# generated using pymatgen
data_AlFe
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   2.64102048
_cell_length_b   4.10707911
_cell_length_c   46.14100348
_cell_angle_alpha   90.00000000
_cell_angle_beta   90.00000000
_cell_angle_gamma   90.00000000
_symmetry_Int_Tables_number   1
_chemical_formula_structural   AlFe
_chemical_formula_sum   'Al9 Fe9'
_cell_volume   500.485930612
_cell_formula_units_Z   9
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  0.753159  0.514510  0.291018  1
  Al  Al2  1  0.253159  0.514510  0.341732  1
  Al  Al3  1  0.753159  0.514511  0.392081  1
  Al  Al4  1  0.253159  0.514347  0.442654  1
  Al  Al5  1  0.753159  0.519307  0.493517  1
  Al  Al6  1  0.253159  0.766751  0.553876  1
  Al  Al7  1  0.753159  0.771728  0.604728  1
  Al  Al8  1  0.253159  0.771563  0.655247  1
  Al  Al9  1  0.753159  0.771565  0.706013  1
  Fe  Fe10  1  0.253159  1.014510  0.309999  1
  Fe  Fe11  1  0.753159  1.014510  0.358808  1
  Fe  Fe12  1  0.253159  1.014474  0.408874  1
  Fe  Fe13  1  0.753159  1.015111  0.457548  1
  Fe  Fe14  1  0.253159  1.016360  0.503787  1
  Fe  Fe15  1  0.753159  0.269709  0.543615  1
  Fe  Fe16  1  0.253159  0.270963  0.589860  1
  Fe  Fe17  1  0.753159  0.271601  0.638487  1
  Fe  Fe18  1  0.253159  0.271565  0.687059  1
