# generated using pymatgen
data_Al3Ni5
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   5.86151944
_cell_length_b   7.75639054
_cell_length_c   50.51363615
_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   'Al36 Ni60'
_cell_volume   2296.56377029
_cell_formula_units_Z   12
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  1.035298  0.485925  0.270816  1
  Al  Al2  1  1.035298  0.758308  0.313970  1
  Al  Al3  1  1.035298  0.213541  0.313970  1
  Al  Al4  1  0.535298  -0.014075  0.270816  1
  Al  Al5  1  0.535298  0.258308  0.313970  1
  Al  Al6  1  0.535298  0.713541  0.313970  1
  Al  Al7  1  1.035298  0.485925  0.351554  1
  Al  Al8  1  1.035298  0.756410  0.390145  1
  Al  Al9  1  1.035298  0.215439  0.390145  1
  Al  Al10  1  0.535298  -0.014075  0.351554  1
  Al  Al11  1  0.535298  0.256410  0.390145  1
  Al  Al12  1  0.535298  0.715439  0.390145  1
  Al  Al13  1  1.035298  0.485925  0.428502  1
  Al  Al14  1  1.035298  0.756382  0.467002  1
  Al  Al15  1  1.035298  0.215467  0.467002  1
  Al  Al16  1  0.535298  -0.014075  0.428502  1
  Al  Al17  1  0.535298  0.256382  0.467002  1
  Al  Al18  1  0.535298  0.715467  0.467002  1
  Al  Al19  1  1.035298  0.485925  0.505427  1
  Al  Al20  1  1.035298  0.756405  0.543898  1
  Al  Al21  1  1.035298  0.215444  0.543898  1
  Al  Al22  1  0.535298  -0.014075  0.505427  1
  Al  Al23  1  0.535298  0.256405  0.543898  1
  Al  Al24  1  0.535298  0.715444  0.543898  1
  Al  Al25  1  1.035298  0.485925  0.582384  1
  Al  Al26  1  1.035298  0.755619  0.620911  1
  Al  Al27  1  1.035298  0.216230  0.620911  1
  Al  Al28  1  0.535298  -0.014075  0.582384  1
  Al  Al29  1  0.535298  0.255619  0.620911  1
  Al  Al30  1  0.535298  0.716230  0.620911  1
  Al  Al31  1  1.035298  0.485925  0.658451  1
  Al  Al32  1  1.035298  0.758897  0.698242  1
  Al  Al33  1  1.035298  0.212952  0.698242  1
  Al  Al34  1  0.535298  -0.014075  0.658451  1
  Al  Al35  1  0.535298  0.258897  0.698242  1
  Al  Al36  1  0.535298  0.712952  0.698242  1
  Ni  Ni37  1  0.535298  0.485925  0.275450  1
  Ni  Ni38  1  0.785298  0.235925  0.275760  1
  Ni  Ni39  1  0.785298  0.735925  0.275760  1
  Ni  Ni40  1  0.813358  0.485925  0.312527  1
  Ni  Ni41  1  0.257238  0.485925  0.312527  1
  Ni  Ni42  1  1.035298  -0.014075  0.275450  1
  Ni  Ni43  1  0.285298  0.735925  0.275760  1
  Ni  Ni44  1  0.285298  0.235925  0.275760  1
  Ni  Ni45  1  0.313358  -0.014075  0.312527  1
  Ni  Ni46  1  0.757238  -0.014075  0.312527  1
  Ni  Ni47  1  0.535298  0.485925  0.351264  1
  Ni  Ni48  1  0.785298  0.235925  0.351895  1
  Ni  Ni49  1  0.785298  0.735925  0.351895  1
  Ni  Ni50  1  0.805041  0.485925  0.390014  1
  Ni  Ni51  1  0.265555  0.485925  0.390014  1
  Ni  Ni52  1  1.035298  -0.014075  0.351264  1
  Ni  Ni53  1  0.285298  0.735925  0.351895  1
  Ni  Ni54  1  0.285298  0.235925  0.351895  1
  Ni  Ni55  1  0.305041  -0.014075  0.390014  1
  Ni  Ni56  1  0.765555  -0.014075  0.390014  1
  Ni  Ni57  1  0.535298  0.485925  0.428512  1
  Ni  Ni58  1  0.785298  0.235925  0.428572  1
  Ni  Ni59  1  0.785298  0.735925  0.428572  1
  Ni  Ni60  1  0.805347  0.485925  0.466976  1
  Ni  Ni61  1  0.265249  0.485925  0.466976  1
  Ni  Ni62  1  1.035298  -0.014075  0.428512  1
  Ni  Ni63  1  0.285298  0.735925  0.428572  1
  Ni  Ni64  1  0.285298  0.235925  0.428572  1
  Ni  Ni65  1  0.305347  -0.014075  0.466976  1
  Ni  Ni66  1  0.765249  -0.014075  0.466976  1
  Ni  Ni67  1  0.535298  0.485925  0.505437  1
  Ni  Ni68  1  0.785298  0.235925  0.505450  1
  Ni  Ni69  1  0.785298  0.735925  0.505450  1
  Ni  Ni70  1  0.805555  0.485925  0.543884  1
  Ni  Ni71  1  0.265042  0.485925  0.543884  1
  Ni  Ni72  1  1.035298  -0.014075  0.505437  1
  Ni  Ni73  1  0.285298  0.735925  0.505450  1
  Ni  Ni74  1  0.285298  0.235925  0.505450  1
  Ni  Ni75  1  0.305555  -0.014075  0.543884  1
  Ni  Ni76  1  0.765042  -0.014075  0.543884  1
  Ni  Ni77  1  0.535298  0.485925  0.582247  1
  Ni  Ni78  1  0.785298  0.235925  0.582375  1
  Ni  Ni79  1  0.785298  0.735925  0.582375  1
  Ni  Ni80  1  0.803072  0.485925  0.620652  1
  Ni  Ni81  1  0.267525  0.485925  0.620652  1
  Ni  Ni82  1  1.035298  -0.014075  0.582247  1
  Ni  Ni83  1  0.285298  0.735925  0.582375  1
  Ni  Ni84  1  0.285298  0.235925  0.582375  1
  Ni  Ni85  1  0.303072  -0.014075  0.620652  1
  Ni  Ni86  1  0.767525  -0.014075  0.620652  1
  Ni  Ni87  1  0.535298  0.485925  0.659325  1
  Ni  Ni88  1  0.785298  0.235925  0.659373  1
  Ni  Ni89  1  0.785298  0.735925  0.659373  1
  Ni  Ni90  1  0.814525  0.485925  0.697426  1
  Ni  Ni91  1  0.256071  0.485925  0.697426  1
  Ni  Ni92  1  1.035298  -0.014075  0.659325  1
  Ni  Ni93  1  0.285298  0.735925  0.659373  1
  Ni  Ni94  1  0.285298  0.235925  0.659373  1
  Ni  Ni95  1  0.314525  -0.014075  0.697426  1
  Ni  Ni96  1  0.756071  -0.014075  0.697426  1
