# generated using pymatgen
data_Al3Ni2
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   3.91024442
_cell_length_b   6.31938058
_cell_length_c   49.66326788
_cell_angle_alpha   90.00000000
_cell_angle_beta   90.00000000
_cell_angle_gamma   108.27465824
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Al3Ni2
_chemical_formula_sum   'Al24 Ni16'
_cell_volume   1165.3008698
_cell_formula_units_Z   8
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  0.969645  0.535663  0.258151  1
  Al  Al2  1  0.618466  0.837002  0.315812  1
  Al  Al3  1  0.638125  0.863425  0.263712  1
  Al  Al4  1  0.282377  0.165182  0.315100  1
  Al  Al5  1  0.954220  0.507826  0.374292  1
  Al  Al6  1  0.963977  0.526808  0.319367  1
  Al  Al7  1  0.629591  0.859000  0.376398  1
  Al  Al8  1  0.290445  0.179966  0.433165  1
  Al  Al9  1  0.299687  0.199588  0.377505  1
  Al  Al10  1  0.961952  0.523351  0.435079  1
  Al  Al11  1  0.624981  0.848645  0.492350  1
  Al  Al12  1  0.633910  0.867716  0.437008  1
  Al  Al13  1  0.296761  0.192651  0.494182  1
  Al  Al14  1  0.959735  0.517862  0.551492  1
  Al  Al15  1  0.968695  0.536904  0.496060  1
  Al  Al16  1  0.631548  0.861817  0.553283  1
  Al  Al17  1  0.294477  0.187142  0.610307  1
  Al  Al18  1  0.303700  0.206594  0.555099  1
  Al  Al19  1  0.968592  0.535656  0.612715  1
  Al  Al20  1  0.632139  0.863069  0.669950  1
  Al  Al21  1  0.637319  0.873350  0.614553  1
  Al  Al22  1  0.288623  0.175780  0.670601  1
  Al  Al23  1  0.458120  0.513343  0.709750  1
  Al  Al24  1  0.977122  0.552553  0.671437  1
  Ni  Ni25  1  0.448666  0.495151  0.287751  1
  Ni  Ni26  1  0.804072  0.208797  0.287535  1
  Ni  Ni27  1  0.787702  0.175329  0.345391  1
  Ni  Ni28  1  0.130741  0.861621  0.347588  1
  Ni  Ni29  1  0.122473  0.844613  0.405073  1
  Ni  Ni30  1  0.467171  0.533966  0.406021  1
  Ni  Ni31  1  0.457255  0.513764  0.464113  1
  Ni  Ni32  1  0.801643  0.202615  0.465176  1
  Ni  Ni33  1  0.792065  0.183063  0.523204  1
  Ni  Ni34  1  0.136415  0.871755  0.524290  1
  Ni  Ni35  1  0.127129  0.852745  0.582249  1
  Ni  Ni36  1  0.471190  0.541073  0.583451  1
  Ni  Ni37  1  0.459114  0.516575  0.641664  1
  Ni  Ni38  1  0.807013  0.212467  0.641992  1
  Ni  Ni39  1  0.802334  0.202950  0.699856  1
  Ni  Ni40  1  0.136098  0.871373  0.702503  1
