# generated using pymatgen
data_Al3Ni5
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   7.27299994
_cell_length_b   14.42325510
_cell_length_c   49.78507477
_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   5222.47094897
_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  0.503972  0.521529  0.299058  1
  Al  Al2  1  0.503972  0.055745  0.340982  1
  Al  Al3  1  0.765749  0.555873  0.341778  1
  Al  Al4  1  0.766487  0.022041  0.301898  1
  Al  Al5  1  0.242196  0.555873  0.341778  1
  Al  Al6  1  0.241457  0.022041  0.301898  1
  Al  Al7  1  0.003972  0.753563  0.285648  1
  Al  Al8  1  0.003972  0.296848  0.321916  1
  Al  Al9  1  0.264613  0.792074  0.323262  1
  Al  Al10  1  0.273338  0.262564  0.286824  1
  Al  Al11  1  0.743332  0.792074  0.323262  1
  Al  Al12  1  0.734607  0.262564  0.286824  1
  Al  Al13  1  0.503972  0.588016  0.377072  1
  Al  Al14  1  0.503972  0.120463  0.412117  1
  Al  Al15  1  0.768459  0.620483  0.412444  1
  Al  Al16  1  0.769906  0.088897  0.376286  1
  Al  Al17  1  0.239486  0.620483  0.412444  1
  Al  Al18  1  0.238039  0.088897  0.376286  1
  Al  Al19  1  0.003972  0.822405  0.359196  1
  Al  Al20  1  0.003972  0.353780  0.394575  1
  Al  Al21  1  0.268904  0.854816  0.394276  1
  Al  Al22  1  0.268607  0.322829  0.358912  1
  Al  Al23  1  0.739041  0.854816  0.394276  1
  Al  Al24  1  0.739338  0.322829  0.358912  1
  Al  Al25  1  0.503972  0.652630  0.448117  1
  Al  Al26  1  0.503972  0.184262  0.483915  1
  Al  Al27  1  0.768599  0.684720  0.483807  1
  Al  Al28  1  0.768664  0.152356  0.448051  1
  Al  Al29  1  0.239346  0.684720  0.483807  1
  Al  Al30  1  0.239281  0.152356  0.448051  1
  Al  Al31  1  0.003972  0.886809  0.430072  1
  Al  Al32  1  0.003972  0.418247  0.466073  1
  Al  Al33  1  0.268643  0.918715  0.465906  1
  Al  Al34  1  0.268610  0.386010  0.430334  1
  Al  Al35  1  0.739302  0.918715  0.465906  1
  Al  Al36  1  0.739335  0.386010  0.430334  1
  Al  Al37  1  0.503972  0.716768  0.519573  1
  Al  Al38  1  0.503972  0.247981  0.555518  1
  Al  Al39  1  0.768566  0.748806  0.555415  1
  Al  Al40  1  0.768638  0.216137  0.519737  1
  Al  Al41  1  0.239379  0.748806  0.555415  1
  Al  Al42  1  0.239307  0.216137  0.519737  1
  Al  Al43  1  0.003972  0.950524  0.501744  1
  Al  Al44  1  0.003972  0.482513  0.537405  1
  Al  Al45  1  0.268687  0.982355  0.537603  1
  Al  Al46  1  0.268593  0.450335  0.501773  1
  Al  Al47  1  0.739258  0.982355  0.537603  1
  Al  Al48  1  0.739352  0.450335  0.501773  1
  Al  Al49  1  0.503972  0.780715  0.591353  1
  Al  Al50  1  0.503972  0.311625  0.626481  1
  Al  Al51  1  0.770074  0.811625  0.626979  1
  Al  Al52  1  0.768409  0.279774  0.591255  1
  Al  Al53  1  0.237871  0.811625  0.626979  1
  Al  Al54  1  0.239536  0.279774  0.591255  1
  Al  Al55  1  0.003972  0.014386  0.573484  1
  Al  Al56  1  0.003972  0.547417  0.608629  1
  Al  Al57  1  0.269293  0.046431  0.609467  1
  Al  Al58  1  0.268685  0.514945  0.573003  1
  Al  Al59  1  0.738652  0.046431  0.609467  1
  Al  Al60  1  0.739260  0.514945  0.573003  1
  Al  Al61  1  0.503972  0.842178  0.661840  1
