# generated using pymatgen
data_Al2Fe6H
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   3.69667890
_cell_length_b   3.69667890
_cell_length_c   7.21800034
_cell_angle_alpha   90.00000000
_cell_angle_beta   90.00000000
_cell_angle_gamma   90.00000000
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Al2Fe6H
_chemical_formula_sum   'Al2 Fe6 H1'
_cell_volume   98.63711350
_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
  Al  Al0  1  0.00000000  0.00000000  0.74708801  1.0
  Al  Al1  1  0.00000000  0.00000000  0.25291199  1.0
  Fe  Fe2  1  0.50000000  0.50000000  0.74237585  1.0
  Fe  Fe3  1  0.50000000  0.50000000  0.25762415  1.0
  Fe  Fe4  1  0.50000000  0.00000000  0.00000000  1.0
  Fe  Fe5  1  0.50000000  0.00000000  0.50000000  1.0
  Fe  Fe6  1  0.00000000  0.50000000  0.00000000  1.0
  Fe  Fe7  1  0.00000000  0.50000000  0.50000000  1.0
  H  H8  1  0.50000000  0.50000000  0.00000000  1.0