# generated using pymatgen
data_Al3Ni5
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   5.40184116
_cell_length_b   13.80805413
_cell_length_c   57.04682209
_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   'Al72 Ni120'
_cell_volume   4255.06057334
_cell_formula_units_Z   24
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  0.080850  0.949294  0.212814  1
  Al  Al2  1  0.080850  0.417092  0.300352  1
  Al  Al3  1  0.080850  0.182865  0.257373  1
  Al  Al4  1  0.080850  0.612053  0.288921  1
  Al  Al5  1  0.080850  0.378558  0.246521  1
  Al  Al6  1  0.080850  0.145327  0.202768  1
  Al  Al7  1  0.080850  0.743522  0.229892  1
  Al  Al8  1  0.080850  0.223243  0.310941  1
  Al  Al9  1  0.080850  0.987111  0.267871  1
  Al  Al10  1  0.580850  0.806584  0.276852  1
  Al  Al11  1  0.580850  0.560446  0.238200  1
  Al  Al12  1  0.580850  0.323445  0.194155  1
  Al  Al13  1  0.580850  0.751761  0.227995  1
  Al  Al14  1  0.580850  0.234059  0.309058  1
  Al  Al15  1  0.580850  -0.001803  0.266033  1
  Al  Al16  1  0.580850  0.603422  0.291588  1
  Al  Al17  1  0.580850  0.367450  0.248237  1
  Al  Al18  1  0.580850  0.127830  0.205126  1
  Al  Al19  1  0.080850  0.661840  0.339788  1
  Al  Al20  1  0.080850  0.133498  0.425217  1
  Al  Al21  1  0.080850  0.896819  0.382676  1
  Al  Al22  1  0.080850  0.329428  0.413099  1
  Al  Al23  1  0.080850  0.091451  0.371772  1
  Al  Al24  1  0.080850  0.855555  0.328979  1
  Al  Al25  1  0.080850  0.461812  0.353423  1
  Al  Al26  1  0.080850  0.938496  0.436362  1
  Al  Al27  1  0.080850  0.701861  0.393471  1
  Al  Al28  1  0.580850  0.518736  0.402669  1
  Al  Al29  1  0.580850  0.275533  0.362834  1
  Al  Al30  1  0.580850  0.039934  0.320027  1
  Al  Al31  1  0.580850  0.470916  0.350790  1
  Al  Al32  1  0.580850  0.948990  0.434337  1
  Al  Al33  1  0.580850  0.712694  0.391676  1
  Al  Al34  1  0.580850  0.320102  0.415662  1
  Al  Al35  1  0.580850  0.080865  0.373750  1
  Al  Al36  1  0.580850  0.844658  0.330745  1
  Al  Al37  1  0.080850  0.375839  0.465376  1
  Al  Al38  1  0.080850  0.849855  0.550193  1
  Al  Al39  1  0.080850  0.611848  0.508115  1
  Al  Al40  1  0.080850  0.044747  0.538193  1
  Al  Al41  1  0.080850  0.806689  0.496872  1
  Al  Al42  1  0.080850  0.570186  0.454335  1
  Al  Al43  1  0.080850  0.177869  0.478119  1
  Al  Al44  1  0.080850  0.653905  0.561346  1
  Al  Al45  1  0.080850  0.417119  0.518761  1
  Al  Al46  1  0.580850  0.233489  0.527956  1
  Al  Al47  1  0.580850  0.991639  0.487667  1
  Al  Al48  1  0.580850  0.754340  0.445392  1
  Al  Al49  1  0.580850  0.187334  0.475592  1
  Al  Al50  1  0.580850  0.664382  0.559308  1
  Al  Al51  1  0.580850  0.427859  0.516950  1
  Al  Al52  1  0.580850  0.035261  0.540771  1
  Al  Al53  1  0.580850  0.796233  0.498908  1
  Al  Al54  1  0.580850  0.559453  0.456174  1
  Al  Al55  1  0.080850  0.092166  0.590410  1
  Al  Al56  1  0.080850  0.572005  0.676688  1
  Al  Al57  1  0.080850  0.326186  0.633706  1
  Al  Al58  1  0.080850  0.761633  0.662824  1
  Al  Al59  1  0.080850  0.522330  0.621424  1
  Al  Al60  1  0.080850  0.285674  0.579603  1
