# generated using pymatgen
data_AlFe2
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   3.98156938
_cell_length_b   4.64358327
_cell_length_c   46.55405448
_cell_angle_alpha   90.00000000
_cell_angle_beta   90.00000000
_cell_angle_gamma   115.04309184
_symmetry_Int_Tables_number   1
_chemical_formula_structural   AlFe2
_chemical_formula_sum   'Al10 Fe20'
_cell_volume   779.80908023
_cell_formula_units_Z   10
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  0.200865  0.401948  0.300854  1
  Al  Al2  1  0.374766  0.750745  0.345168  1
  Al  Al3  1  0.548981  0.100353  0.388857  1
  Al  Al4  1  0.723076  0.449695  0.432404  1
  Al  Al5  1  0.896728  0.798171  0.475975  1
  Al  Al6  1  0.070429  0.146749  0.519528  1
  Al  Al7  1  0.244080  0.495224  0.563100  1
  Al  Al8  1  0.418176  0.844567  0.606647  1
  Al  Al9  1  0.592390  0.194175  0.650336  1
  Al  Al10  1  0.766292  0.542972  0.694650  1
  Fe  Fe11  1  0.879131  0.758535  0.304673  1
  Fe  Fe12  1  0.531833  0.063441  0.300348  1
  Fe  Fe13  1  0.051993  0.105239  0.347284  1
  Fe  Fe14  1  0.701323  0.403707  0.343717  1
  Fe  Fe15  1  0.224571  0.451646  0.390953  1
  Fe  Fe16  1  0.874933  0.752087  0.386880  1
  Fe  Fe17  1  0.398124  0.799924  0.434483  1
  Fe  Fe18  1  0.048160  0.099728  0.430417  1
  Fe  Fe19  1  0.571763  0.148377  0.478010  1
  Fe  Fe20  1  0.221766  0.448112  0.473952  1
  Fe  Fe21  1  0.745390  0.496808  0.521552  1
  Fe  Fe22  1  0.395393  0.796543  0.517494  1
  Fe  Fe23  1  0.918997  0.845192  0.565087  1
  Fe  Fe24  1  0.569032  0.144996  0.561021  1
  Fe  Fe25  1  0.092223  0.192833  0.608624  1
  Fe  Fe26  1  0.742585  0.493273  0.604551  1
  Fe  Fe27  1  0.265834  0.541213  0.651787  1
  Fe  Fe28  1  0.915163  0.839681  0.648220  1
  Fe  Fe29  1  0.435324  0.881479  0.695156  1
  Fe  Fe30  1  0.088026  0.186385  0.690831  1
