# generated using pymatgen
data_Al3Ni5
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   3.74294920
_cell_length_b   23.31345358
_cell_length_c   55.16951376
_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   4814.15093922
_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  1.004737  0.290324  0.329157  1
  Al  Al2  1  1.004737  0.983509  0.289636  1
  Al  Al3  1  0.004737  0.599329  0.365738  1
  Al  Al4  1  0.504737  0.206865  0.319670  1
  Al  Al5  1  0.504737  0.898440  0.281759  1
  Al  Al6  1  0.504737  0.515256  0.355510  1
  Al  Al7  1  0.504737  0.374473  0.338513  1
  Al  Al8  1  0.504737  0.067275  0.302818  1
  Al  Al9  1  0.504737  0.683985  0.376148  1
  Al  Al10  1  0.004737  0.483636  0.289758  1
  Al  Al11  1  1.004737  0.099326  0.365894  1
  Al  Al12  1  0.004737  0.790969  0.328365  1
  Al  Al13  1  0.504737  0.398028  0.281392  1
  Al  Al14  1  0.504737  0.015754  0.355699  1
  Al  Al15  1  0.504737  0.706557  0.319606  1
  Al  Al16  1  0.504737  0.183825  0.376337  1
  Al  Al17  1  0.504737  0.874991  0.338802  1
  Al  Al18  1  0.504737  0.566976  0.302747  1
  Al  Al19  1  1.004737  0.217093  0.440081  1
  Al  Al20  1  1.004737  0.908313  0.402829  1
  Al  Al21  1  0.004737  0.525641  0.476888  1
  Al  Al22  1  0.504737  0.133142  0.429929  1
  Al  Al23  1  0.504737  0.824665  0.392844  1
  Al  Al24  1  0.504737  0.441832  0.466904  1
  Al  Al25  1  0.504737  0.301130  0.450186  1
  Al  Al26  1  0.504737  0.992283  0.413007  1
  Al  Al27  1  0.504737  0.609493  0.486933  1
  Al  Al28  1  0.004737  0.408327  0.402794  1
  Al  Al29  1  1.004737  0.025737  0.477026  1
  Al  Al30  1  0.004737  0.716987  0.439911  1
  Al  Al31  1  0.504737  0.324675  0.392982  1
  Al  Al32  1  0.504737  0.941825  0.466947  1
  Al  Al33  1  0.504737  0.633001  0.429692  1
  Al  Al34  1  0.504737  0.109695  0.487138  1
  Al  Al35  1  0.504737  0.801036  0.450094  1
  Al  Al36  1  0.504737  0.492150  0.412744  1
  Al  Al37  1  0.004737  0.143101  0.551178  1
  Al  Al38  1  1.004737  0.834343  0.514023  1
  Al  Al39  1  1.004737  0.451641  0.588189  1
  Al  Al40  1  0.504737  0.059124  0.541026  1
  Al  Al41  1  0.504737  0.750349  0.503888  1
  Al  Al42  1  0.504737  0.367829  0.578248  1
  Al  Al43  1  0.504737  0.227014  0.561338  1
  Al  Al44  1  0.504737  0.918297  0.524125  1
  Al  Al45  1  0.504737  0.535379  0.598050  1
  Al  Al46  1  0.004737  0.334407  0.514148  1
  Al  Al47  1  1.004737  0.951688  0.588174  1
  Al  Al48  1  1.004737  0.642976  0.550985  1
  Al  Al49  1  0.504737  0.250534  0.504087  1
  Al  Al50  1  0.504737  0.867734  0.577992  1
  Al  Al51  1  0.504737  0.558995  0.540910  1
  Al  Al52  1  0.504737  0.035406  0.598216  1
  Al  Al53  1  0.504737  0.726876  0.561082  1
  Al  Al54  1  0.504737  0.418251  0.524151  1
  Al  Al55  1  0.004737  0.068763  0.662454  1
  Al  Al56  1  1.004737  0.760721  0.625129  1
  Al  Al57  1  1.004737  0.375785  0.701223  1
  Al  Al58  1  0.504737  0.984828  0.652184  1
  Al  Al59  1  0.504737  0.676439  0.614899  1
  Al  Al60  1  0.504737  0.292547  0.689300  1
  Al  Al61  1  0.504737  0.153406  0.671135  1
