# generated using pymatgen
data_LiAl2FeO6
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   4.92123229
_cell_length_b   4.92123229
_cell_length_c   5.32219508
_cell_angle_alpha   80.51634753
_cell_angle_beta   80.51634753
_cell_angle_gamma   120.21227369
_symmetry_Int_Tables_number   1
_chemical_formula_structural   LiAl2FeO6
_chemical_formula_sum   'Li1 Al2 Fe1 O6'
_cell_volume   105.12447582
_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
  Li  Li0  1  0.50000000  0.50000000  0.50000000  1
  Al  Al1  1  0.66788400  0.33211600  0.00000000  1
  Al  Al2  1  0.33211600  0.66788400  0.00000000  1
  Fe  Fe3  1  0.00000000  0.00000000  0.00000000  1
  O  O4  1  0.92407900  0.59878700  0.19608700  1
  O  O5  1  0.73502800  0.73502800  0.80455800  1
  O  O6  1  0.40121300  0.07592100  0.80391300  1
  O  O7  1  0.59878700  0.92407900  0.19608700  1
  O  O8  1  0.26497200  0.26497200  0.19544200  1
  O  O9  1  0.07592100  0.40121300  0.80391300  1
