# generated using pymatgen
data_Li8Mn5Fe3(BO3)8
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   5.23061300
_cell_length_b   5.23663711
_cell_length_c   20.89838390
_cell_angle_alpha   91.19688833
_cell_angle_beta   90.59528313
_cell_angle_gamma   119.85859321
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Li8Mn5Fe3(BO3)8
_chemical_formula_sum   'Li8 Mn5 Fe3 B8 O24'
_cell_volume   496.18752681
_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  0.34660600  0.32306300  0.66625600  1
  Li  Li1  1  0.32175800  0.34674200  0.91537800  1
  Li  Li2  1  0.34849400  0.32141800  0.16639500  1
  Li  Li3  1  0.32149400  0.34746500  0.41627400  1
  Li  Li4  1  0.66377000  0.65086700  0.79171900  1
  Li  Li5  1  0.65104800  0.66240000  0.54147700  1
  Li  Li6  1  0.66534700  0.65179000  0.29135000  1
  Li  Li7  1  0.65162900  0.66242800  0.04101400  1
  Mn  Mn8  1  0.99285000  0.32596500  0.55899400  1
  Mn  Mn9  1  0.99634800  0.32978500  0.05833500  1
  Mn  Mn10  1  0.99935800  0.67830200  0.93269400  1
  Mn  Mn11  1  0.99941700  0.67875400  0.43282900  1
  Mn  Mn12  1  0.67435900  0.99746200  0.18448000  1
  Fe  Fe13  1  0.68013900  0.99872100  0.68426800  1
  Fe  Fe14  1  0.33592800  0.98904500  0.80731200  1
  Fe  Fe15  1  0.32477400  0.99974300  0.30851700  1
  B  B16  1  0.65878900  0.00323300  0.93623300  1
  B  B17  1  0.65883300  0.00348000  0.43636100  1
  B  B18  1  0.00004000  0.33454600  0.81098100  1
  B  B19  1  0.99459900  0.33064600  0.31190500  1
  B  B20  1  0.00036400  0.66219700  0.68759000  1
  B  B21  1  0.00157600  0.65912100  0.18809400  1
  B  B22  1  0.33314000  0.99391300  0.56317800  1
  B  B23  1  0.33442900  0.99568300  0.06216200  1
  O  O24  1  0.74820600  0.07151200  0.79178800  1
  O  O25  1  0.74613300  0.06768400  0.29265300  1
  O  O26  1  0.93033400  0.25439100  0.95162700  1
  O  O27  1  0.42252800  0.03487400  0.91554100  1
  O  O28  1  0.93020200  0.25431900  0.45192300  1
  O  O29  1  0.42163500  0.03349000  0.41557900  1
  O  O30  1  0.97563900  0.58569900  0.82477700  1
  O  O31  1  0.35733700  0.26864400  0.56993900  1
  O  O32  1  0.97359900  0.58154700  0.32626300  1
  O  O33  1  0.35899200  0.26988400  0.06961600  1
  O  O34  1  0.26927600  0.35008300  0.81837300  1
  O  O35  1  0.26751000  0.34838800  0.31830800  1
  O  O36  1  0.72550500  0.63975900  0.69426100  1
  O  O37  1  0.72569300  0.62938200  0.19513300  1
  O  O38  1  0.62954300  0.72782900  0.94361000  1
  O  O39  1  0.01901400  0.41498900  0.66888500  1
  O  O40  1  0.62930900  0.72803300  0.44390300  1
  O  O41  1  0.03258300  0.42157800  0.16707000  1
  O  O42  1  0.57629500  0.96149400  0.57888100  1
  O  O43  1  0.57708800  0.96226800  0.07777500  1
  O  O44  1  0.06973900  0.75094600  0.54137700  1
  O  O45  1  0.07006000  0.75313900  0.04065800  1
  O  O46  1  0.25548100  0.93135500  0.70096300  1
  O  O47  1  0.25200600  0.93074200  0.20349600  1
