297  0.518885  1
  Ni  Ni228  1  -0.011419  0.350131  0.567196  1
  Ni  Ni229  1  0.488581  0.095744  0.567371  1
  Ni  Ni230  1  0.488581  0.811927  0.616226  1
  Ni  Ni231  1  0.488581  0.454903  0.591726  1
  Ni  Ni232  1  0.237464  1.025855  0.579140  1
  Ni  Ni233  1  0.234796  0.743424  0.627996  1
  Ni  Ni234  1  0.236389  0.385003  0.603110  1
  Ni  Ni235  1  0.739698  1.025855  0.579140  1
  Ni  Ni236  1  0.742365  0.743424  0.627996  1
  Ni  Ni237  1  0.740772  0.385003  0.603110  1
  Ni  Ni238  1  0.488581  0.060725  0.615568  1
  Ni  Ni239  1  0.488581  0.699125  0.592274  1
  Ni  Ni240  1  0.488581  0.339062  0.568928  1
  Ni  Ni241  1  0.488581  0.210137  0.591453  1
  Ni  Ni242  1  0.488581  0.931781  0.636601  1
  Ni  Ni243  1  0.488581  0.571904  0.614352  1
  Ni  Ni244  1  -0.011419  0.311927  0.616226  1
  Ni  Ni245  1  -0.011419  0.954903  0.591726  1
  Ni  Ni246  1  -0.011419  0.595744  0.567371  1
  Ni  Ni247  1  0.734796  0.243424  0.627996  1
  Ni  Ni248  1  0.736389  0.885003  0.603110  1
  Ni  Ni249  1  0.737464  0.525855  0.579140  1
  Ni  Ni250  1  0.242365  0.243424  0.627996  1
  Ni  Ni251  1  0.240772  0.885003  0.603110  1
  Ni  Ni252  1  0.239698  0.525855  0.579140  1
  Ni  Ni253  1  -0.011419  0.199125  0.592274  1
  Ni  Ni254  1  -0.011419  0.839062  0.568928  1
  Ni  Ni255  1  -0.011419  0.560725  0.615568  1
  Ni  Ni256  1  -0.011419  0.071904  0.614352  1
  Ni  Ni257  1  -0.011419  0.710137  0.591453  1
  Ni  Ni258  1  -0.011419  0.431781  0.636601  1
  Ni  Ni259  1  0.488581  0.174047  0.641025  1
  Ni  Ni260  1  0.488581  0.892328  0.684354  1
  Ni  Ni261  1  0.488581  0.532818  0.662717  1
  Ni  Ni262  1  0.235112  0.104980  0.651180  1
  Ni  Ni263  1  0.226803  0.830671  0.696870  1
  Ni  Ni264  1  0.229045  0.463724  0.672840  1
  Ni  Ni265  1  0.742049  0.104980  0.651180  1
  Ni  Ni266  1  0.750359  0.830671  0.696870  1
  Ni  Ni267  1  0.748116  0.463724  0.672840  1
  Ni  Ni268  1  0.488581  0.132229  0.690315  1
  Ni  Ni269  1  0.488581  0.776023  0.666566  1
  Ni  Ni270  1  0.488581  0.418482  0.640979  1
  Ni  Ni271  1  0.488581  0.296833  0.663293  1
  Ni  Ni272  1  0.488581  1.005196  0.707484  1
  Ni  Ni273  1  0.488581  0.652869  0.685211  1
  Ni  Ni274  1  -0.011419  0.392328  0.684354  1
  Ni  Ni275  1  -0.011419  0.032818  0.662717  1
  Ni  Ni276  1  -0.011419  0.674047  0.641025  1
  Ni  Ni277  1  0.726803  0.330671  0.696870  1
  Ni  Ni278  1  0.729045  0.963724  0.672840  1
  Ni  Ni279  1  0.735112  0.604980  0.651180  1
  Ni  Ni280  1  0.250359  0.330671  0.696870  1
  Ni  Ni281  1  0.248116  0.963724  0.672840  1
  Ni  Ni282  1  0.242049  0.604980  0.651180  1
  Ni  Ni283  1  -0.011419  0.276023  0.666566  1
  Ni  Ni284  1  -0.011419  0.918482  0.640979  1
  Ni  Ni285  1  -0.011419  0.632229  0.690315  1
  Ni  Ni286  1  -0.011419  0.152869  0.685211  1
  Ni  Ni287  1  -0.011419  0.796833  0.663293  1
  Ni  Ni288  1  -0.011419  0.505196  0.707484  1