  Al  Al62  1  0.503972  0.382656  0.703266  1
  Al  Al63  1  0.761004  0.876338  0.700515  1
  Al  Al64  1  0.766114  0.345604  0.660682  1
  Al  Al65  1  0.246941  0.876338  0.700515  1
  Al  Al66  1  0.241831  0.345604  0.660682  1
  Al  Al67  1  0.003972  0.078928  0.645136  1
  Al  Al68  1  0.003972  0.602248  0.686361  1
  Al  Al69  1  0.266867  0.110066  0.683949  1
  Al  Al70  1  0.266621  0.578251  0.644512  1
  Al  Al71  1  0.741078  0.110066  0.683949  1
  Al  Al72  1  0.741324  0.578251  0.644512  1
  Ni  Ni73  1  0.503972  0.755089  0.291276  1
  Ni  Ni74  1  0.503972  0.292206  0.323845  1
  Ni  Ni75  1  0.751079  0.410609  0.314870  1
  Ni  Ni76  1  0.754709  0.941001  0.349297  1
  Ni  Ni77  1  0.256866  0.410609  0.314870  1
  Ni  Ni78  1  0.253236  0.941001  0.349297  1
  Ni  Ni79  1  0.503972  0.666465  0.332788  1
  Ni  Ni80  1  0.503972  0.141604  0.299284  1
  Ni  Ni81  1  0.503972  0.444882  0.348828  1
  Ni  Ni82  1  0.503972  0.910768  0.314480  1
  Ni  Ni83  1  0.003972  0.524822  0.307373  1
  Ni  Ni84  1  0.003972  0.055530  0.340273  1
  Ni  Ni85  1  0.251375  0.640954  0.299199  1
  Ni  Ni86  1  0.252907  0.173467  0.331839  1
  Ni  Ni87  1  0.756570  0.640954  0.299199  1
  Ni  Ni88  1  0.755038  0.173467  0.331839  1
  Ni  Ni89  1  0.003972  0.437200  0.350700  1
  Ni  Ni90  1  0.003972  0.903495  0.315233  1
  Ni  Ni91  1  0.003972  0.676594  0.332329  1
  Ni  Ni92  1  0.003972  0.148233  0.298754  1
  Ni  Ni93  1  0.503972  0.822216  0.358524  1
  Ni  Ni94  1  0.503972  0.354311  0.394446  1
  Ni  Ni95  1  0.753457  0.470921  0.385789  1
  Ni  Ni96  1  0.754061  0.003731  0.421102  1
  Ni  Ni97  1  0.254488  0.470921  0.385789  1
  Ni  Ni98  1  0.253884  0.003731  0.421102  1
  Ni  Ni99  1  0.503972  0.734663  0.403680  1
  Ni  Ni100  1  0.503972  0.202143  0.367571  1
  Ni  Ni101  1  0.503972  0.506170  0.421306  1
  Ni  Ni102  1  0.503972  0.974605  0.385035  1
  Ni  Ni103  1  0.003972  0.588690  0.376857  1
  Ni  Ni104  1  0.003972  0.120850  0.412106  1
  Ni  Ni105  1  0.254814  0.705546  0.367538  1
  Ni  Ni106  1  0.253854  0.237200  0.403294  1
  Ni  Ni107  1  0.753131  0.705546  0.367538  1
  Ni  Ni108  1  0.754091  0.237200  0.403294  1
  Ni  Ni109  1  0.003972  0.500063  0.421644  1
  Ni  Ni110  1  0.003972  0.968724  0.385519  1
  Ni  Ni111  1  0.003972  0.740486  0.403274  1
  Ni  Ni112  1  0.003972  0.209545  0.366370  1
  Ni  Ni113  1  0.503972  0.886807  0.430112  1
  Ni  Ni114  1  0.503972  0.418133  0.466088  1
  Ni  Ni115  1  0.754035  0.535354  0.457104  1
  Ni  Ni116  1  0.753958  0.067388  0.492828  1
  Ni  Ni117  1  0.253910  0.535354  0.457104  1
  Ni  Ni118  1  0.253987  0.067388  0.492828  1
  Ni  Ni119  1  0.503972  0.798636  0.475126  1
  Ni  Ni120  1  0.503972  0.265966  0.439419  1
  Ni  Ni121  1  0.503972  0.570634  0.492510  1
  Ni  Ni122  1  0.503972  0.038764  0.456679  1
  Ni  Ni123  1  0.003972  0.652498  0.448128  1
  Ni  Ni124  1  0.003972  0.184207  0.483924  1
  Ni  Ni125  1  0.254013  0.769795  0.439099  1
  Ni  Ni126  1  0.253999  0.301142  0.475020  1
  Ni  Ni127  1  0.753932  0.769795  0.439099  1
