# generated using pymatgen
data_Al3Ni2
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   3.97890117
_cell_length_b   6.34482216
_cell_length_c   48.82482948
_cell_angle_alpha   90.00000000
_cell_angle_beta   90.00000000
_cell_angle_gamma   108.38467792
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Al3Ni2
_chemical_formula_sum   'Al24 Ni16'
_cell_volume   1169.69174737
_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  0.949549  0.508281  0.268458  1
  Al  Al2  1  0.596137  0.804843  0.325627  1
  Al  Al3  1  0.611484  0.827480  0.272271  1
  Al  Al4  1  0.259771  0.131993  0.324636  1
  Al  Al5  1  0.931260  0.474788  0.384238  1
  Al  Al6  1  0.940608  0.492457  0.327636  1
  Al  Al7  1  0.603736  0.819824  0.385346  1
  Al  Al8  1  0.265785  0.143867  0.443141  1
  Al  Al9  1  0.274676  0.161624  0.385736  1
  Al  Al10  1  0.936979  0.486276  0.444281  1
  Al  Al11  1  0.599513  0.811322  0.502376  1
  Al  Al12  1  0.607855  0.828077  0.445315  1
  Al  Al13  1  0.270545  0.153415  0.503375  1
  Al  Al14  1  0.933532  0.479375  0.561458  1
  Al  Al15  1  0.941683  0.495722  0.504425  1
  Al  Al16  1  0.604822  0.821966  0.562628  1
  Al  Al17  1  0.267000  0.146326  0.620624  1
  Al  Al18  1  0.275418  0.163184  0.563546  1
  Al  Al19  1  0.938851  0.490059  0.621817  1
  Al  Al20  1  0.606235  0.824421  0.679232  1
  Al  Al21  1  0.607304  0.826972  0.623424  1
  Al  Al22  1  0.260140  0.132753  0.679505  1
  Al  Al23  1  0.434360  0.480936  0.713292  1
  Al  Al24  1  0.948143  0.508548  0.678515  1
  Ni  Ni25  1  0.426790  0.463965  0.296974  1
  Ni  Ni26  1  0.779358  0.171240  0.297071  1
  Ni  Ni27  1  0.764325  0.140843  0.354621  1
  Ni  Ni28  1  0.106539  0.825537  0.356750  1
  Ni  Ni29  1  0.098542  0.809381  0.413919  1
  Ni  Ni30  1  0.441286  0.494931  0.415444  1
  Ni  Ni31  1  0.432169  0.476613  0.473079  1
  Ni  Ni32  1  0.775218  0.162810  0.474552  1
  Ni  Ni33  1  0.766055  0.144385  0.532209  1
  Ni  Ni34  1  0.109040  0.830453  0.533712  1
  Ni  Ni35  1  0.099755  0.811781  0.591515  1
  Ni  Ni36  1  0.442798  0.497997  0.592786  1
  Ni  Ni37  1  0.431297  0.474911  0.651208  1
  Ni  Ni38  1  0.777390  0.167171  0.651489  1
  Ni  Ni39  1  0.779460  0.171588  0.708590  1
  Ni  Ni40  1  0.100311  0.812226  0.711302  1
