# generated using pymatgen
data_Li3Fe3O8
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   5.89395222
_cell_length_b   10.17280175
_cell_length_c   5.84040486
_cell_angle_alpha   73.34096428
_cell_angle_beta   119.67349083
_cell_angle_gamma   105.85119531
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Li3Fe3O8
_chemical_formula_sum   'Li6 Fe6 O16'
_cell_volume   287.84182828
_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  0.49822000  0.49979500  0.50246900  1
  Li  Li1  1  0.00122900  0.99927400  0.99749000  1
  Li  Li2  1  0.70099800  0.07819100  0.31056000  1
  Li  Li3  1  0.20076400  0.57816400  0.81201900  1
  Li  Li4  1  0.79872600  0.42093800  0.18953000  1
  Li  Li5  1  0.29916600  0.92097100  0.68830700  1
  Fe  Fe6  1  0.74979300  0.74955300  0.25008400  1
  Fe  Fe7  1  0.24959800  0.24952800  0.74976500  1
  Fe  Fe8  1  0.24972100  0.24949600  0.25009900  1
  Fe  Fe9  1  0.74984300  0.74946800  0.75025100  1
  Fe  Fe10  1  0.75015300  0.24964700  0.75009500  1
  Fe  Fe11  1  0.25026100  0.74953800  0.25032500  1
  O  O12  1  0.90267500  0.14816500  0.10329500  1
  O  O13  1  0.40518900  0.64620700  0.60809100  1
  O  O14  1  0.59693900  0.35097800  0.39669500  1
  O  O15  1  0.09456000  0.85278400  0.89220300  1
  O  O16  1  0.36562700  0.13214700  0.63743200  1
  O  O17  1  0.86163100  0.63309800  0.09306600  1
  O  O18  1  0.13420200  0.36695800  0.86268300  1
  O  O19  1  0.63830000  0.86593600  0.40731500  1
  O  O20  1  0.35066400  0.14317200  0.10130100  1
  O  O21  1  0.84989100  0.64245300  0.60369200  1
  O  O22  1  0.90399400  0.14638500  0.65086600  1
  O  O23  1  0.39751000  0.64739100  0.15006300  1
  O  O24  1  0.14899700  0.35581000  0.39880100  1
  O  O25  1  0.65001700  0.85641900  0.89665400  1
  O  O26  1  0.59565000  0.35273300  0.84915300  1
  O  O27  1  0.10236500  0.85181600  0.35021900  1
