# generated using pymatgen
data_Al3Ni5
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   6.97177715
_cell_length_b   3.62340286
_cell_length_c   51.69847965
_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   'Al18 Ni30'
_cell_volume   1305.98410525
_cell_formula_units_Z   6
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  0.504262  0.504240  0.371165  1
  Al  Al2  1  0.504262  1.004240  0.334675  1
  Al  Al3  1  0.504262  1.004240  0.408823  1
  Al  Al4  1  0.004262  0.504240  0.295622  1
  Al  Al5  1  0.004262  1.004240  0.404892  1
  Al  Al6  1  0.004262  1.004240  0.337160  1
  Al  Al7  1  0.504262  0.504240  0.514138  1
  Al  Al8  1  0.504262  1.004240  0.476369  1
  Al  Al9  1  0.504262  1.004240  0.551911  1
  Al  Al10  1  0.004262  0.504240  0.442634  1
  Al  Al11  1  0.004262  1.004240  0.547872  1
  Al  Al12  1  0.004262  1.004240  0.480382  1
  Al  Al13  1  0.504262  0.504240  0.656366  1
  Al  Al14  1  0.504262  1.004240  0.619268  1
  Al  Al15  1  0.504262  1.004240  0.697657  1
  Al  Al16  1  0.004262  0.504240  0.585643  1
  Al  Al17  1  0.004262  1.004240  0.693211  1
  Al  Al18  1  0.004262  1.004240  0.623505  1
  Ni  Ni19  1  0.004262  0.504240  0.371083  1
  Ni  Ni20  1  0.250598  0.504240  0.335355  1
  Ni  Ni21  1  0.254129  0.504240  0.406863  1
  Ni  Ni22  1  0.750501  1.004240  0.371034  1
  Ni  Ni23  1  0.258023  1.004240  0.371034  1
  Ni  Ni24  1  0.504262  0.504240  0.301428  1
  Ni  Ni25  1  0.754396  0.504240  0.406863  1
  Ni  Ni26  1  0.757927  0.504240  0.335355  1
  Ni  Ni27  1  0.255802  1.004240  0.301840  1
  Ni  Ni28  1  0.752722  1.004240  0.301840  1
  Ni  Ni29  1  0.004262  0.504240  0.514130  1
  Ni  Ni30  1  0.254299  0.504240  0.478376  1
  Ni  Ni31  1  0.254262  0.504240  0.549889  1
  Ni  Ni32  1  0.749136  1.004240  0.514132  1
  Ni  Ni33  1  0.259389  1.004240  0.514132  1
  Ni  Ni34  1  0.504262  0.504240  0.442608  1
  Ni  Ni35  1  0.754263  0.504240  0.549889  1
  Ni  Ni36  1  0.754225  0.504240  0.478376  1
  Ni  Ni37  1  0.249252  1.004240  0.442617  1
  Ni  Ni38  1  0.759272  1.004240  0.442617  1
  Ni  Ni39  1  0.004262  0.504240  0.657108  1
  Ni  Ni40  1  0.253252  0.504240  0.621453  1
  Ni  Ni41  1  0.254595  0.504240  0.690034  1
  Ni  Ni42  1  0.749724  1.004240  0.657211  1
  Ni  Ni43  1  0.258801  1.004240  0.657211  1
  Ni  Ni44  1  0.504262  0.504240  0.585660  1
  Ni  Ni45  1  0.753930  0.504240  0.690034  1
  Ni  Ni46  1  0.755273  0.504240  0.621453  1
  Ni  Ni47  1  0.248842  1.004240  0.585641  1
  Ni  Ni48  1  0.759683  1.004240  0.585641  1
