# generated using pymatgen
data_Al3Ni5
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   4.00149680
_cell_length_b   18.76420079
_cell_length_c   50.68895981
_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   'Al54 Ni90'
_cell_volume   3805.974945
_cell_formula_units_Z   18
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  0.999796  0.455542  0.360428  1
  Al  Al2  1  0.999796  0.724023  0.311166  1
  Al  Al3  1  0.999796  0.182558  0.408031  1
  Al  Al4  1  0.499796  0.409010  0.322128  1
  Al  Al5  1  0.499796  0.862780  0.418561  1
  Al  Al6  1  0.499796  0.135069  0.370219  1
  Al  Al7  1  0.499796  0.502340  0.396888  1
  Al  Al8  1  0.499796  0.775840  0.350590  1
  Al  Al9  1  0.499796  0.045689  0.301722  1
  Al  Al10  1  0.999796  0.682190  0.407855  1
  Al  Al11  1  0.999796  0.954974  0.360506  1
  Al  Al12  1  0.999796  0.228944  0.312688  1
  Al  Al13  1  0.499796  0.635440  0.371257  1
  Al  Al14  1  0.499796  0.908720  0.322334  1
  Al  Al15  1  0.499796  0.362578  0.418223  1
  Al  Al16  1  0.499796  0.552877  0.302548  1
  Al  Al17  1  0.499796  1.002197  0.397244  1
  Al  Al18  1  0.499796  0.274264  0.349481  1
  Al  Al19  1  0.999796  0.637113  0.503438  1
  Al  Al20  1  0.999796  0.909693  0.455817  1
  Al  Al21  1  0.999796  0.364571  0.551132  1
  Al  Al22  1  0.499796  0.589867  0.466315  1
  Al  Al23  1  0.499796  0.044381  0.561962  1
  Al  Al24  1  0.499796  0.317149  0.513875  1
  Al  Al25  1  0.499796  0.684128  0.540325  1
  Al  Al26  1  0.499796  0.956742  0.492836  1
  Al  Al27  1  0.499796  0.229355  0.444922  1
  Al  Al28  1  0.999796  0.864381  0.551341  1
  Al  Al29  1  0.999796  0.136985  0.503512  1
  Al  Al30  1  0.999796  0.409970  0.455652  1
  Al  Al31  1  0.499796  0.817265  0.514180  1
  Al  Al32  1  0.499796  0.089857  0.466300  1
  Al  Al33  1  0.499796  0.544334  0.561521  1
  Al  Al34  1  0.499796  0.729465  0.445196  1
  Al  Al35  1  0.499796  0.183916  0.540498  1
  Al  Al36  1  0.499796  0.456767  0.492493  1
  Al  Al37  1  0.999796  0.819274  0.646739  1
  Al  Al38  1  0.999796  0.091796  0.599044  1
  Al  Al39  1  0.999796  0.555531  0.695846  1
  Al  Al40  1  0.499796  0.771629  0.609686  1
  Al  Al41  1  0.499796  0.228062  0.704320  1
  Al  Al42  1  0.499796  0.497518  0.655916  1
  Al  Al43  1  0.499796  0.862462  0.683455  1
  Al  Al44  1  0.499796  0.138756  0.636437  1
  Al  Al45  1  0.499796  0.411054  0.587942  1
  Al  Al46  1  0.999796  0.048025  0.694109  1
  Al  Al47  1  0.999796  0.320764  0.646672  1
  Al  Al48  1  0.999796  0.592004  0.599029  1
  Al  Al49  1  0.499796  0.999011  0.657080  1
  Al  Al50  1  0.499796  0.271748  0.609289  1
  Al  Al51  1  0.499796  0.719354  0.703886  1
  Al  Al52  1  0.499796  0.911320  0.588474  1
  Al  Al53  1  0.499796  0.364361  0.683203  1
  Al  Al54  1  0.499796  0.638173  0.634963  1
  Ni  Ni55  1  0.999796  0.593638  0.335110  1
  Ni  Ni56  1  0.999796  0.863031  0.291737  1
  Ni  Ni57  1  0.999796  0.319030  0.384549  1
  Ni  Ni58  1  0.999796  0.705465  0.359945  1
  Ni  Ni59  1  0.999796  0.980017  0.313896  1
  Ni  Ni60  1  0.999796  0.432823  0.408025  1
  Ni  Ni61  1  0.999796  0.795956  0.431911  1
  Ni  Ni62  1  0.999796  0.068990  0.384357  1
  Ni  Ni63  1  0.999796  0.341913  0.337718  1
  Ni  Ni64  1  0.499796  0.664753  0.325824  1
  Ni  Ni65  1  0.499796  0.115951  0.419345  1
  Ni  Ni66  1  0.499796  0.388545  0.371118  1
  Ni  Ni67  1  0.499796  0.522040  0.348520  1
  Ni  Ni68  1  0.499796  0.792354  0.302918  1
  Ni  Ni69  1  0.499796  0.248263  0.396127  1
