# generated using pymatgen
data_Li3Fe5O12
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   5.02471200
_cell_length_b   5.02920532
_cell_length_c   20.16561384
_cell_angle_alpha   88.03605746
_cell_angle_beta   94.30956210
_cell_angle_gamma   119.92909772
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Li3Fe5O12
_chemical_formula_sum   'Li6 Fe10 O24'
_cell_volume   440.38222682
_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  0.65663900  0.81631800  0.49825700  1
  Li  Li1  1  0.62336000  0.49776500  0.37504900  1
  Li  Li2  1  0.89582800  0.81160000  0.25233300  1
  Li  Li3  1  0.48760300  0.50387700  0.99838500  1
  Li  Li4  1  0.12129100  0.50058900  0.87516400  1
  Li  Li5  1  0.40703800  0.82031000  0.75191200  1
  Fe  Fe6  1  0.53718200  0.82968100  0.12498300  1
  Fe  Fe7  1  0.87111000  0.49605400  0.12489000  1
  Fe  Fe8  1  0.20442100  0.16262900  0.12538200  1
  Fe  Fe9  1  0.29445500  0.84009100  0.37483500  1
  Fe  Fe10  1  0.96396900  0.17923000  0.37494300  1
  Fe  Fe11  1  0.03972600  0.82933900  0.62501400  1
  Fe  Fe12  1  0.37308700  0.49537400  0.62498400  1
  Fe  Fe13  1  0.70620900  0.16253300  0.62499400  1
  Fe  Fe14  1  0.80325900  0.84146900  0.87495500  1
  Fe  Fe15  1  0.46296400  0.17165200  0.87488700  1
  O  O16  1  0.20412700  0.80895200  0.17527100  1
  O  O17  1  0.54217000  0.17667800  0.07493300  1
  O  O18  1  0.20456000  0.51579000  0.07433300  1
  O  O19  1  0.64456500  0.13447500  0.42632400  1
  O  O20  1  0.69996600  0.82953000  0.67595600  1
  O  O21  1  0.62013000  0.87767600  0.32455600  1
  O  O22  1  0.97464400  0.51485600  0.32523600  1
  O  O23  1  0.00905900  0.16747400  0.57480700  1
  O  O24  1  0.67031100  0.49039100  0.57442300  1
  O  O25  1  0.57582700  0.51952500  0.17619600  1
  O  O26  1  0.86540000  0.14881500  0.17503300  1
  O  O27  1  0.15515800  0.15124800  0.92516800  1
  O  O28  1  0.29016000  0.51706500  0.42458400  1
  O  O29  1  0.12417900  0.86816300  0.82483300  1
  O  O30  1  0.00623700  0.87855800  0.42534200  1
  O  O31  1  0.83317700  0.80685300  0.07403600  1
  O  O32  1  0.48501200  0.51296100  0.82485200  1
  O  O33  1  0.23747200  0.13297900  0.32331300  1
  O  O34  1  0.07105100  0.49161600  0.67563600  1
  O  O35  1  0.40938000  0.16867600  0.67525200  1
  O  O36  1  0.77401000  0.50635100  0.92619800  1
  O  O37  1  0.51672300  0.86836800  0.92525200  1
  O  O38  1  0.37916900  0.82819800  0.57411300  1
  O  O39  1  0.74191800  0.13097600  0.82367700  1
