# generated using pymatgen
data_Al3Ni5
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   3.85441359
_cell_length_b   19.44676299
_cell_length_c   49.52426361
_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   3712.13414709
_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  0.990140  0.355570  0.357902  1
  Al  Al2  1  0.990140  0.639232  0.308259  1
  Al  Al3  1  0.990140  0.074883  0.404643  1
  Al  Al4  1  0.490140  0.316052  0.318400  1
  Al  Al5  1  0.490140  0.750598  0.414022  1
  Al  Al6  1  0.490140  0.032723  0.366003  1
  Al  Al7  1  0.490140  0.397825  0.396679  1
  Al  Al8  1  0.490140  0.679733  0.348761  1
  Al  Al9  1  0.490140  0.959423  0.301843  1
  Al  Al10  1  0.990140  0.574883  0.404643  1
  Al  Al11  1  0.990140  0.855570  0.357902  1
  Al  Al12  1  0.990140  0.139232  0.308259  1
  Al  Al13  1  0.490140  0.532723  0.366003  1
  Al  Al14  1  0.490140  0.816052  0.318400  1
  Al  Al15  1  0.490140  0.250598  0.414022  1
  Al  Al16  1  0.490140  0.459423  0.301843  1
  Al  Al17  1  0.490140  0.897825  0.396679  1
  Al  Al18  1  0.490140  0.179733  0.348761  1
  Al  Al19  1  0.990140  0.511679  0.500215  1
  Al  Al20  1  0.990140  0.792469  0.453033  1
  Al  Al21  1  -0.009860  0.229653  0.548303  1
  Al  Al22  1  0.490140  0.469260  0.461546  1
  Al  Al23  1  0.490140  0.906079  0.556888  1
  Al  Al24  1  0.490140  0.187577  0.509399  1
  Al  Al25  1  0.490140  0.553794  0.539044  1
  Al  Al26  1  0.490140  0.834867  0.491858  1
  Al  Al27  1  0.490140  0.116704  0.443826  1
  Al  Al28  1  -0.009860  0.729653  0.548303  1
  Al  Al29  1  0.990140  1.011679  0.500215  1
  Al  Al30  1  0.990140  0.292469  0.453033  1
  Al  Al31  1  0.490140  0.687577  0.509399  1
  Al  Al32  1  0.490140  0.969260  0.461546  1
  Al  Al33  1  0.490140  0.406079  0.556888  1
  Al  Al34  1  0.490140  0.616704  0.443826  1
  Al  Al35  1  0.490140  0.053794  0.539044  1
  Al  Al36  1  0.490140  0.334867  0.491858  1
  Al  Al37  1  0.990140  0.668930  0.643603  1
  Al  Al38  1  0.990140  0.949250  0.595598  1
  Al  Al39  1  0.990140  0.398553  0.693652  1
  Al  Al40  1  0.490140  0.624483  0.604738  1
  Al  Al41  1  0.490140  0.055690  0.699713  1
  Al  Al42  1  0.490140  0.341794  0.651499  1
  Al  Al43  1  0.490140  0.707274  0.682478  1
  Al  Al44  1  0.490140  0.991307  0.633471  1
  Al  Al45  1  0.490140  0.271786  0.587269  1
  Al  Al46  1  0.990140  0.898553  0.693652  1
  Al  Al47  1  0.990140  0.168930  0.643603  1
  Al  Al48  1  0.990140  0.449250  0.595598  1
  Al  Al49  1  0.490140  0.841794  0.651499  1
  Al  Al50  1  0.490140  0.124483  0.604738  1
  Al  Al51  1  0.490140  0.555690  0.699713  1
  Al  Al52  1  0.490140  0.771786  0.587269  1
  Al  Al53  1  0.490140  0.207274  0.682478  1
  Al  Al54  1  0.490140  0.491307  0.633471  1
  Ni  Ni55  1  0.990140  0.497149  0.334457  1
  Ni  Ni56  1  0.990140  0.774900  0.286693  1
  Ni  Ni57  1  0.990140  0.215278  0.381479  1
  Ni  Ni58  1  0.990140  0.607354  0.356771  1
  Ni  Ni59  1  0.990140  0.888236  0.310292  1
  Ni  Ni60  1  0.990140  0.324162  0.405462  1
  Ni  Ni61  1  0.990140  0.526653  0.287406  1
  Ni  Ni62  1  0.990140  0.964886  0.381609  1
  Ni  Ni63  1  0.990140  0.246780  0.334204  1
  Ni  Ni64  1  0.490140  0.574049  0.320241  1
  Ni  Ni65  1  0.490140  1.010429  0.415869  1
  Ni  Ni66  1  0.490140  0.291529  0.368341  1
  Ni  Ni67  1  0.490140  0.419988  0.347343  1
  Ni  Ni68  1  0.490140  0.703100  0.299776  1
  Ni  Ni69  1  0.490140  0.138908  0.394118  1
  Ni  Ni70  1  0.990140  0.274900  0.286693  1
