# generated using pymatgen
data_Li5Fe8(BO3)8
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   5.25470700
_cell_length_b   9.11514685
_cell_length_c   10.13290061
_cell_angle_alpha   89.06304016
_cell_angle_beta   88.59996512
_cell_angle_gamma   89.44876658
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Li5Fe8(BO3)8
_chemical_formula_sum   'Li5 Fe8 B8 O24'
_cell_volume   485.10945281
_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  0.15134800  0.17418400  0.66537400  1
  Li  Li1  1  0.18600200  0.16251600  0.15829900  1
  Li  Li2  1  0.32448000  0.33000900  0.40446900  1
  Li  Li3  1  0.68297400  0.66226600  0.14535800  1
  Li  Li4  1  0.81614800  0.83351800  0.41767800  1
  Fe  Fe5  1  0.15763400  0.83473700  0.63658700  1
  Fe  Fe6  1  0.18621000  0.49448600  0.12256500  1
  Fe  Fe7  1  0.33493900  0.99315400  0.87878000  1
  Fe  Fe8  1  0.32427300  0.66405800  0.37909700  1
  Fe  Fe9  1  0.65228700  0.34851800  0.63536400  1
  Fe  Fe10  1  0.68569600  0.99713900  0.12538800  1
  Fe  Fe11  1  0.83325200  0.16210600  0.38347600  1
  Fe  Fe12  1  0.83124700  0.49922700  0.87757700  1
  B  B13  1  0.15534000  0.49683400  0.62110900  1
  B  B14  1  0.16990800  0.83032100  0.13298000  1
  B  B15  1  0.33891900  0.99457300  0.37497400  1
  B  B16  1  0.33322100  0.66637200  0.88209700  1
  B  B17  1  0.66924500  0.00684100  0.62801200  1
  B  B18  1  0.67568300  0.32923500  0.13003600  1
  B  B19  1  0.82512900  0.50140200  0.37529700  1
  B  B20  1  0.82673000  0.16566700  0.87614800  1
  O  O21  1  0.08891100  0.49895700  0.34566600  1
  O  O22  1  0.08505100  0.14477900  0.85835800  1
  O  O23  1  0.22206200  0.79821500  0.84121300  1
  O  O24  1  0.20901100  0.86563700  0.41229400  1
  O  O25  1  0.20881900  0.12657000  0.36652500  1
  O  O26  1  0.17449600  0.55209600  0.92217300  1
  O  O27  1  0.27742500  0.36257600  0.60495100  1
  O  O28  1  0.29520800  0.95723200  0.08495900  1
  O  O29  1  0.26822500  0.62534600  0.57246600  1
  O  O30  1  0.31786800  0.70929000  0.17737100  1
  O  O31  1  0.41450600  0.32356200  0.14065800  1
  O  O32  1  0.41250900  0.01259200  0.67430900  1
  O  O33  1  0.59625400  0.98770300  0.34406300  1
  O  O34  1  0.59065900  0.65224900  0.88865200  1
  O  O35  1  0.71583600  0.30068300  0.84665000  1
  O  O36  1  0.70204700  0.37485000  0.41517400  1
  O  O37  1  0.69173900  0.63285800  0.36029500  1
  O  O38  1  0.67431900  0.05121100  0.92172100  1
  O  O39  1  0.79685900  0.46005900  0.08907500  1
  O  O40  1  0.79112000  0.87566200  0.60790400  1
  O  O41  1  0.79292200  0.13892500  0.59699900  1
  O  O42  1  0.82249900  0.20656800  0.16429100  1
  O  O43  1  0.91265300  0.82305800  0.13925600  1
  O  O44  1  0.91497900  0.50499000  0.68026900  1
