# generated using pymatgen
data_Al3Ni5
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   7.46255896
_cell_length_b   3.74223410
_cell_length_c   51.10640198
_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   'Al24 Ni40'
_cell_volume   1427.23022232
_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  0.505057  0.004833  0.254818  1
  Al  Al2  1  0.783701  0.504833  0.256772  1
  Al  Al3  1  0.226414  0.504833  0.256772  1
  Al  Al4  1  1.005057  0.004833  0.319431  1
  Al  Al5  1  0.277834  0.504833  0.319398  1
  Al  Al6  1  0.732281  0.504833  0.319398  1
  Al  Al7  1  0.505057  0.004833  0.381830  1
  Al  Al8  1  0.777088  0.504833  0.381811  1
  Al  Al9  1  0.233026  0.504833  0.381811  1
  Al  Al10  1  1.005057  0.004833  0.444297  1
  Al  Al11  1  0.276964  0.504833  0.444289  1
  Al  Al12  1  0.733151  0.504833  0.444289  1
  Al  Al13  1  0.505057  0.004833  0.506768  1
  Al  Al14  1  0.776952  0.504833  0.506769  1
  Al  Al15  1  0.233163  0.504833  0.506769  1
  Al  Al16  1  1.005057  0.004833  0.569237  1
  Al  Al17  1  0.277005  0.504833  0.569250  1
  Al  Al18  1  0.733109  0.504833  0.569250  1
  Al  Al19  1  0.505057  0.004833  0.631720  1
  Al  Al20  1  0.777064  0.504833  0.631733  1
  Al  Al21  1  0.233051  0.504833  0.631733  1
  Al  Al22  1  1.005057  0.004833  0.693909  1
  Al  Al23  1  0.277544  0.504833  0.693741  1
  Al  Al24  1  0.732570  0.504833  0.693741  1
  Ni  Ni25  1  0.505057  0.004833  0.319466  1
  Ni  Ni26  1  0.255154  0.004833  0.350598  1
  Ni  Ni27  1  0.754961  0.004833  0.350598  1
  Ni  Ni28  1  0.505057  0.504833  0.353055  1
  Ni  Ni29  1  0.505057  0.504833  0.285556  1
  Ni  Ni30  1  1.005057  0.004833  0.257099  1
  Ni  Ni31  1  0.752418  0.004833  0.288295  1
  Ni  Ni32  1  0.257697  0.004833  0.288295  1
  Ni  Ni33  1  1.005057  0.504833  0.291303  1
  Ni  Ni34  1  1.005057  0.504833  0.348117  1
  Ni  Ni35  1  0.505057  0.004833  0.444284  1
  Ni  Ni36  1  0.255068  0.004833  0.475530  1
  Ni  Ni37  1  0.755047  0.004833  0.475530  1
  Ni  Ni38  1  0.505057  0.504833  0.477942  1
  Ni  Ni39  1  0.505057  0.504833  0.410634  1
  Ni  Ni40  1  1.005057  0.004833  0.381792  1
  Ni  Ni41  1  0.755112  0.004833  0.413050  1
  Ni  Ni42  1  0.255003  0.004833  0.413050  1
  Ni  Ni43  1  1.005057  0.504833  0.415473  1
  Ni  Ni44  1  1.005057  0.504833  0.473118  1
  Ni  Ni45  1  0.505057  0.004833  0.569257  1
  Ni  Ni46  1  0.255025  0.004833  0.600490  1
  Ni  Ni47  1  0.755090  0.004833  0.600490  1
  Ni  Ni48  1  0.505057  0.504833  0.602920  1
  Ni  Ni49  1  0.505057  0.504833  0.535595  1
  Ni  Ni50  1  1.005057  0.004833  0.506771  1
  Ni  Ni51  1  0.755032  0.004833  0.538008  1
  Ni  Ni52  1  0.255082  0.004833  0.538008  1
  Ni  Ni53  1  1.005057  0.504833  0.540421  1
  Ni  Ni54  1  1.005057  0.504833  0.598051  1
  Ni  Ni55  1  0.505057  0.004833  0.694146  1
  Ni  Ni56  1  0.254861  0.004833  0.726197  1
  Ni  Ni57  1  0.755254  0.004833  0.726197  1
  Ni  Ni58  1  0.505057  0.504833  0.728076  1
  Ni  Ni59  1  0.505057  0.504833  0.660307  1
  Ni  Ni60  1  1.005057  0.004833  0.631716  1
  Ni  Ni61  1  0.755000  0.004833  0.662865  1
  Ni  Ni62  1  0.255115  0.004833  0.662865  1
  Ni  Ni63  1  1.005057  0.504833  0.665319  1
  Ni  Ni64  1  1.005057  0.504833  0.724056  1