  Al  Al62  1  0.504737  0.844153  0.635268  1
  Al  Al63  1  0.504737  0.462840  0.709413  1
  Al  Al64  1  0.004737  0.260716  0.625331  1
  Al  Al65  1  1.004737  0.875634  0.701332  1
  Al  Al66  1  1.004737  0.569534  0.661615  1
  Al  Al67  1  0.504737  0.176278  0.615137  1
  Al  Al68  1  0.504737  0.792091  0.689218  1
  Al  Al69  1  0.504737  0.485390  0.652418  1
  Al  Al70  1  0.504737  0.962045  0.709053  1
  Al  Al71  1  0.504737  0.653105  0.671046  1
  Al  Al72  1  0.504737  0.344667  0.635477  1
  Ni  Ni73  1  1.004737  0.254489  0.384771  1
  Ni  Ni74  1  1.004737  0.945587  0.347516  1
  Ni  Ni75  1  0.004737  0.637202  0.311561  1
  Ni  Ni76  1  0.004737  0.349642  0.365754  1
  Ni  Ni77  1  1.004737  0.040505  0.328472  1
  Ni  Ni78  1  0.004737  0.730944  0.291183  1
  Ni  Ni79  1  1.004737  0.195508  0.348234  1
  Ni  Ni80  1  0.004737  0.887667  0.310773  1
  Ni  Ni81  1  0.004737  0.583693  0.273715  1
  Ni  Ni82  1  0.504737  0.274122  0.354760  1
  Ni  Ni83  1  0.504737  0.965519  0.317301  1
  Ni  Ni84  1  0.504737  0.658345  0.280600  1
  Ni  Ni85  1  0.504737  0.306360  0.302349  1
  Ni  Ni86  1  0.504737  0.925439  0.377235  1
  Ni  Ni87  1  0.504737  0.616437  0.340909  1
  Ni  Ni88  1  0.004737  0.444630  0.346952  1
  Ni  Ni89  1  1.004737  0.138161  0.311450  1
  Ni  Ni90  1  0.004737  0.827625  0.274457  1
  Ni  Ni91  1  1.004737  0.233190  0.290946  1
  Ni  Ni92  1  0.004737  0.849674  0.365610  1
  Ni  Ni93  1  0.004737  0.540022  0.328519  1
  Ni  Ni94  1  0.004737  0.385663  0.309771  1
  Ni  Ni95  1  1.004737  0.083732  0.273837  1
  Ni  Ni96  1  0.004737  0.695825  0.348028  1
  Ni  Ni97  1  0.504737  0.465121  0.317166  1
  Ni  Ni98  1  0.504737  0.158311  0.280745  1
  Ni  Ni99  1  0.504737  0.774353  0.354439  1
  Ni  Ni100  1  0.504737  0.425108  0.376976  1
  Ni  Ni101  1  0.504737  0.116708  0.340931  1
  Ni  Ni102  1  0.504737  0.806341  0.302913  1
  Ni  Ni103  1  0.004737  0.180130  0.495615  1
  Ni  Ni104  1  1.004737  0.871456  0.458547  1
  Ni  Ni105  1  0.004737  0.562550  0.421163  1
  Ni  Ni106  1  0.004737  0.275809  0.477107  1
  Ni  Ni107  1  1.004737  0.967035  0.439944  1
  Ni  Ni108  1  0.004737  0.658393  0.402794  1
  Ni  Ni109  1  1.004737  0.121411  0.458542  1
  Ni  Ni110  1  0.004737  0.812891  0.421575  1
  Ni  Ni111  1  0.004737  0.503639  0.384077  1
  Ni  Ni112  1  0.504737  0.200072  0.465669  1
  Ni  Ni113  1  0.504737  0.891388  0.428547  1
  Ni  Ni114  1  0.504737  0.582500  0.391235  1
  Ni  Ni115  1  0.504737  0.234315  0.414595  1
  Ni  Ni116  1  0.504737  0.851438  0.488451  1
  Ni  Ni117  1  0.504737  0.542642  0.451186  1
  Ni  Ni118  1  0.004737  0.371527  0.458570  1
  Ni  Ni119  1  1.004737  0.062733  0.421469  1
  Ni  Ni120  1  0.004737  0.754539  0.384650  1
  Ni  Ni121  1  1.004737  0.158420  0.402981  1
  Ni  Ni122  1  1.004737  0.775662  0.476974  1
  Ni  Ni123  1  0.004737  0.467026  0.439828  1
  Ni  Ni124  1  0.004737  0.312935  0.421653  1
  Ni  Ni125  1  1.004737  0.003983  0.384460  1
  Ni  Ni126  1  0.004737  0.621217  0.458294  1
  Ni  Ni127  1  0.504737  0.391426  0.428560  1
