# generated using pymatgen
data_Li2Fe3CuO8
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   8.41191900
_cell_length_b   8.41191900
_cell_length_c   8.41191900
_cell_angle_alpha   90.00000000
_cell_angle_beta   90.00000000
_cell_angle_gamma   90.00000000
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Li2Fe3CuO8
_chemical_formula_sum   'Li8 Fe12 Cu4 O32'
_cell_volume   595.23059559
_cell_formula_units_Z   4
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  0.00393800  0.00393800  0.00393800  1
  Li  Li1  1  0.24606200  0.24606200  0.24606200  1
  Li  Li2  1  0.25393800  0.75393800  0.74606200  1
  Li  Li3  1  0.49606200  0.99606200  0.50393800  1
  Li  Li4  1  0.50393800  0.49606200  0.99606200  1
  Li  Li5  1  0.74606200  0.25393800  0.75393800  1
  Li  Li6  1  0.75393800  0.74606200  0.25393800  1
  Li  Li7  1  0.99606200  0.50393800  0.49606200  1
  Fe  Fe8  1  0.12450300  0.12549700  0.62500000  1
  Fe  Fe9  1  0.12500000  0.37549700  0.87450300  1
  Fe  Fe10  1  0.12549700  0.62500000  0.12450300  1
  Fe  Fe11  1  0.37450300  0.37500000  0.62450300  1
  Fe  Fe12  1  0.37500000  0.62450300  0.37450300  1
  Fe  Fe13  1  0.37549700  0.87450300  0.12500000  1
  Fe  Fe14  1  0.62450300  0.37450300  0.37500000  1
  Fe  Fe15  1  0.62500000  0.12450300  0.12549700  1
  Fe  Fe16  1  0.62549700  0.87500000  0.87549700  1
  Fe  Fe17  1  0.87450300  0.12500000  0.37549700  1
  Fe  Fe18  1  0.87500000  0.87549700  0.62549700  1
  Fe  Fe19  1  0.87549700  0.62549700  0.87500000  1
  Cu  Cu20  1  0.12500000  0.87500000  0.37500000  1
  Cu  Cu21  1  0.37500000  0.12500000  0.87500000  1
  Cu  Cu22  1  0.62500000  0.62500000  0.62500000  1
  Cu  Cu23  1  0.87500000  0.37500000  0.12500000  1
  O  O24  1  0.11770300  0.10396800  0.38668400  1
  O  O25  1  0.11331600  0.88229700  0.60396800  1
  O  O26  1  0.11522800  0.61522800  0.88477200  1
  O  O27  1  0.14603200  0.13229700  0.86331600  1
  O  O28  1  0.10396800  0.38668400  0.11770300  1
  O  O29  1  0.13477200  0.36522800  0.63477200  1
  O  O30  1  0.13668400  0.64603200  0.36770300  1
  O  O31  1  0.13229700  0.86331600  0.14603200  1
  O  O32  1  0.36770300  0.13668400  0.64603200  1
  O  O33  1  0.36331600  0.35396800  0.86770300  1
  O  O34  1  0.36522800  0.63477200  0.13477200  1
  O  O35  1  0.39603200  0.61331600  0.61770300  1
  O  O36  1  0.35396800  0.86770300  0.36331600  1
  O  O37  1  0.38477200  0.38477200  0.38477200  1
  O  O38  1  0.38668400  0.11770300  0.10396800  1
  O  O39  1  0.38229700  0.89603200  0.88668400  1
  O  O40  1  0.61770300  0.39603200  0.61331600  1
  O  O41  1  0.61331600  0.61770300  0.39603200  1
  O  O42  1  0.61522800  0.88477200  0.11522800  1
  O  O43  1  0.64603200  0.36770300  0.13668400  1
  O  O44  1  0.60396800  0.11331600  0.88229700  1
  O  O45  1  0.63477200  0.13477200  0.36522800  1
  O  O46  1  0.63668400  0.85396800  0.63229700  1
  O  O47  1  0.63229700  0.63668400  0.85396800  1
  O  O48  1  0.86770300  0.36331600  0.35396800  1
  O  O49  1  0.86331600  0.14603200  0.13229700  1
  O  O50  1  0.86522800  0.86522800  0.86522800  1
  O  O51  1  0.89603200  0.88668400  0.38229700  1
  O  O52  1  0.85396800  0.63229700  0.63668400  1
  O  O53  1  0.88477200  0.11522800  0.61522800  1
  O  O54  1  0.88668400  0.38229700  0.89603200  1
  O  O55  1  0.88229700  0.60396800  0.11331600  1
