# generated using pymatgen
data_Li5Fe8(BO3)8
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   5.21751400
_cell_length_b   9.09128413
_cell_length_c   10.24685899
_cell_angle_alpha   88.93616535
_cell_angle_beta   89.65337797
_cell_angle_gamma   89.91033749
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Li5Fe8(BO3)8
_chemical_formula_sum   'Li5 Fe8 B8 O24'
_cell_volume   485.95532202
_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  0.14983800  0.17058800  0.65225200  1
  Li  Li1  1  0.32576300  0.32973900  0.40823000  1
  Li  Li2  1  0.34103900  0.31952200  0.91953900  1
  Li  Li3  1  0.65895000  0.67775100  0.66687300  1
  Li  Li4  1  0.68709400  0.67171100  0.16564700  1
  Fe  Fe5  1  0.14760700  0.83865100  0.62702700  1
  Fe  Fe6  1  0.18046200  0.49183400  0.13365900  1
  Fe  Fe7  1  0.32650900  0.98258300  0.87680900  1
  Fe  Fe8  1  0.32338300  0.66969400  0.38256800  1
  Fe  Fe9  1  0.66565300  0.34278400  0.63335800  1
  Fe  Fe10  1  0.67357300  0.01105100  0.12658900  1
  Fe  Fe11  1  0.83613300  0.15399600  0.37921000  1
  Fe  Fe12  1  0.83261800  0.50790300  0.88701500  1
  B  B13  1  0.16349200  0.50161400  0.62067500  1
  B  B14  1  0.17015200  0.83221600  0.12877400  1
  B  B15  1  0.34409500  0.00162900  0.37662700  1
  B  B16  1  0.32968300  0.66085900  0.87301600  1
  B  B17  1  0.66144400  0.00176800  0.63462500  1
  B  B18  1  0.67095400  0.33367200  0.12613800  1
  B  B19  1  0.82165400  0.49399700  0.37639900  1
  B  B20  1  0.82567500  0.16733700  0.87806700  1
  O  O21  1  0.09010500  0.49887100  0.35406800  1
  O  O22  1  0.08910700  0.15231900  0.86164100  1
  O  O23  1  0.19052500  0.78900100  0.84106400  1
  O  O24  1  0.23961000  0.86940100  0.42247900  1
  O  O25  1  0.21805600  0.13134100  0.39622100  1
  O  O26  1  0.20692300  0.53346700  0.91948100  1
  O  O27  1  0.28196400  0.36570300  0.61581100  1
  O  O28  1  0.32326600  0.94292100  0.07284900  1
  O  O29  1  0.30299900  0.62905100  0.58271200  1
  O  O30  1  0.29693000  0.70788100  0.18020800  1
  O  O31  1  0.41058900  0.32493700  0.11436100  1
  O  O32  1  0.40447100  0.01133800  0.68144500  1
  O  O33  1  0.58536400  0.99751000  0.31666700  1
  O  O34  1  0.58717500  0.66345900  0.85462200  1
  O  O35  1  0.69955400  0.29679500  0.84457400  1
  O  O36  1  0.70743400  0.36393300  0.41641100  1
  O  O37  1  0.67626600  0.61846200  0.35600000  1
  O  O38  1  0.67744500  0.05026800  0.92735800  1
  O  O39  1  0.79641400  0.46811500  0.10216600  1
  O  O40  1  0.77567000  0.86859000  0.62697400  1
  O  O41  1  0.78808100  0.13017900  0.59588600  1
  O  O42  1  0.81060300  0.20655900  0.15830500  1
  O  O43  1  0.90920000  0.84432100  0.13191200  1
  O  O44  1  0.91053500  0.51503900  0.65965000  1
