# generated using pymatgen
data_Li6Fe5O12
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   5.12639621
_cell_length_b   8.83470934
_cell_length_c   9.90607939
_cell_angle_alpha   90.70985784
_cell_angle_beta   100.02990817
_cell_angle_gamma   89.59254168
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Li6Fe5O12
_chemical_formula_sum   'Li12 Fe10 O24'
_cell_volume   441.75231647
_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  0.24123100  0.74070000  0.00229600  1.0
  Li  Li1  1  0.25820000  0.42016000  0.00013600  1.0
  Li  Li2  1  0.24513000  0.91384100  0.49342200  1.0
  Li  Li3  1  0.25533500  0.24559900  0.49464700  1.0
  Li  Li4  1  0.25085400  0.58975700  0.49505800  1.0
  Li  Li5  1  0.25009500  0.08741900  0.00132500  1.0
  Li  Li6  1  0.74691000  0.89802500  0.00912700  1.0
  Li  Li7  1  0.75222200  0.25768600  0.00522600  1.0
  Li  Li8  1  0.50203500  0.24571700  0.25411000  1.0
  Li  Li9  1  0.74996200  0.75999600  0.49873500  1.0
  Li  Li10  1  0.74902800  0.40083000  0.49742300  1.0
  Li  Li11  1  0.99829600  0.74714000  0.24553700  1.0
  Fe  Fe12  1  0.99373500  0.58803100  0.74936200  1.0
  Fe  Fe13  1  0.50629500  0.08542500  0.75015600  1.0
  Fe  Fe14  1  0.49989600  0.75088900  0.75570000  1.0
  Fe  Fe15  1  0.99935600  0.25028900  0.74564900  1.0
  Fe  Fe16  1  0.49777200  0.41899400  0.75311300  1.0
  Fe  Fe17  1  0.99661900  0.91922200  0.74619600  1.0
  Fe  Fe18  1  0.00910900  0.41523300  0.24974000  1.0
  Fe  Fe19  1  0.49665300  0.91608600  0.25202600  1.0
  Fe  Fe20  1  0.51190000  0.58051300  0.25297800  1.0
  Fe  Fe21  1  0.99137000  0.08139100  0.24600500  1.0
  O  O22  1  0.13298700  0.09484300  0.64194400  1.0
  O  O23  1  0.12255500  0.75129100  0.63117900  1.0
  O  O24  1  0.12186200  0.41316500  0.63611100  1.0
  O  O25  1  0.37087000  0.92121000  0.86474900  1.0
  O  O26  1  0.37729400  0.25353400  0.86892100  1.0
  O  O27  1  0.10665500  0.23791300  0.13564500  1.0
  O  O28  1  0.35561100  0.58509400  0.86070000  1.0
  O  O29  1  0.13158900  0.93223400  0.13456500  1.0
  O  O30  1  0.16573800  0.56616700  0.14380400  1.0
  O  O31  1  0.33981600  0.06635800  0.35569300  1.0
  O  O32  1  0.34749800  0.42172500  0.36601500  1.0
  O  O33  1  0.39943200  0.74712100  0.36488300  1.0
  O  O34  1  0.62471600  0.58195100  0.64011400  1.0
  O  O35  1  0.62255400  0.25597300  0.63836300  1.0
  O  O36  1  0.62092400  0.91288600  0.63937900  1.0
  O  O37  1  0.59432500  0.76336700  0.14081500  1.0
  O  O38  1  0.88459100  0.40525500  0.85742700  1.0
  O  O39  1  0.87758600  0.75661900  0.86240200  1.0
  O  O40  1  0.88010100  0.09108800  0.86003400  1.0
  O  O41  1  0.64879000  0.07537200  0.13844300  1.0
  O  O42  1  0.65247400  0.42496100  0.14563800  1.0
  O  O43  1  0.86869500  0.93137700  0.35406700  1.0
  O  O44  1  0.84913300  0.57415900  0.36479200  1.0
  O  O45  1  0.90219500  0.24993900  0.35635700  1.0