# generated using pymatgen
data_Li5Fe8(BO3)8
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   5.24495700
_cell_length_b   9.06812754
_cell_length_c   10.22098532
_cell_angle_alpha   89.01247196
_cell_angle_beta   89.58822414
_cell_angle_gamma   89.50563833
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Li5Fe8(BO3)8
_chemical_formula_sum   'Li5 Fe8 B8 O24'
_cell_volume   486.02754116
_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  0.15387500  0.17188400  0.66143700  1
  Li  Li1  1  0.18891900  0.16237200  0.16706500  1
  Li  Li2  1  0.33679300  0.32273600  0.90609300  1
  Li  Li3  1  0.68324100  0.66558600  0.15063700  1
  Li  Li4  1  0.82501700  0.82889500  0.41069000  1
  Fe  Fe5  1  0.17524200  0.82701000  0.63444200  1
  Fe  Fe6  1  0.18368500  0.49830400  0.13342500  1
  Fe  Fe7  1  0.32251800  0.98917400  0.88509700  1
  Fe  Fe8  1  0.33385200  0.64892600  0.38153500  1
  Fe  Fe9  1  0.64938000  0.35367800  0.62434600  1
  Fe  Fe10  1  0.68629200  0.99708000  0.11890000  1
  Fe  Fe11  1  0.81677900  0.17209700  0.38052400  1
  Fe  Fe12  1  0.83119900  0.50591500  0.87566500  1
  B  B13  1  0.15123600  0.49852400  0.63538100  1
  B  B14  1  0.17630900  0.83323200  0.13298600  1
  B  B15  1  0.32239300  0.99536700  0.38292500  1
  B  B16  1  0.33295800  0.65870200  0.87575200  1
  B  B17  1  0.67211600  0.00272900  0.62221000  1
  B  B18  1  0.66971400  0.33195800  0.12466900  1
  B  B19  1  0.84047800  0.50058000  0.37136600  1
  B  B20  1  0.82802900  0.17276800  0.87657500  1
  O  O21  1  0.09171600  0.49222100  0.33182300  1
  O  O22  1  0.09037900  0.16781100  0.86053100  1
  O  O23  1  0.20731500  0.78296500  0.82556000  1
  O  O24  1  0.21867500  0.86368700  0.43025900  1
  O  O25  1  0.16834500  0.11551600  0.35727300  1
  O  O26  1  0.19070700  0.53475000  0.91610000  1
  O  O27  1  0.27712700  0.36581100  0.63605800  1
  O  O28  1  0.29560500  0.96543600  0.09491700  1
  O  O29  1  0.26872100  0.62657800  0.58819700  1
  O  O30  1  0.32341000  0.70852600  0.16221200  1
  O  O31  1  0.40966100  0.31998000  0.10778200  1
  O  O32  1  0.41318500  0.99960900  0.65788100  1
  O  O33  1  0.58539100  0.00325100  0.35558300  1
  O  O34  1  0.59009900  0.65715700  0.88884000  1
  O  O35  1  0.69565600  0.30653100  0.84854400  1
  O  O36  1  0.72032600  0.37210900  0.41864700  1
  O  O37  1  0.70931600  0.63260500  0.36491700  1
  O  O38  1  0.68952400  0.05351600  0.91868300  1
  O  O39  1  0.79807600  0.45989000  0.08556400  1
  O  O40  1  0.81827300  0.87639100  0.61651900  1
  O  O41  1  0.78625300  0.13810000  0.58571600  1
  O  O42  1  0.80846000  0.21154200  0.17826200  1
  O  O43  1  0.91525400  0.82685800  0.14228200  1
  O  O44  1  0.90202200  0.50884900  0.68209100  1
