# generated using pymatgen
data_Li3Fe5O12
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   5.02715300
_cell_length_b   5.07229020
_cell_length_c   18.52707508
_cell_angle_alpha   93.65448032
_cell_angle_beta   92.61053331
_cell_angle_gamma   113.99046347
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Li3Fe5O12
_chemical_formula_sum   'Li6 Fe10 O24'
_cell_volume   429.41112933
_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  0.67939500  0.19453500  0.10656200  1
  Li  Li1  1  0.69159900  0.18206600  0.60620200  1
  Li  Li2  1  0.82997900  0.61945000  0.74238500  1
  Li  Li3  1  0.14569800  0.35038800  0.24860600  1
  Li  Li4  1  0.06684000  0.92684200  0.12464900  1
  Li  Li5  1  0.07973700  0.93768600  0.62402500  1
  Fe  Fe6  1  0.92854800  0.05866200  0.37792600  1
  Fe  Fe7  1  0.01829600  0.53438500  0.00406400  1
  Fe  Fe8  1  0.93710800  0.07269800  0.87726200  1
  Fe  Fe9  1  0.01768600  0.52334200  0.50484700  1
  Fe  Fe10  1  0.48633700  0.99977100  0.24663200  1
  Fe  Fe11  1  0.48430400  0.99551200  0.74740200  1
  Fe  Fe12  1  0.57691900  0.42911600  0.37814800  1
  Fe  Fe13  1  0.57159900  0.42899300  0.87773400  1
  Fe  Fe14  1  0.43185400  0.58316200  0.12418300  1
  Fe  Fe15  1  0.42485700  0.56962500  0.62470000  1
  O  O16  1  0.81152700  0.29037600  0.30770600  1
  O  O17  1  0.70357800  0.20192700  0.44432600  1
  O  O18  1  0.91116400  0.73898100  0.43257100  1
  O  O19  1  0.80264400  0.30525100  0.80836900  1
  O  O20  1  0.73023300  0.56514600  0.07148800  1
  O  O21  1  0.70762000  0.20623100  0.94465400  1
  O  O22  1  0.90487900  0.74442000  0.93297400  1
  O  O23  1  0.73759700  0.55832300  0.56886600  1
  O  O24  1  0.72405600  0.92848600  0.17928600  1
  O  O25  1  0.42068800  0.27546300  0.18114700  1
  O  O26  1  0.59603400  0.74826200  0.32417300  1
  O  O27  1  0.72342000  0.90073000  0.68037800  1
  O  O28  1  0.47394400  0.29183600  0.68148400  1
  O  O29  1  0.25934100  0.10797800  0.31660300  1
  O  O30  1  0.62266200  0.75678100  0.81998800  1
  O  O31  1  0.26045100  0.09308400  0.82007500  1
  O  O32  1  0.33308900  0.82121600  0.05834900  1
  O  O33  1  0.23551600  0.38406000  0.43090900  1
  O  O34  1  0.09177800  0.29464100  0.07070600  1
  O  O35  1  0.19564400  0.68265200  0.19534500  1
  O  O36  1  0.33770700  0.81260600  0.55855300  1
  O  O37  1  0.24503200  0.40221600  0.92929400  1
  O  O38  1  0.09177000  0.28179800  0.57242200  1
  O  O39  1  0.18999400  0.69239100  0.69610400  1
