# generated using pymatgen
data_Nb3AlFe8
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   4.74045878
_cell_length_b   4.74299200
_cell_length_c   7.89296334
_cell_angle_alpha   90.00000000
_cell_angle_beta   90.02952554
_cell_angle_gamma   59.98232116
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Nb3AlFe8
_chemical_formula_sum   'Nb3 Al1 Fe8'
_cell_volume   153.66183403
_cell_formula_units_Z   1
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
  Nb  Nb0  1  0.66672400  0.66663800  0.44026500  1.0
  Nb  Nb1  1  0.66673300  0.66663300  0.06838900  1.0
  Nb  Nb2  1  0.33353800  0.33323100  0.92289900  1.0
  Al  Al3  1  0.33360100  0.33320000  0.56039400  1.0
  Fe  Fe4  1  0.99984600  0.00007700  0.50236700  1.0
  Fe  Fe5  1  0.99975100  0.00012500  0.00677200  1.0
  Fe  Fe6  1  0.83102300  0.33804500  0.74799700  1.0
  Fe  Fe7  1  0.33801100  0.83099500  0.74806200  1.0
  Fe  Fe8  1  0.83102300  0.83093200  0.74799700  1.0
  Fe  Fe9  1  0.16982700  0.66023500  0.25160100  1.0
  Fe  Fe10  1  0.66009700  0.16995200  0.25165700  1.0
  Fe  Fe11  1  0.16982700  0.16993800  0.25160100  1.0