# generated using pymatgen
data_Li2MnFe3O8
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   5.90781040
_cell_length_b   5.90781040
_cell_length_c   9.55162800
_cell_angle_alpha   90.00000000
_cell_angle_beta   90.00000000
_cell_angle_gamma   120.00000445
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Li2MnFe3O8
_chemical_formula_sum   'Li4 Mn2 Fe6 O16'
_cell_volume   288.70952344
_cell_formula_units_Z   2
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  0.33333300  0.66666700  0.89676200  1
  Li  Li1  1  0.00000000  0.00000000  0.99414100  1
  Li  Li2  1  0.00000000  0.00000000  0.49414100  1
  Li  Li3  1  0.66666700  0.33333300  0.39676200  1
  Mn  Mn4  1  0.33333300  0.66666700  0.48232200  1
  Mn  Mn5  1  0.66666700  0.33333300  0.98232200  1
  Fe  Fe6  1  0.16933500  0.83066500  0.21208000  1
  Fe  Fe7  1  0.16933500  0.33866900  0.21208000  1
  Fe  Fe8  1  0.66133100  0.83066500  0.21208000  1
  Fe  Fe9  1  0.33866900  0.16933500  0.71208000  1
  Fe  Fe10  1  0.83066500  0.66133100  0.71208000  1
  Fe  Fe11  1  0.83066500  0.16933500  0.71208000  1
  O  O12  1  0.16891300  0.83108700  0.59775800  1
  O  O13  1  0.04174600  0.52087300  0.34687000  1
  O  O14  1  0.33333300  0.66666700  0.10391200  1
  O  O15  1  0.00000000  0.00000000  0.30668000  1
  O  O16  1  0.00000000  0.00000000  0.80668000  1
  O  O17  1  0.16891300  0.33782600  0.59775800  1
  O  O18  1  0.47912700  0.95825400  0.34687000  1
  O  O19  1  0.47912700  0.52087300  0.34687000  1
  O  O20  1  0.33782600  0.16891300  0.09775800  1
  O  O21  1  0.66217400  0.83108700  0.59775800  1
  O  O22  1  0.52087300  0.47912700  0.84687000  1
  O  O23  1  0.52087300  0.04174600  0.84687000  1
  O  O24  1  0.66666700  0.33333300  0.60391200  1
  O  O25  1  0.83108700  0.66217400  0.09775800  1
  O  O26  1  0.95825400  0.47912700  0.84687000  1
  O  O27  1  0.83108700  0.16891300  0.09775800  1
