# generated using pymatgen
data_Li8Mn5Fe3(BO3)8
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   5.23663000
_cell_length_b   5.24900590
_cell_length_c   20.89175224
_cell_angle_alpha   91.56699003
_cell_angle_beta   89.53754246
_cell_angle_gamma   119.92169644
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Li8Mn5Fe3(BO3)8
_chemical_formula_sum   'Li8 Mn5 Fe3 B8 O24'
_cell_volume   497.51384378
_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  0.02226200  0.67597400  0.33387900  1
  Li  Li1  1  0.97534500  0.65324700  0.08422700  1
  Li  Li2  1  0.02556200  0.67742200  0.83399400  1
  Li  Li3  1  0.97270200  0.65148800  0.58397000  1
  Li  Li4  1  0.01570800  0.34851700  0.20821500  1
  Li  Li5  1  0.98794200  0.33712400  0.45812500  1
  Li  Li6  1  0.00930400  0.34555800  0.70818300  1
  Li  Li7  1  0.98873700  0.33757500  0.95868700  1
  Mn  Mn8  1  0.66709200  0.67401400  0.44035100  1
  Mn  Mn9  1  0.66701900  0.67321600  0.94124200  1
  Mn  Mn10  1  0.32155200  0.32144000  0.06748300  1
  Mn  Mn11  1  0.32080100  0.32361300  0.56631900  1
  Mn  Mn12  1  0.33463900  0.00274500  0.69280500  1
  Fe  Fe13  1  0.68300200  0.00743300  0.31504400  1
  Fe  Fe14  1  0.68680100  0.00526000  0.81636100  1
  Fe  Fe15  1  0.33229100  0.99588000  0.19310900  1
  B  B16  1  0.65576500  0.99665200  0.06375400  1
  B  B17  1  0.65546900  0.99763600  0.56282000  1
  B  B18  1  0.66621100  0.66862600  0.18911700  1
  B  B19  1  0.66239200  0.66527100  0.68865500  1
  B  B20  1  0.33808000  0.33710100  0.31213800  1
  B  B21  1  0.34202400  0.33905300  0.81325300  1
  B  B22  1  0.33906100  0.00625500  0.43662600  1
  B  B23  1  0.33923600  0.00644000  0.93710500  1
  O  O24  1  0.68194100  0.93366900  0.20806000  1
  O  O25  1  0.68461900  0.92942100  0.71005000  1
  O  O26  1  0.67596700  0.74574000  0.04829000  1
  O  O27  1  0.38863400  0.96599600  0.08467900  1
  O  O28  1  0.67600900  0.74697600  0.54741100  1
  O  O29  1  0.38827400  0.96680000  0.58404900  1
  O  O30  1  0.39479900  0.41867600  0.17519800  1
  O  O31  1  0.08923700  0.73171700  0.42981600  1
  O  O32  1  0.38515900  0.42220000  0.67338800  1
  O  O33  1  0.08959800  0.73206500  0.93015800  1
  O  O34  1  0.92218100  0.65377800  0.18201600  1
  O  O35  1  0.91171200  0.64114700  0.68074400  1
  O  O36  1  0.08523300  0.35903400  0.30583100  1
  O  O37  1  0.08921600  0.36069000  0.80630500  1
  O  O38  1  0.90149900  0.27226600  0.05641500  1
  O  O39  1  0.60303900  0.58319200  0.33071700  1
  O  O40  1  0.90059600  0.27291400  0.55526000  1
  O  O41  1  0.60717900  0.58448200  0.83231600  1
  O  O42  1  0.61455700  0.03913900  0.42078500  1
  O  O43  1  0.61510200  0.03927600  0.92161300  1
  O  O44  1  0.31853900  0.24899000  0.45835600  1
  O  O45  1  0.31801500  0.24884600  0.95883100  1
  O  O46  1  0.32217900  0.06648500  0.29866400  1
  O  O47  1  0.32771700  0.07016200  0.79938400  1
