# generated using pymatgen
data_Li5Fe8(BO3)8
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   5.22970300
_cell_length_b   9.12321657
_cell_length_c   11.38655916
_cell_angle_alpha   112.72032956
_cell_angle_beta   102.64372230
_cell_angle_gamma   89.93667656
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Li5Fe8(BO3)8
_chemical_formula_sum   'Li5 Fe8 B8 O24'
_cell_volume   486.85727506
_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  0.29470300  0.27422400  0.91709600  1
  Li  Li1  1  0.48016400  0.50559700  0.65894400  1
  Li  Li2  1  0.53277300  0.53591500  0.41086400  1
  Li  Li3  1  0.98557900  0.00546500  0.66487400  1
  Li  Li4  1  0.76776800  0.75562900  0.16519000  1
  Fe  Fe5  1  0.03504200  0.34228100  0.37635500  1
  Fe  Fe6  1  0.26247400  0.92739600  0.88169000  1
  Fe  Fe7  1  0.46259800  0.15581400  0.62234900  1
  Fe  Fe8  1  0.24529600  0.55952200  0.13592100  1
  Fe  Fe9  1  0.77665100  0.43810000  0.87921300  1
  Fe  Fe10  1  0.51237600  0.85949100  0.38155300  1
  Fe  Fe11  1  0.97215200  0.65288300  0.63238600  1
  Fe  Fe12  1  0.73936600  0.07344500  0.12729600  1
  B  B13  1  0.00904700  0.68109200  0.37759100  1
  B  B14  1  0.26227000  0.59356800  0.87136600  1
  B  B15  1  0.47014100  0.81336200  0.62177700  1
  B  B16  1  0.23891200  0.89873200  0.13324500  1
  B  B17  1  0.53350300  0.18947800  0.37368000  1
  B  B18  1  0.77298500  0.11410800  0.88314200  1
  B  B19  1  0.98031900  0.31782100  0.63371200  1
  B  B20  1  0.73083500  0.39500300  0.12296300  1
  O  O21  1  0.01979800  0.09675500  0.86003300  1
  O  O22  1  0.11883800  0.70221700  0.83730100  1
  O  O23  1  0.15029600  0.49207600  0.91753300  1
  O  O24  1  0.09396800  0.18395300  0.63529200  1
  O  O25  1  0.09097400  0.42253800  0.59260300  1
  O  O26  1  0.24031800  0.84605600  0.66428400  1
  O  O27  1  0.26395000  0.67556500  0.35296600  1
  O  O28  1  0.51854000  0.57761600  0.85950400  1
  O  O29  1  0.62192500  0.22822800  0.84858100  1
  O  O30  1  0.44810000  0.07917900  0.41871800  1
  O  O31  1  0.41751600  0.32716100  0.39159900  1
  O  O32  1  0.65424100  0.02422400  0.93300700  1
  O  O33  1  0.36998700  0.98856300  0.08791100  1
  O  O34  1  0.58465700  0.67430200  0.61136000  1
  O  O35  1  0.58765900  0.92271500  0.58292400  1
  O  O36  1  0.38573800  0.79376700  0.18029300  1
  O  O37  1  0.46623300  0.38405200  0.11177100  1
  O  O38  1  0.74425900  0.35192500  0.67741200  1
  O  O39  1  0.75041300  0.15731900  0.31874600  1
  O  O40  1  0.91635400  0.57217100  0.41726000  1
  O  O41  1  0.85272400  0.79484500  0.35540500  1
  O  O42  1  0.84097600  0.51018100  0.08652200  1
  O  O43  1  0.88833200  0.29185900  0.16222900  1
  O  O44  1  0.97628400  0.90714800  0.13150300  1
