# generated using pymatgen
data_Al3Ni2
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   3.97858710
_cell_length_b   6.31644598
_cell_length_c   48.44097496
_cell_angle_alpha   90.00000000
_cell_angle_beta   90.00000000
_cell_angle_gamma   108.38512622
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Al3Ni2
_chemical_formula_sum   'Al24 Ni16'
_cell_volume   1155.21145525
_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  0.958145  0.482309  0.269983  1
  Al  Al2  1  0.618966  0.803906  0.328644  1
  Al  Al3  1  0.631514  0.828314  0.272796  1
  Al  Al4  1  0.286527  0.139008  0.327236  1
  Al  Al5  1  0.956955  0.479729  0.386558  1
  Al  Al6  1  0.960849  0.487800  0.329015  1
  Al  Al7  1  0.627767  0.821446  0.387349  1
  Al  Al8  1  0.291399  0.148576  0.445334  1
  Al  Al9  1  0.296448  0.158828  0.387142  1
  Al  Al10  1  0.960651  0.487125  0.446152  1
  Al  Al11  1  0.624909  0.815529  0.504741  1
  Al  Al12  1  0.629710  0.825301  0.446861  1
  Al  Al13  1  0.294104  0.153968  0.505199  1
  Al  Al14  1  0.959176  0.483998  0.563682  1
  Al  Al15  1  0.963569  0.492951  0.505828  1
  Al  Al16  1  0.628689  0.823072  0.564530  1
  Al  Al17  1  0.292396  0.150350  0.622916  1
  Al  Al18  1  0.297620  0.160984  0.564976  1
  Al  Al19  1  0.960971  0.487590  0.623242  1
  Al  Al20  1  0.629892  0.825350  0.682035  1
  Al  Al21  1  0.630215  0.826101  0.624523  1
  Al  Al22  1  0.290682  0.146843  0.681713  1
  Al  Al23  1  0.458300  0.482339  0.721558  1
  Al  Al24  1  0.968243  0.502171  0.681091  1
  Ni  Ni25  1  0.446650  0.459377  0.298136  1
  Ni  Ni26  1  0.800408  0.166734  0.300170  1
  Ni  Ni27  1  0.786391  0.138726  0.355967  1
  Ni  Ni28  1  0.131096  0.828117  0.358923  1
  Ni  Ni29  1  0.120944  0.807807  0.415615  1
  Ni  Ni30  1  0.466574  0.498955  0.417532  1
  Ni  Ni31  1  0.454313  0.474459  0.474711  1
  Ni  Ni32  1  0.800271  0.166295  0.476637  1
  Ni  Ni33  1  0.788434  0.142634  0.533819  1
  Ni  Ni34  1  0.134247  0.834182  0.535849  1
  Ni  Ni35  1  0.122123  0.809944  0.593086  1
  Ni  Ni36  1  0.468026  0.501685  0.594839  1
  Ni  Ni37  1  0.455151  0.475995  0.652412  1
  Ni  Ni38  1  0.801662  0.168802  0.653978  1
  Ni  Ni39  1  0.800897  0.167260  0.709956  1
  Ni  Ni40  1  0.128733  0.823002  0.712490  1
