# generated using pymatgen
data_Al4Ni3
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   11.40007417
_cell_length_b   11.40007417
_cell_length_c   11.40007417
_cell_angle_alpha   90.00000000
_cell_angle_beta   90.00000000
_cell_angle_gamma   90.00000000
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Al4Ni3
_chemical_formula_sum   'Al64 Ni48'
_cell_volume   1481.57291759
_cell_formula_units_Z   16
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  Al0  1  0.25000000  0.75000000  0.75000000  1
  Al  Al1  1  0.00000000  0.00000000  0.50000000  1
  Al  Al2  1  0.50000000  0.00000000  0.00000000  1
  Al  Al3  1  0.50000000  0.50000000  0.50000000  1
  Al  Al4  1  0.25000000  0.25000000  0.75000000  1
  Al  Al5  1  0.75000000  0.75000000  0.75000000  1
  Al  Al6  1  0.25000000  0.75000000  0.25000000  1
  Al  Al7  1  0.50000000  0.00000000  0.50000000  1
  Al  Al8  1  0.25000000  0.75892100  0.50000000  1
  Al  Al9  1  0.00892100  0.00000000  0.25000000  1
  Al  Al10  1  0.49107900  0.00000000  0.75000000  1
  Al  Al11  1  0.50000000  0.75000000  0.50892100  1
  Al  Al12  1  0.50000000  0.25000000  0.99107900  1
  Al  Al13  1  0.75000000  0.50892100  0.50000000  1
  Al  Al14  1  0.50000000  0.25000000  0.75892100  1
  Al  Al15  1  0.24107900  0.00000000  0.25000000  1
  Al  Al16  1  0.50000000  0.75000000  0.74107900  1
  Al  Al17  1  0.25892100  0.00000000  0.75000000  1
  Al  Al18  1  0.75000000  0.74107900  0.50000000  1
  Al  Al19  1  0.25000000  0.99107900  0.50000000  1
  Al  Al20  1  0.75000000  0.24107900  0.50000000  1
  Al  Al21  1  0.99107900  0.00000000  0.75000000  1
  Al  Al22  1  0.50892100  0.00000000  0.25000000  1
  Al  Al23  1  0.50000000  0.25000000  0.49107900  1
  Al  Al24  1  0.50000000  0.75000000  0.00892100  1
  Al  Al25  1  0.25000000  0.49107900  0.50000000  1
  Al  Al26  1  0.50000000  0.75000000  0.24107900  1
  Al  Al27  1  0.75892100  0.00000000  0.75000000  1
  Al  Al28  1  0.50000000  0.25000000  0.25892100  1
  Al  Al29  1  0.74107900  0.00000000  0.25000000  1
  Al  Al30  1  0.25000000  0.25892100  0.50000000  1
  Al  Al31  1  0.75000000  0.00892100  0.50000000  1
  Al  Al32  1  0.75000000  0.25000000  0.25000000  1
  Al  Al33  1  0.50000000  0.50000000  0.00000000  1
  Al  Al34  1  0.00000000  0.50000000  0.50000000  1
  Al  Al35  1  0.00000000  0.00000000  0.00000000  1
  Al  Al36  1  0.75000000  0.75000000  0.25000000  1
  Al  Al37  1  0.25000000  0.25000000  0.25000000  1
  Al  Al38  1  0.75000000  0.25000000  0.75000000  1
  Al  Al39  1  0.00000000  0.50000000  0.00000000  1
  Al  Al40  1  0.75000000  0.25892100  0.00000000  1
  Al  Al41  1  0.50892100  0.50000000  0.75000000  1
  Al  Al42  1  0.99107900  0.50000000  0.25000000  1
  Al  Al43  1  0.00000000  0.25000000  0.00892100  1
  Al  Al44  1  0.00000000  0.75000000  0.49107900  1
  Al  Al45  1  0.25000000  0.00892100  0.00000000  1
  Al  Al46  1  0.00000000  0.75000000  0.25892100  1
  Al  Al47  1  0.74107900  0.50000000  0.75000000  1
  Al  Al48  1  0.00000000  0.25000000  0.24107900  1
  Al  Al49  1  0.75892100  0.50000000  0.25000000  1
  Al  Al50  1  0.25000000  0.24107900  0.00000000  1
  Al  Al51  1  0.75000000  0.49107900  0.00000000  1