  Al  Al61  1  0.080850  0.891626  0.603591  1
  Al  Al62  1  0.080850  0.372299  0.686390  1
  Al  Al63  1  0.080850  0.129616  0.643125  1
  Al  Al64  1  0.580850  0.951906  0.652340  1
  Al  Al65  1  0.580850  0.707303  0.612697  1
  Al  Al66  1  0.580850  0.469001  0.570878  1
  Al  Al67  1  0.580850  0.901194  0.600641  1
  Al  Al68  1  0.580850  0.378852  0.683363  1
  Al  Al69  1  0.580850  0.142272  0.641907  1
  Al  Al70  1  0.580850  0.745604  0.667017  1
  Al  Al71  1  0.580850  0.511328  0.623605  1
  Al  Al72  1  0.580850  0.274591  0.581236  1
  Ni  Ni73  1  0.580850  0.949725  0.212603  1
  Ni  Ni74  1  0.580850  0.417356  0.300637  1
  Ni  Ni75  1  0.580850  0.182117  0.257236  1
  Ni  Ni76  1  0.331409  0.876869  0.244621  1
  Ni  Ni77  1  0.331553  0.629323  0.205538  1
  Ni  Ni78  1  0.330757  0.110591  0.288537  1
  Ni  Ni79  1  0.329325  0.733099  0.307977  1
  Ni  Ni80  1  0.332147  0.489241  0.269401  1
  Ni  Ni81  1  0.330724  0.254740  0.226409  1
  Ni  Ni82  1  0.325918  0.814001  0.197138  1
  Ni  Ni83  1  0.323374  0.300406  0.278612  1
  Ni  Ni84  1  0.320957  0.065043  0.235982  1
  Ni  Ni85  1  0.835783  0.814001  0.197138  1
  Ni  Ni86  1  0.838326  0.300406  0.278612  1
  Ni  Ni87  1  0.840744  0.065043  0.235982  1
  Ni  Ni88  1  0.080850  0.806320  0.276375  1
  Ni  Ni89  1  0.080850  0.562437  0.238219  1
  Ni  Ni90  1  0.080850  0.326210  0.194017  1
  Ni  Ni91  1  0.832376  0.733099  0.307977  1
  Ni  Ni92  1  0.829553  0.489241  0.269401  1
  Ni  Ni93  1  0.830976  0.254740  0.226409  1
  Ni  Ni94  1  0.830291  0.876869  0.244621  1
  Ni  Ni95  1  0.830148  0.629323  0.205538  1
  Ni  Ni96  1  0.830943  0.110591  0.288537  1
  Ni  Ni97  1  0.820948  0.679063  0.259830  1
  Ni  Ni98  1  0.826275  0.445569  0.215573  1
  Ni  Ni99  1  0.823297  0.922267  0.298622  1
  Ni  Ni100  1  0.340753  0.679063  0.259830  1
  Ni  Ni101  1  0.335426  0.445569  0.215573  1
  Ni  Ni102  1  0.338403  0.922267  0.298622  1
  Ni  Ni103  1  0.580850  0.661562  0.339360  1
  Ni  Ni104  1  0.580850  0.133465  0.425401  1
  Ni  Ni105  1  0.580850  0.896883  0.382753  1
  Ni  Ni106  1  0.332264  0.589481  0.370951  1
  Ni  Ni107  1  0.329425  0.346293  0.331706  1
  Ni  Ni108  1  0.330431  0.825395  0.414035  1
  Ni  Ni109  1  0.329630  0.446664  0.433810  1
  Ni  Ni110  1  0.331970  0.204476  0.394111  1
  Ni  Ni111  1  0.331239  0.968097  0.351335  1
  Ni  Ni112  1  0.320660  0.537132  0.321199  1
  Ni  Ni113  1  0.322460  0.015037  0.404088  1
  Ni  Ni114  1  0.323339  0.778829  0.361266  1
  Ni  Ni115  1  0.841041  0.537132  0.321199  1
  Ni  Ni116  1  0.839241  0.015037  0.404088  1
  Ni  Ni117  1  0.838362  0.778829  0.361266  1
  Ni  Ni118  1  0.080850  0.518595  0.402354  1
  Ni  Ni119  1  0.080850  0.275603  0.363079  1
  Ni  Ni120  1  0.080850  0.039985  0.320086  1
  Ni  Ni121  1  0.832070  0.446664  0.433810  1
  Ni  Ni122  1  0.829731  0.204476  0.394111  1
  Ni  Ni123  1  0.830462  0.968097  0.351335  1
  Ni  Ni124  1  0.829437  0.589481  0.370951  1
  Ni  Ni125  1  0.832275  0.346293  0.331706  1
  Ni  Ni126  1  0.831270  0.825395  0.414035  1