  Ni  Ni71  1  0.990140  0.715278  0.381479  1
  Ni  Ni72  1  0.990140  0.997149  0.334457  1
  Ni  Ni73  1  0.990140  0.388236  0.310292  1
  Ni  Ni74  1  0.990140  0.824162  0.405462  1
  Ni  Ni75  1  0.990140  0.107354  0.356771  1
  Ni  Ni76  1  0.990140  0.464886  0.381609  1
  Ni  Ni77  1  0.990140  0.746780  0.334204  1
  Ni  Ni78  1  0.990140  0.026653  0.287406  1
  Ni  Ni79  1  0.490140  0.510429  0.415869  1
  Ni  Ni80  1  0.490140  0.791529  0.368341  1
  Ni  Ni81  1  0.490140  0.074049  0.320241  1
  Ni  Ni82  1  0.490140  0.638908  0.394118  1
  Ni  Ni83  1  0.490140  0.919988  0.347343  1
  Ni  Ni84  1  0.490140  0.203100  0.299776  1
  Ni  Ni85  1  0.990140  0.652191  0.476624  1
  Ni  Ni86  1  0.990140  0.933555  0.429168  1
  Ni  Ni87  1  0.990140  0.370390  0.524498  1
  Ni  Ni88  1  -0.009860  0.761128  0.500669  1
  Ni  Ni89  1  0.990140  0.043327  0.452511  1
  Ni  Ni90  1  0.990140  0.480195  0.547891  1
  Ni  Ni91  1  0.990140  0.683539  0.428983  1
  Ni  Ni92  1  0.990140  0.120689  0.524268  1
  Ni  Ni93  1  0.990140  0.401900  0.476784  1
  Ni  Ni94  1  0.490140  0.728305  0.463821  1
  Ni  Ni95  1  0.490140  0.165283  0.559166  1
  Ni  Ni96  1  0.490140  0.447136  0.511286  1
  Ni  Ni97  1  0.490140  0.575958  0.489376  1
  Ni  Ni98  1  0.490140  0.856825  0.442177  1
  Ni  Ni99  1  0.490140  0.293882  0.537453  1
  Ni  Ni100  1  0.990140  0.433555  0.429168  1
  Ni  Ni101  1  0.990140  0.870390  0.524498  1
  Ni  Ni102  1  0.990140  0.152191  0.476624  1
  Ni  Ni103  1  0.990140  0.543327  0.452511  1
  Ni  Ni104  1  0.990140  0.980195  0.547891  1
  Ni  Ni105  1  -0.009860  0.261128  0.500669  1
  Ni  Ni106  1  0.990140  0.620689  0.524268  1
  Ni  Ni107  1  0.990140  0.901900  0.476784  1
  Ni  Ni108  1  0.990140  0.183539  0.428983  1
  Ni  Ni109  1  0.490140  0.665283  0.559166  1
  Ni  Ni110  1  0.490140  0.947136  0.511286  1
  Ni  Ni111  1  0.490140  0.228305  0.463821  1
  Ni  Ni112  1  0.490140  0.793882  0.537453  1
  Ni  Ni113  1  0.490140  0.075958  0.489376  1
  Ni  Ni114  1  0.490140  0.356825  0.442177  1
  Ni  Ni115  1  0.990140  0.806160  0.620229  1
  Ni  Ni116  1  0.990140  0.089083  0.571970  1
  Ni  Ni117  1  0.990140  0.523979  0.668132  1
  Ni  Ni118  1  0.990140  0.916004  0.643248  1
  Ni  Ni119  1  0.990140  0.197953  0.595887  1
  Ni  Ni120  1  0.990140  0.635506  0.690870  1
  Ni  Ni121  1  0.990140  0.838870  0.572284  1
  Ni  Ni122  1  0.990140  0.279147  0.669249  1
  Ni  Ni123  1  0.990140  0.558648  0.620008  1
  Ni  Ni124  1  0.490140  0.883947  0.606423  1
  Ni  Ni125  1  0.490140  0.323189  0.700223  1
  Ni  Ni126  1  0.490140  0.601665  0.654328  1
  Ni  Ni127  1  0.490140  0.730437  0.632680  1
  Ni  Ni128  1  0.490140  1.013159  0.584422  1
  Ni  Ni129  1  0.490140  0.447607  0.676953  1
  Ni  Ni130  1  0.990140  0.589083  0.571970  1
  Ni  Ni131  1  0.990140  0.023979  0.668132  1
  Ni  Ni132  1  0.990140  0.306160  0.620229  1
  Ni  Ni133  1  0.990140  0.697953  0.595887  1
  Ni  Ni134  1  0.990140  0.135506  0.690870  1
  Ni  Ni135  1  0.990140  0.416004  0.643248  1
  Ni  Ni136  1  0.990140  0.779147  0.669249  1
  Ni  Ni137  1  0.990140  0.058648  0.620008  1
  Ni  Ni138  1  0.990140  0.338870  0.572284  1
  Ni  Ni139  1  0.490140  0.823189  0.700223  1
  Ni  Ni140  1  0.490140  0.101665  0.654328  1
  Ni  Ni141  1  0.490140  0.383947  0.606423  1
  Ni  Ni142  1  0.490140  0.947607  0.676953  1
  Ni  Ni143  1  0.490140  0.230437  0.632680  1
  Ni  Ni144  1  0.490140  0.513159  0.584422  1
