# generated using pymatgen
data_Y(AlFe)6
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   4.96741662
_cell_length_b   6.57044733
_cell_length_c   6.57044733
_cell_angle_alpha   98.36039488
_cell_angle_beta   112.21060401
_cell_angle_gamma   67.78939599
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Y(AlFe)6
_chemical_formula_sum   'Y1 Al6 Fe6'
_cell_volume   183.80340810
_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
  Y  Y0  1  -0.00000000  0.00000000  -0.00000000  1.0
  Al  Al1  1  0.65270067  0.34729933  0.65270067  1.0
  Al  Al2  1  0.34729933  0.65270067  0.34729933  1.0
  Al  Al3  1  -0.00000000  0.33823382  0.33823382  1.0
  Al  Al4  1  0.00000000  0.66176618  0.66176618  1.0
  Al  Al5  1  0.69602275  0.80397725  0.19602275  1.0
  Al  Al6  1  0.30397725  0.19602275  0.80397725  1.0
  Fe  Fe7  1  0.50000000  0.00000000  0.50000000  1.0
  Fe  Fe8  1  -0.00000000  0.00000000  0.50000000  1.0
  Fe  Fe9  1  0.50000000  0.50000000  -0.00000000  1.0
  Fe  Fe10  1  -0.00000000  0.50000000  -0.00000000  1.0
  Fe  Fe11  1  0.50000000  0.76074351  0.76074351  1.0
  Fe  Fe12  1  0.50000000  0.23925649  0.23925649  1.0