# generated using pymatgen
data_Li8Mn5Fe3(BO3)8
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   5.24084300
_cell_length_b   5.24244154
_cell_length_c   20.93569472
_cell_angle_alpha   90.75337153
_cell_angle_beta   90.97065974
_cell_angle_gamma   119.85771359
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Li8Mn5Fe3(BO3)8
_chemical_formula_sum   'Li8 Mn5 Fe3 B8 O24'
_cell_volume   498.62812338
_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  0.67865900  0.65199700  0.33363700  1
  Li  Li1  1  0.65347400  0.67822200  0.08447200  1
  Li  Li2  1  0.67916500  0.65138300  0.83407100  1
  Li  Li3  1  0.65089300  0.67883200  0.58381600  1
  Li  Li4  1  0.34883500  0.33779000  0.20837300  1
  Li  Li5  1  0.33790800  0.34879600  0.45849100  1
  Li  Li6  1  0.34833800  0.33814900  0.70879100  1
  Li  Li7  1  0.33819600  0.34691600  0.95860800  1
  Mn  Mn8  1  0.67408600  0.00588200  0.44065500  1
  Mn  Mn9  1  0.66912000  0.00337700  0.94240400  1
  Mn  Mn10  1  0.32334700  0.00322400  0.56615600  1
  Mn  Mn11  1  0.00329000  0.32296600  0.81658000  1
  Mn  Mn12  1  0.00300600  0.67102300  0.69141400  1
  Fe  Fe13  1  0.31614100  0.00215700  0.06697000  1
  Fe  Fe14  1  0.00416600  0.32086200  0.31534500  1
  Fe  Fe15  1  0.00730900  0.66643600  0.19128800  1
  B  B16  1  0.99604700  0.33844400  0.06372500  1
  B  B17  1  0.99694100  0.34131800  0.56289600  1
  B  B18  1  0.66590000  0.00474800  0.18797600  1
  B  B19  1  0.66555000  0.00479100  0.68795600  1
  B  B20  1  0.33770400  0.99643100  0.31247400  1
  B  B21  1  0.34137200  0.99717100  0.81306100  1
  B  B22  1  0.00591000  0.66582100  0.43712200  1
  B  B23  1  0.00433200  0.66575900  0.93858400  1
  O  O24  1  0.92887100  0.25615400  0.20782800  1
  O  O25  1  0.93053500  0.24711900  0.70905800  1
  O  O26  1  0.74052300  0.07080200  0.04962700  1
  O  O27  1  0.97702100  0.58413200  0.08269500  1
  O  O28  1  0.74674400  0.06959400  0.54773300  1
  O  O29  1  0.96607400  0.57861900  0.58348300  1
  O  O30  1  0.41659500  0.02947300  0.17324300  1
  O  O31  1  0.73102100  0.64114000  0.43016900  1
  O  O32  1  0.42250600  0.03867700  0.67267600  1
  O  O33  1  0.72990300  0.64100500  0.93117000  1
  O  O34  1  0.65302300  0.73640000  0.18142500  1
  O  O35  1  0.64021300  0.73051000  0.68065600  1
  O  O36  1  0.35887000  0.27075400  0.30584600  1
  O  O37  1  0.37156600  0.27293700  0.80596200  1
  O  O38  1  0.27042000  0.35981000  0.05714500  1
  O  O39  1  0.58500800  0.97896400  0.33157200  1
  O  O40  1  0.27277200  0.37155800  0.55560700  1
  O  O41  1  0.57892100  0.96612000  0.83373700  1
  O  O42  1  0.03887700  0.42318200  0.42145600  1
  O  O43  1  0.03782900  0.42270800  0.92322800  1
  O  O44  1  0.24856700  0.93007200  0.45851800  1
  O  O45  1  0.24643900  0.92994600  0.95982900  1
  O  O46  1  0.06973100  0.74226900  0.29828100  1
  O  O47  1  0.06947600  0.74676100  0.79799200  1