  Ni  Ni128  1  0.504737  0.082599  0.391490  1
  Ni  Ni129  1  0.504737  0.699888  0.465471  1
  Ni  Ni130  1  0.504737  0.351520  0.488511  1
  Ni  Ni131  1  0.504737  0.042771  0.451413  1
  Ni  Ni132  1  0.504737  0.734290  0.414447  1
  Ni  Ni133  1  0.004737  0.105725  0.606604  1
  Ni  Ni134  1  1.004737  0.797268  0.569520  1
  Ni  Ni135  1  1.004737  0.488594  0.532518  1
  Ni  Ni136  1  0.004737  0.201672  0.588316  1
  Ni  Ni137  1  1.004737  0.893026  0.551082  1
  Ni  Ni138  1  1.004737  0.584259  0.513944  1
  Ni  Ni139  1  0.004737  0.047294  0.569578  1
  Ni  Ni140  1  1.004737  0.738608  0.532459  1
  Ni  Ni141  1  0.004737  0.430054  0.495540  1
  Ni  Ni142  1  0.504737  0.125899  0.576739  1
  Ni  Ni143  1  0.504737  0.817263  0.539602  1
  Ni  Ni144  1  0.504737  0.508578  0.502560  1
  Ni  Ni145  1  0.504737  0.160159  0.525564  1
  Ni  Ni146  1  0.504737  0.777417  0.599491  1
  Ni  Ni147  1  0.504737  0.468641  0.562481  1
  Ni  Ni148  1  0.004737  0.297427  0.569832  1
  Ni  Ni149  1  1.004737  0.988705  0.532564  1
  Ni  Ni150  1  1.004737  0.679891  0.495393  1
  Ni  Ni151  1  1.004737  0.084431  0.514095  1
  Ni  Ni152  1  1.004737  0.701643  0.588093  1
  Ni  Ni153  1  1.004737  0.392998  0.551184  1
  Ni  Ni154  1  0.004737  0.238793  0.532711  1
  Ni  Ni155  1  1.004737  0.930074  0.495551  1
  Ni  Ni156  1  1.004737  0.547218  0.569473  1
  Ni  Ni157  1  0.504737  0.317362  0.539826  1
  Ni  Ni158  1  0.504737  0.008697  0.502639  1
  Ni  Ni159  1  0.504737  0.625855  0.576556  1
  Ni  Ni160  1  0.504737  0.277505  0.599771  1
  Ni  Ni161  1  0.504737  0.968715  0.562514  1
  Ni  Ni162  1  0.504737  0.659963  0.525355  1
  Ni  Ni163  1  0.004737  0.032526  0.716442  1
  Ni  Ni164  1  1.004737  0.722895  0.680745  1
  Ni  Ni165  1  1.004737  0.415189  0.644029  1
  Ni  Ni166  1  0.004737  0.128508  0.699365  1
  Ni  Ni167  1  1.004737  0.819305  0.662436  1
  Ni  Ni168  1  1.004737  0.510222  0.625168  1
  Ni  Ni169  1  1.004737  0.972022  0.680209  1
  Ni  Ni170  1  1.004737  0.665170  0.643172  1
  Ni  Ni171  1  1.004737  0.356302  0.606906  1
  Ni  Ni172  1  0.504737  0.053798  0.687926  1
  Ni  Ni173  1  0.504737  0.743655  0.650434  1
  Ni  Ni174  1  0.504737  0.434783  0.613998  1
  Ni  Ni175  1  0.504737  0.085609  0.636563  1
  Ni  Ni176  1  0.504737  0.698472  0.710040  1
  Ni  Ni177  1  0.504737  0.394801  0.673782  1
  Ni  Ni178  1  0.004737  0.223979  0.680690  1
  Ni  Ni179  1  1.004737  0.914214  0.643485  1
  Ni  Ni180  1  1.004737  0.605769  0.606439  1
  Ni  Ni181  1  0.004737  0.010179  0.625347  1
  Ni  Ni182  1  1.004737  0.626122  0.699703  1
  Ni  Ni183  1  1.004737  0.319872  0.662427  1
  Ni  Ni184  1  0.004737  0.164839  0.643439  1
  Ni  Ni185  1  1.004737  0.855982  0.606522  1
  Ni  Ni186  1  1.004737  0.474153  0.681136  1
  Ni  Ni187  1  0.504737  0.243953  0.650499  1
  Ni  Ni188  1  0.504737  0.934477  0.613761  1
  Ni  Ni189  1  0.504737  0.553872  0.688369  1
  Ni  Ni190  1  0.504737  0.198554  0.710211  1
  Ni  Ni191  1  0.504737  0.894254  0.673640  1
  Ni  Ni192  1  0.504737  0.585873  0.636207  1