  Ni  Ni127  1  0.821045  0.395993  0.383315  1
  Ni  Ni128  1  0.822711  0.157789  0.341489  1
  Ni  Ni129  1  0.823132  0.636339  0.423988  1
  Ni  Ni130  1  0.340656  0.395993  0.383315  1
  Ni  Ni131  1  0.338990  0.157789  0.341489  1
  Ni  Ni132  1  0.338569  0.636339  0.423988  1
  Ni  Ni133  1  0.580850  0.375786  0.465114  1
  Ni  Ni134  1  0.580850  0.849826  0.550429  1
  Ni  Ni135  1  0.580850  0.611876  0.508211  1
  Ni  Ni136  1  0.332051  0.304139  0.496480  1
  Ni  Ni137  1  0.329881  0.062488  0.456498  1
  Ni  Ni138  1  0.330381  0.540115  0.539489  1
  Ni  Ni139  1  0.329348  0.161919  0.558928  1
  Ni  Ni140  1  0.331956  0.920344  0.518934  1
  Ni  Ni141  1  0.331224  0.682846  0.476741  1
  Ni  Ni142  1  0.321342  0.253916  0.445654  1
  Ni  Ni143  1  0.322437  0.730857  0.529232  1
  Ni  Ni144  1  0.323023  0.493909  0.486616  1
  Ni  Ni145  1  0.840359  0.253916  0.445654  1
  Ni  Ni146  1  0.839263  0.730857  0.529232  1
  Ni  Ni147  1  0.838678  0.493909  0.486616  1
  Ni  Ni148  1  0.080850  0.233471  0.527677  1
  Ni  Ni149  1  0.080850  0.991567  0.487836  1
  Ni  Ni150  1  0.080850  0.754393  0.445473  1
  Ni  Ni151  1  0.832353  0.161919  0.558928  1
  Ni  Ni152  1  0.829745  0.920344  0.518934  1
  Ni  Ni153  1  0.830476  0.682846  0.476741  1
  Ni  Ni154  1  0.829650  0.304139  0.496480  1
  Ni  Ni155  1  0.831820  0.062488  0.456498  1
  Ni  Ni156  1  0.831320  0.540115  0.539489  1
  Ni  Ni157  1  0.821397  0.111644  0.508232  1
  Ni  Ni158  1  0.822393  0.872836  0.466677  1
  Ni  Ni159  1  0.823263  0.351588  0.549199  1
  Ni  Ni160  1  0.340303  0.111644  0.508232  1
  Ni  Ni161  1  0.339307  0.872836  0.466677  1
  Ni  Ni162  1  0.338438  0.351588  0.549199  1
  Ni  Ni163  1  0.580850  0.092164  0.590066  1
  Ni  Ni164  1  0.580850  0.563955  0.677003  1
  Ni  Ni165  1  0.580850  0.326372  0.634621  1
  Ni  Ni166  1  0.332687  0.018940  0.620825  1
  Ni  Ni167  1  0.329163  0.777687  0.581380  1
  Ni  Ni168  1  0.326492  0.250912  0.665329  1
  Ni  Ni169  1  0.332689  0.882406  0.683763  1
  Ni  Ni170  1  0.333148  0.634432  0.643705  1
  Ni  Ni171  1  0.332334  0.396795  0.602374  1
  Ni  Ni172  1  0.320899  0.969447  0.571035  1
  Ni  Ni173  1  0.319026  0.448880  0.653713  1
  Ni  Ni174  1  0.324072  0.209784  0.611883  1
  Ni  Ni175  1  0.840802  0.969447  0.571035  1
  Ni  Ni176  1  0.842675  0.448880  0.653713  1
  Ni  Ni177  1  0.837629  0.209784  0.611883  1
  Ni  Ni178  1  0.080850  0.949729  0.652084  1
  Ni  Ni179  1  0.080850  0.707780  0.613113  1
  Ni  Ni180  1  0.080850  0.469039  0.571087  1
  Ni  Ni181  1  0.829012  0.882406  0.683763  1
  Ni  Ni182  1  0.828553  0.634432  0.643705  1
  Ni  Ni183  1  0.829367  0.396795  0.602374  1
  Ni  Ni184  1  0.829013  0.018940  0.620825  1
  Ni  Ni185  1  0.832538  0.777687  0.581380  1
  Ni  Ni186  1  0.835208  0.250912  0.665329  1
  Ni  Ni187  1  0.817463  0.826628  0.633717  1
  Ni  Ni188  1  0.822295  0.588876  0.591614  1
  Ni  Ni189  1  0.827928  0.068258  0.675569  1
  Ni  Ni190  1  0.344237  0.826628  0.633717  1
  Ni  Ni191  1  0.339405  0.588876  0.591614  1
  Ni  Ni192  1  0.333772  0.068258  0.675569  1
