# generated using pymatgen
data_Li5Fe8(BO3)8
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   5.25786400
_cell_length_b   9.10153834
_cell_length_c   11.34474937
_cell_angle_alpha   112.94737659
_cell_angle_beta   102.93215335
_cell_angle_gamma   89.60495573
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Li5Fe8(BO3)8
_chemical_formula_sum   'Li5 Fe8 B8 O24'
_cell_volume   485.29822214
_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  0.02521600  0.03436000  0.40213600  1
  Li  Li1  1  0.26565700  0.24331900  0.15943500  1
  Li  Li2  1  0.52854900  0.53882800  0.41798800  1
  Li  Li3  1  0.98403400  0.00837400  0.66494300  1
  Li  Li4  1  0.75491100  0.73781100  0.14840200  1
  Fe  Fe5  1  0.02776400  0.34927800  0.38377000  1
  Fe  Fe6  1  0.27173000  0.92911700  0.87614300  1
  Fe  Fe7  1  0.46458400  0.16531800  0.63121400  1
  Fe  Fe8  1  0.23985600  0.56674100  0.13096400  1
  Fe  Fe9  1  0.76773900  0.43460900  0.87083600  1
  Fe  Fe10  1  0.53089200  0.85757800  0.38726200  1
  Fe  Fe11  1  0.97641500  0.65097700  0.63367900  1
  Fe  Fe12  1  0.74411800  0.05748400  0.12603000  1
  B  B13  1  0.01759400  0.68237100  0.37182600  1
  B  B14  1  0.27580200  0.60750400  0.88687200  1
  B  B15  1  0.48428500  0.82227600  0.62911100  1
  B  B16  1  0.23150900  0.89140600  0.12752900  1
  B  B17  1  0.51832600  0.18434600  0.37220200  1
  B  B18  1  0.76371700  0.10340100  0.87717700  1
  B  B19  1  0.97325400  0.31158000  0.62509200  1
  B  B20  1  0.74048500  0.39858600  0.13005200  1
  O  O21  1  0.01250200  0.07313700  0.85899500  1
  O  O22  1  0.14194000  0.71503600  0.84313100  1
  O  O23  1  0.13824400  0.51562100  0.93262200  1
  O  O24  1  0.07799300  0.16553500  0.60607400  1
  O  O25  1  0.07186500  0.42003600  0.58747100  1
  O  O26  1  0.25065800  0.85224500  0.67527100  1
  O  O27  1  0.25909500  0.65345700  0.33117500  1
  O  O28  1  0.53610700  0.59434400  0.89447400  1
  O  O29  1  0.63878500  0.22519500  0.84935800  1
  O  O30  1  0.40427400  0.08218700  0.41477800  1
  O  O31  1  0.39043900  0.31164600  0.35631800  1
  O  O32  1  0.63388700  0.01011900  0.92176300  1
  O  O33  1  0.33495800  0.99820100  0.08467400  1
  O  O34  1  0.59528900  0.68221800  0.60947000  1
  O  O35  1  0.59108900  0.93845600  0.59651000  1
  O  O36  1  0.39348000  0.78045500  0.16025500  1
  O  O37  1  0.48025200  0.40878000  0.13549100  1
  O  O38  1  0.75462300  0.34416900  0.68095300  1
  O  O39  1  0.76030800  0.15643500  0.34015300  1
  O  O40  1  0.91369600  0.57954200  0.41419500  1
  O  O41  1  0.89460900  0.81366100  0.36354600  1
  O  O42  1  0.85848000  0.50970200  0.09437100  1
  O  O43  1  0.88956400  0.28741100  0.16095400  1
  O  O44  1  0.98104300  0.89295600  0.14129500  1