  Ni  Ni70  1  0.999796  0.363125  0.291794  1
  Ni  Ni71  1  0.999796  0.818692  0.384422  1
  Ni  Ni72  1  0.999796  0.092320  0.337534  1
  Ni  Ni73  1  0.999796  0.479679  0.313799  1
  Ni  Ni74  1  0.999796  0.932630  0.408137  1
  Ni  Ni75  1  0.999796  0.205972  0.360439  1
  Ni  Ni76  1  0.999796  0.569199  0.383490  1
  Ni  Ni77  1  0.999796  0.840099  0.337342  1
  Ni  Ni78  1  0.999796  0.113963  0.291428  1
  Ni  Ni79  1  0.499796  0.615906  0.419671  1
  Ni  Ni80  1  0.499796  0.889396  0.371574  1
  Ni  Ni81  1  0.499796  0.161129  0.323310  1
  Ni  Ni82  1  0.499796  0.748691  0.396839  1
  Ni  Ni83  1  0.499796  0.020760  0.348558  1
  Ni  Ni84  1  0.499796  0.292585  0.301751  1
  Ni  Ni85  1  0.999796  0.773383  0.479637  1
  Ni  Ni86  1  0.999796  0.046245  0.431973  1
  Ni  Ni87  1  0.999796  0.500821  0.527357  1
  Ni  Ni88  1  0.999796  0.887028  0.503566  1
  Ni  Ni89  1  0.999796  0.159833  0.455783  1
  Ni  Ni90  1  0.999796  0.614613  0.551216  1
  Ni  Ni91  1  0.999796  0.977864  0.575414  1
  Ni  Ni92  1  0.999796  0.250741  0.527326  1
  Ni  Ni93  1  0.999796  0.523546  0.479504  1
  Ni  Ni94  1  0.499796  0.843285  0.467386  1
  Ni  Ni95  1  0.499796  0.297782  0.562537  1
  Ni  Ni96  1  0.499796  0.570444  0.514887  1
  Ni  Ni97  1  0.499796  0.703494  0.491806  1
  Ni  Ni98  1  0.499796  0.976071  0.444057  1
  Ni  Ni99  1  0.499796  0.430611  0.539219  1
  Ni  Ni100  1  0.999796  0.546370  0.431580  1
  Ni  Ni101  1  0.999796  1.000586  0.527516  1
  Ni  Ni102  1  0.999796  0.273487  0.479610  1
  Ni  Ni103  1  0.999796  0.659663  0.455680  1
  Ni  Ni104  1  0.999796  0.114290  0.551274  1
  Ni  Ni105  1  0.999796  0.387240  0.503390  1
  Ni  Ni106  1  0.999796  0.750795  0.527398  1
  Ni  Ni107  1  0.999796  0.023368  0.479690  1
  Ni  Ni108  1  0.999796  0.296250  0.431950  1
  Ni  Ni109  1  0.499796  0.797728  0.562902  1
  Ni  Ni110  1  0.499796  0.070418  0.515126  1
  Ni  Ni111  1  0.499796  0.343230  0.467057  1
  Ni  Ni112  1  0.499796  0.930684  0.539650  1
  Ni  Ni113  1  0.499796  0.203277  0.491716  1
  Ni  Ni114  1  0.499796  0.476261  0.443702  1
  Ni  Ni115  1  0.999796  0.954844  0.623551  1
  Ni  Ni116  1  0.999796  0.228119  0.575048  1
  Ni  Ni117  1  0.999796  0.681750  0.671610  1
  Ni  Ni118  1  0.999796  0.068803  0.646569  1
  Ni  Ni119  1  0.999796  0.342020  0.598933  1
  Ni  Ni120  1  0.999796  0.795485  0.693571  1
  Ni  Ni121  1  0.999796  0.161762  0.715619  1
  Ni  Ni122  1  0.999796  0.435052  0.672366  1
  Ni  Ni123  1  0.999796  0.705430  0.623341  1
  Ni  Ni124  1  0.499796  0.025271  0.610676  1
  Ni  Ni125  1  0.499796  0.481123  0.703138  1
  Ni  Ni126  1  0.499796  0.750863  0.657781  1
  Ni  Ni127  1  0.499796  0.884952  0.635217  1
  Ni  Ni128  1  0.499796  0.157902  0.587365  1
  Ni  Ni129  1  0.499796  0.609632  0.680003  1
  Ni  Ni130  1  0.999796  0.728150  0.575297  1
  Ni  Ni131  1  0.999796  0.183173  0.669508  1
  Ni  Ni132  1  0.999796  0.455193  0.623542  1
  Ni  Ni133  1  0.999796  0.841801  0.599101  1
  Ni  Ni134  1  0.999796  0.296296  0.693419  1
  Ni  Ni135  1  0.999796  0.569046  0.646951  1
  Ni  Ni136  1  0.999796  0.931665  0.671810  1
  Ni  Ni137  1  0.999796  0.205870  0.622716  1
  Ni  Ni138  1  0.999796  0.478143  0.575290  1
  Ni  Ni139  1  0.499796  0.978453  0.704132  1
  Ni  Ni140  1  0.499796  0.253089  0.657598  1
  Ni  Ni141  1  0.499796  0.524605  0.609803  1
  Ni  Ni142  1  0.499796  0.113170  0.683048  1
  Ni  Ni143  1  0.499796  0.384340  0.634532  1
  Ni  Ni144  1  0.499796  0.658078  0.586821  1
