# generated using pymatgen
data_AlNi
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   4.00161094
_cell_length_b   6.29884602
_cell_length_c   47.29974865
_cell_angle_alpha   90.00000000
_cell_angle_beta   90.00000000
_cell_angle_gamma   108.43494882
_symmetry_Int_Tables_number   1
_chemical_formula_structural   AlNi
_chemical_formula_sum   'Al22 Ni22'
_cell_volume   1131.034731
_cell_formula_units_Z   22
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  0.664281  0.446552  0.292119  1
  Al  Al2  1  0.880103  0.878974  0.313086  1
  Al  Al3  1  0.102700  0.324366  0.334907  1
  Al  Al4  1  0.326451  0.772447  0.354092  1
  Al  Al5  1  0.546690  0.213502  0.373602  1
  Al  Al6  1  0.768390  0.657551  0.393818  1
  Al  Al7  1  0.990123  0.101659  0.413857  1
  Al  Al8  1  0.211916  0.545880  0.433960  1
  Al  Al9  1  0.433588  0.989877  0.453882  1
  Al  Al10  1  0.655174  0.433698  0.473852  1
  Al  Al11  1  0.876852  0.877706  0.493904  1
  Al  Al12  1  0.098503  0.321660  0.513938  1
  Al  Al13  1  0.320077  0.765457  0.533896  1
  Al  Al14  1  0.541772  0.209500  0.553814  1
  Al  Al15  1  0.763627  0.653844  0.573933  1
  Al  Al16  1  0.985316  0.097863  0.594070  1
  Al  Al17  1  0.206683  0.541266  0.614172  1
  Al  Al18  1  0.427509  0.983523  0.633534  1
  Al  Al19  1  0.650648  0.430388  0.653064  1
  Al  Al20  1  0.872956  0.875529  0.674480  1
  Al  Al21  1  0.088651  0.307038  0.696659  1
  Al  Al22  1  0.320534  0.771900  0.714873  1
  Ni  Ni23  1  0.050170  0.217617  0.286123  1
  Ni  Ni24  1  0.269955  0.658284  0.305147  1
  Ni  Ni25  1  0.493224  0.105093  0.322746  1
  Ni  Ni26  1  0.714426  0.548061  0.343698  1
  Ni  Ni27  1  0.935002  0.989895  0.363850  1
  Ni  Ni28  1  0.157868  0.436204  0.384139  1
  Ni  Ni29  1  0.379516  0.880119  0.403910  1
  Ni  Ni30  1  0.600978  0.323671  0.423774  1
  Ni  Ni31  1  0.822757  0.767888  0.443873  1
  Ni  Ni32  1  0.044306  0.211646  0.463909  1
  Ni  Ni33  1  0.266006  0.655690  0.483914  1
  Ni  Ni34  1  0.487683  0.099691  0.503867  1
  Ni  Ni35  1  0.709372  0.543714  0.523879  1
  Ni  Ni36  1  0.930956  0.987546  0.543949  1
  Ni  Ni37  1  0.152642  0.431577  0.564023  1
  Ni  Ni38  1  0.374164  0.875238  0.583834  1
  Ni  Ni39  1  0.595961  0.319448  0.603604  1
  Ni  Ni40  1  0.818286  0.764726  0.624020  1
  Ni  Ni41  1  0.039300  0.207454  0.644507  1
  Ni  Ni42  1  0.259272  0.648002  0.664532  1
  Ni  Ni43  1  0.485473  0.100564  0.682498  1
  Ni  Ni44  1  0.701976  0.534200  0.702218  1
