# generated using pymatgen
data_Li8Mn5Fe3(BO3)8
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   5.24049200
_cell_length_b   5.25034119
_cell_length_c   20.93706437
_cell_angle_alpha   90.90966483
_cell_angle_beta   90.63499070
_cell_angle_gamma   119.76611599
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Li8Mn5Fe3(BO3)8
_chemical_formula_sum   'Li8 Mn5 Fe3 B8 O24'
_cell_volume   499.88061456
_cell_formula_units_Z   1
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  0.34968700  0.32510900  0.66645400  1
  Li  Li1  1  0.32131400  0.34697100  0.91569400  1
  Li  Li2  1  0.34909900  0.32092600  0.16596400  1
  Li  Li3  1  0.32205700  0.34918000  0.41646800  1
  Li  Li4  1  0.66631400  0.65573700  0.79042400  1
  Li  Li5  1  0.65113700  0.66349100  0.54189800  1
  Li  Li6  1  0.66223200  0.65148200  0.29132100  1
  Li  Li7  1  0.65189000  0.66211000  0.04088700  1
  Mn  Mn8  1  0.99660500  0.32963500  0.05800200  1
  Mn  Mn9  1  0.99954100  0.67942300  0.93233600  1
  Mn  Mn10  1  0.99800000  0.67401700  0.43465900  1
  Mn  Mn11  1  0.67736900  0.99652600  0.18343300  1
  Mn  Mn12  1  0.32865800  0.99605200  0.30869700  1
  Fe  Fe13  1  0.99535900  0.32161900  0.55982600  1
  Fe  Fe14  1  0.67620600  0.01018500  0.68311600  1
  Fe  Fe15  1  0.32592500  0.99766000  0.80773700  1
  B  B16  1  0.65855600  0.00363000  0.93611900  1
  B  B17  1  0.65972000  0.00263700  0.43820800  1
  B  B18  1  0.99549800  0.33041600  0.81093700  1
  B  B19  1  0.99584300  0.33416700  0.31239300  1
  B  B20  1  0.00183600  0.66230300  0.68694500  1
  B  B21  1  0.00183100  0.65790400  0.18727500  1
  B  B22  1  0.32919800  0.99138000  0.56256100  1
  B  B23  1  0.33450900  0.99511300  0.06199000  1
  O  O24  1  0.74758400  0.06981700  0.79191000  1
  O  O25  1  0.75346700  0.07056700  0.29114700  1
  O  O26  1  0.92952900  0.25418700  0.95148300  1
  O  O27  1  0.42185600  0.03339700  0.91547300  1
  O  O28  1  0.92960400  0.25225500  0.45375000  1
  O  O29  1  0.42190400  0.03220300  0.41722200  1
  O  O30  1  0.97609200  0.58265000  0.82538300  1
  O  O31  1  0.34558500  0.26468300  0.56892100  1
  O  O32  1  0.96197900  0.57746000  0.32782900  1
  O  O33  1  0.35876300  0.26905600  0.06922600  1
  O  O34  1  0.26821100  0.34732600  0.81728800  1
  O  O35  1  0.26895200  0.35835400  0.31984800  1
  O  O36  1  0.73232500  0.64373600  0.69310300  1
  O  O37  1  0.72677600  0.62814800  0.19464300  1
  O  O38  1  0.62949500  0.72775800  0.94355600  1
  O  O39  1  0.02453800  0.41575500  0.66781200  1
  O  O40  1  0.63048100  0.72688900  0.44534600  1
  O  O41  1  0.03325800  0.42056600  0.16640800  1
  O  O42  1  0.58016400  0.97158300  0.57708800  1
  O  O43  1  0.57782100  0.96208900  0.07734100  1
  O  O44  1  0.06862400  0.74322400  0.54350300  1
  O  O45  1  0.07076100  0.75335400  0.04076300  1
  O  O46  1  0.26013500  0.92725000  0.70153800  1
  O  O47  1  0.25251500  0.92882500  0.20227600  1
