# generated using pymatgen
data_Al3Ni2
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   6.85873539
_cell_length_b   6.28488961
_cell_length_c   46.26825671
_cell_angle_alpha   90.00000000
_cell_angle_beta   90.00000000
_cell_angle_gamma   123.09493858
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Al3Ni2
_chemical_formula_sum   'Al33 Ni22'
_cell_volume   1670.89078987
_cell_formula_units_Z   11
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  0.287952  0.540164  0.298527  1
  Al  Al2  1  0.658610  0.065187  0.289935  1
  Al  Al3  1  0.746540  0.744780  0.318050  1
  Al  Al4  1  0.662308  0.302293  0.339715  1
  Al  Al5  1  0.209561  0.996106  0.320462  1
  Al  Al6  1  0.129418  0.596432  0.352808  1
  Al  Al7  1  0.068225  0.130718  0.375851  1
  Al  Al8  1  0.595075  0.860530  0.363170  1
  Al  Al9  1  0.564138  0.459187  0.391539  1
  Al  Al10  1  0.509848  0.015183  0.418165  1
  Al  Al11  1  0.026931  0.711818  0.404636  1
  Al  Al12  1  0.995504  0.314005  0.432134  1
  Al  Al13  1  0.940291  0.874584  0.457894  1
  Al  Al14  1  0.457646  0.572662  0.443843  1
  Al  Al15  1  0.420858  0.174248  0.471751  1
  Al  Al16  1  0.368409  0.732045  0.497958  1
  Al  Al17  1  0.884678  0.431091  0.483991  1
  Al  Al18  1  0.852139  0.032999  0.511924  1
  Al  Al19  1  0.796526  0.589506  0.538021  1
  Al  Al20  1  0.315960  0.289842  0.524164  1
  Al  Al21  1  0.279172  0.891428  0.552072  1
  Al  Al22  1  0.226970  0.448907  0.577750  1
  Al  Al23  1  0.741313  0.150085  0.563781  1
  Al  Al24  1  0.709886  0.752272  0.591279  1
  Al  Al25  1  0.668592  0.333372  0.620064  1
  Al  Al26  1  0.172680  0.004903  0.604376  1
  Al  Al27  1  0.141742  0.603560  0.632745  1
  Al  Al28  1  0.074509  0.161797  0.656200  1
  Al  Al29  1  0.607400  0.867658  0.643107  1
  Al  Al30  1  0.527256  0.467985  0.675453  1
  Al  Al31  1  0.448865  0.923926  0.697388  1
  Al  Al32  1  0.990277  0.719310  0.677865  1
  Al  Al33  1  0.078207  0.398904  0.705980  1
  Ni  Ni34  1  0.944906  0.544438  0.302304  1
  Ni  Ni35  1  0.510755  0.343246  0.292198  1
  Ni  Ni36  1  0.382605  0.422856  0.344285  1
  Ni  Ni37  1  0.949134  0.186213  0.329564  1
  Ni  Ni38  1  0.816437  0.284252  0.384969  1
  Ni  Ni39  1  0.350515  0.025988  0.372098  1
  Ni  Ni40  1  0.240581  0.145413  0.423238  1
  Ni  Ni41  1  0.777801  0.884557  0.411836  1
  Ni  Ni42  1  0.670446  0.003174  0.464053  1
  Ni  Ni43  1  0.208260  0.743011  0.452132  1
  Ni  Ni44  1  0.099696  0.861937  0.504007  1
  Ni  Ni45  1  0.637121  0.602153  0.491908  1
  Ni  Ni46  1  0.528558  0.721079  0.543783  1
  Ni  Ni47  1  0.066371  0.460916  0.531862  1
  Ni  Ni48  1  0.959016  0.579533  0.584079  1
  Ni  Ni49  1  0.496236  0.318678  0.572677  1
  Ni  Ni50  1  0.386303  0.438102  0.623817  1
  Ni  Ni51  1  0.920381  0.179839  0.610946  1
  Ni  Ni52  1  0.787683  0.277878  0.666351  1
  Ni  Ni53  1  0.354212  0.041234  0.651630  1
  Ni  Ni54  1  0.226063  0.120844  0.703717  1
  Ni  Ni55  1  0.791911  0.919653  0.693611  1