  Al  Al52  1  0.25000000  0.74107900  0.00000000  1
  Al  Al53  1  0.49107900  0.50000000  0.25000000  1
  Al  Al54  1  0.00892100  0.50000000  0.75000000  1
  Al  Al55  1  0.00000000  0.75000000  0.99107900  1
  Al  Al56  1  0.00000000  0.25000000  0.50892100  1
  Al  Al57  1  0.75000000  0.99107900  0.00000000  1
  Al  Al58  1  0.00000000  0.25000000  0.74107900  1
  Al  Al59  1  0.25892100  0.50000000  0.25000000  1
  Al  Al60  1  0.00000000  0.75000000  0.75892100  1
  Al  Al61  1  0.24107900  0.50000000  0.75000000  1
  Al  Al62  1  0.75000000  0.75892100  0.00000000  1
  Al  Al63  1  0.25000000  0.50892100  0.00000000  1
  Ni  Ni64  1  0.38130700  0.37500000  0.63130700  1
  Ni  Ni65  1  0.62500000  0.86869300  0.38130700  1
  Ni  Ni66  1  0.37500000  0.63130700  0.38130700  1
  Ni  Ni67  1  0.13130700  0.11869300  0.62500000  1
  Ni  Ni68  1  0.63130700  0.38130700  0.37500000  1
  Ni  Ni69  1  0.88130700  0.12500000  0.36869300  1
  Ni  Ni70  1  0.61869300  0.12500000  0.63130700  1
  Ni  Ni71  1  0.36869300  0.11869300  0.37500000  1
  Ni  Ni72  1  0.62500000  0.13130700  0.11869300  1
  Ni  Ni73  1  0.87500000  0.86869300  0.61869300  1
  Ni  Ni74  1  0.36869300  0.88130700  0.12500000  1
  Ni  Ni75  1  0.61869300  0.87500000  0.86869300  1
  Ni  Ni76  1  0.61869300  0.62500000  0.36869300  1
  Ni  Ni77  1  0.37500000  0.13130700  0.61869300  1
  Ni  Ni78  1  0.62500000  0.36869300  0.61869300  1
  Ni  Ni79  1  0.86869300  0.88130700  0.37500000  1
  Ni  Ni80  1  0.36869300  0.61869300  0.62500000  1
  Ni  Ni81  1  0.11869300  0.87500000  0.63130700  1
  Ni  Ni82  1  0.38130700  0.87500000  0.36869300  1
  Ni  Ni83  1  0.63130700  0.88130700  0.62500000  1
  Ni  Ni84  1  0.37500000  0.86869300  0.88130700  1
  Ni  Ni85  1  0.12500000  0.13130700  0.38130700  1
  Ni  Ni86  1  0.63130700  0.11869300  0.87500000  1
  Ni  Ni87  1  0.38130700  0.12500000  0.13130700  1
  Ni  Ni88  1  0.88130700  0.87500000  0.13130700  1
  Ni  Ni89  1  0.12500000  0.36869300  0.88130700  1
  Ni  Ni90  1  0.87500000  0.13130700  0.88130700  1
  Ni  Ni91  1  0.63130700  0.61869300  0.12500000  1
  Ni  Ni92  1  0.13130700  0.88130700  0.87500000  1
  Ni  Ni93  1  0.38130700  0.62500000  0.86869300  1
  Ni  Ni94  1  0.11869300  0.62500000  0.13130700  1
  Ni  Ni95  1  0.86869300  0.61869300  0.87500000  1
  Ni  Ni96  1  0.12500000  0.63130700  0.61869300  1
  Ni  Ni97  1  0.37500000  0.36869300  0.11869300  1
  Ni  Ni98  1  0.86869300  0.38130700  0.62500000  1
  Ni  Ni99  1  0.11869300  0.37500000  0.36869300  1
  Ni  Ni100  1  0.11869300  0.12500000  0.86869300  1
  Ni  Ni101  1  0.87500000  0.63130700  0.11869300  1
  Ni  Ni102  1  0.12500000  0.86869300  0.11869300  1
  Ni  Ni103  1  0.36869300  0.38130700  0.87500000  1
  Ni  Ni104  1  0.86869300  0.11869300  0.12500000  1
  Ni  Ni105  1  0.61869300  0.37500000  0.13130700  1
  Ni  Ni106  1  0.88130700  0.37500000  0.86869300  1
  Ni  Ni107  1  0.13130700  0.38130700  0.12500000  1
  Ni  Ni108  1  0.87500000  0.36869300  0.38130700  1
  Ni  Ni109  1  0.62500000  0.63130700  0.88130700  1
  Ni  Ni110  1  0.13130700  0.61869300  0.37500000  1
  Ni  Ni111  1  0.88130700  0.62500000  0.63130700  1