  Ni  Ni128  1  0.753946  0.301142  0.475020  1
  Ni  Ni129  1  0.003972  0.564502  0.493038  1
  Ni  Ni130  1  0.003972  0.032419  0.457225  1
  Ni  Ni131  1  0.003972  0.804879  0.474568  1
  Ni  Ni132  1  0.003972  0.272339  0.438985  1
  Ni  Ni133  1  0.503972  0.950536  0.501745  1
  Ni  Ni134  1  0.503972  0.482578  0.537410  1
  Ni  Ni135  1  0.753901  0.599818  0.528443  1
  Ni  Ni136  1  0.754057  0.130997  0.564516  1
  Ni  Ni137  1  0.254044  0.599818  0.528443  1
  Ni  Ni138  1  0.253888  0.130997  0.564516  1
  Ni  Ni139  1  0.503972  0.862360  0.546809  1
  Ni  Ni140  1  0.503972  0.330074  0.511052  1
  Ni  Ni141  1  0.503972  0.635135  0.564030  1
  Ni  Ni142  1  0.503972  0.102357  0.528401  1
  Ni  Ni143  1  0.003972  0.716863  0.519556  1
  Ni  Ni144  1  0.003972  0.248069  0.555510  1
  Ni  Ni145  1  0.253982  0.833674  0.510661  1
  Ni  Ni146  1  0.253919  0.365214  0.546486  1
  Ni  Ni147  1  0.753963  0.833674  0.510661  1
  Ni  Ni148  1  0.754026  0.365214  0.546486  1
  Ni  Ni149  1  0.003972  0.628771  0.564353  1
  Ni  Ni150  1  0.003972  0.096045  0.528948  1
  Ni  Ni151  1  0.003972  0.868772  0.546269  1
  Ni  Ni152  1  0.003972  0.336262  0.510501  1
  Ni  Ni153  1  0.503972  0.014214  0.573466  1
  Ni  Ni154  1  0.503972  0.546717  0.608857  1
  Ni  Ni155  1  0.754558  0.663673  0.600104  1
  Ni  Ni156  1  0.752455  0.193765  0.636753  1
  Ni  Ni157  1  0.253387  0.663673  0.600104  1
  Ni  Ni158  1  0.255490  0.193765  0.636753  1
  Ni  Ni159  1  0.503972  0.926910  0.618570  1
  Ni  Ni160  1  0.503972  0.394490  0.582222  1
  Ni  Ni161  1  0.503972  0.697115  0.635589  1
  Ni  Ni162  1  0.503972  0.165793  0.600078  1
  Ni  Ni163  1  0.003972  0.780330  0.591298  1
  Ni  Ni164  1  0.003972  0.312010  0.626490  1
  Ni  Ni165  1  0.253866  0.897604  0.582414  1
  Ni  Ni166  1  0.254267  0.430489  0.617342  1
  Ni  Ni167  1  0.754079  0.897604  0.582414  1
  Ni  Ni168  1  0.753678  0.430489  0.617342  1
  Ni  Ni169  1  0.003972  0.689536  0.637572  1
  Ni  Ni170  1  0.003972  0.159857  0.600695  1
  Ni  Ni171  1  0.003972  0.933216  0.617976  1
  Ni  Ni172  1  0.003972  0.400541  0.581752  1
  Ni  Ni173  1  0.503972  0.079875  0.645741  1
  Ni  Ni174  1  0.503972  0.606887  0.679619  1
  Ni  Ni175  1  0.756629  0.724638  0.671495  1
  Ni  Ni176  1  0.763810  0.267419  0.703557  1
  Ni  Ni177  1  0.251316  0.724638  0.671495  1
  Ni  Ni178  1  0.244135  0.267419  0.703557  1
  Ni  Ni179  1  0.503972  0.986490  0.687321  1
  Ni  Ni180  1  0.503972  0.456151  0.653708  1
  Ni  Ni181  1  0.503972  0.751961  0.703201  1
  Ni  Ni182  1  0.503972  0.233929  0.671732  1
  Ni  Ni183  1  0.003972  0.845276  0.662076  1
  Ni  Ni184  1  0.003972  0.380112  0.694828  1
  Ni  Ni185  1  0.254192  0.960914  0.654005  1
  Ni  Ni186  1  0.259281  0.490128  0.687364  1
  Ni  Ni187  1  0.753753  0.960914  0.654005  1
  Ni  Ni188  1  0.748664  0.490128  0.687364  1
  Ni  Ni189  1  0.003972  0.757926  0.703419  1
  Ni  Ni190  1  0.003972  0.224179  0.671326  1
  Ni  Ni191  1  0.003972  0.992435  0.687302  1
  Ni  Ni192  1  0.003972  0.466740  0.652546  1
