# generated using pymatgen
data_AlNi
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   4.00631915
_cell_length_b   8.88538503
_cell_length_c   46.93561542
_cell_angle_alpha   90.00000000
_cell_angle_beta   90.00000000
_cell_angle_gamma   102.92096638
_symmetry_Int_Tables_number   1
_chemical_formula_structural   AlNi
_chemical_formula_sum   'Al33 Ni33'
_cell_volume   1628.49381779
_cell_formula_units_Z   33
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  0.124134  0.824443  0.277739  1
  Al  Al2  1  0.280798  0.138719  0.290952  1
  Al  Al3  1  0.434954  0.447454  0.306478  1
  Al  Al4  1  0.593991  0.765394  0.322412  1
  Al  Al5  1  0.751687  0.081229  0.336008  1
  Al  Al6  1  0.910111  0.398572  0.349013  1
  Al  Al7  1  0.066956  0.712682  0.362406  1
  Al  Al8  1  0.224496  0.028237  0.376564  1
  Al  Al9  1  0.381780  0.343304  0.390487  1
  Al  Al10  1  0.539111  0.658457  0.404552  1
  Al  Al11  1  0.696999  0.974718  0.418597  1
  Al  Al12  1  0.854628  0.290503  0.432396  1
  Al  Al13  1  0.011995  0.605756  0.446158  1
  Al  Al14  1  0.169430  0.921137  0.460015  1
  Al  Al15  1  0.326969  0.236732  0.473957  1
  Al  Al16  1  0.484480  0.552272  0.487864  1
  Al  Al17  1  0.642011  0.867846  0.501779  1
  Al  Al18  1  0.799520  0.183376  0.515714  1
  Al  Al19  1  0.957024  0.498904  0.529632  1
  Al  Al20  1  0.114437  0.814243  0.543455  1
  Al  Al21  1  0.271898  0.129682  0.557253  1
  Al  Al22  1  0.429539  0.445487  0.571030  1
  Al  Al23  1  0.587306  0.761506  0.585085  1
  Al  Al24  1  0.744745  0.076870  0.599216  1
  Al  Al25  1  0.902027  0.391932  0.613232  1
  Al  Al26  1  0.059164  0.706702  0.627204  1
  Al  Al27  1  0.216561  0.021969  0.640300  1
  Al  Al28  1  0.375084  0.339460  0.653773  1
  Al  Al29  1  0.532008  0.653786  0.667478  1
  Al  Al30  1  0.691022  0.972185  0.682769  1
  Al  Al31  1  0.844949  0.279752  0.699401  1
  Al  Al32  1  0.003106  0.596729  0.712411  1
  Al  Al33  1  0.166752  0.925496  0.724711  1
  Ni  Ni34  1  0.544491  0.664246  0.274908  1
  Ni  Ni35  1  0.699952  0.976623  0.288484  1
  Ni  Ni36  1  0.856835  0.290956  0.301407  1
  Ni  Ni37  1  0.015451  0.608082  0.313018  1
  Ni  Ni38  1  0.174349  0.926199  0.327493  1
  Ni  Ni39  1  0.330281  0.238635  0.341608  1
  Ni  Ni40  1  0.487308  0.553256  0.355886  1
  Ni  Ni41  1  0.645336  0.869757  0.370367  1
  Ni  Ni42  1  0.803406  0.186329  0.383985  1
  Ni  Ni43  1  0.960782  0.501535  0.397495  1
  Ni  Ni44  1  0.118155  0.816748  0.411269  1
  Ni  Ni45  1  0.275842  0.132652  0.425293  1
  Ni  Ni46  1  0.433170  0.447853  0.439235  1
  Ni  Ni47  1  0.590617  0.763268  0.453178  1
  Ni  Ni48  1  0.748235  0.079012  0.467111  1
  Ni  Ni49  1  0.905773  0.394604  0.480985  1
  Ni  Ni50  1  0.063227  0.710022  0.494814  1
  Ni  Ni51  1  0.220716  0.025507  0.508665  1
  Ni  Ni52  1  0.378259  0.341104  0.522534  1
  Ni  Ni53  1  0.535854  0.656806  0.536450  1
  Ni  Ni54  1  0.693303  0.972233  0.550436  1
  Ni  Ni55  1  0.850681  0.287532  0.564418  1
  Ni  Ni56  1  0.008240  0.603174  0.578377  1
  Ni  Ni57  1  0.165588  0.918327  0.592051  1
  Ni  Ni58  1  0.323405  0.234396  0.605632  1
  Ni  Ni59  1  0.481076  0.550189  0.619287  1
  Ni  Ni60  1  0.638737  0.866025  0.633809  1
  Ni  Ni61  1  0.796377  0.181862  0.648303  1
  Ni  Ni62  1  0.952035  0.493713  0.662553  1
  Ni  Ni63  1  0.110240  0.810562  0.675956  1
  Ni  Ni64  1  0.270588  0.131100  0.687769  1
  Ni  Ni65  1  0.426393  0.442945  0.701576  1
  Ni  Ni66  1  0.582183  0.755551  0.715225  1
