# generated using pymatgen
data_Li5Fe8(BO3)8
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   5.25618800
_cell_length_b   9.08572401
_cell_length_c   11.36921649
_cell_angle_alpha   113.29222810
_cell_angle_beta   102.85744954
_cell_angle_gamma   89.91080603
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Li5Fe8(BO3)8
_chemical_formula_sum   'Li5 Fe8 B8 O24'
_cell_volume   483.92657952
_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  0.16756900  0.84121600  0.66201300  1
  Li  Li1  1  0.60763100  0.94354900  0.90425800  1
  Li  Li2  1  0.92837300  0.57374400  0.16651100  1
  Li  Li3  1  0.67647400  0.34585000  0.66341200  1
  Li  Li4  1  0.42481600  0.06726000  0.16625400  1
  Fe  Fe5  1  0.39968700  0.71854100  0.12993700  1
  Fe  Fe6  1  0.09115000  0.76145800  0.87937100  1
  Fe  Fe7  1  0.84595000  0.86123400  0.38184400  1
  Fe  Fe8  1  0.64947900  0.65722000  0.62529400  1
  Fe  Fe9  1  0.34908200  0.35979900  0.38336600  1
  Fe  Fe10  1  0.14998700  0.16159800  0.62974500  1
  Fe  Fe11  1  0.90921300  0.22076900  0.13052200  1
  Fe  Fe12  1  0.59774800  0.27673400  0.88052600  1
  B  B13  1  0.64892000  0.98716100  0.63245600  1
  B  B14  1  0.89969900  0.89565500  0.12949900  1
  B  B15  1  0.14352800  0.48364800  0.62446100  1
  B  B16  1  0.39954600  0.39215600  0.12802400  1
  B  B17  1  0.84754800  0.51964000  0.37448100  1
  B  B18  1  0.59229400  0.60741400  0.87629700  1
  B  B19  1  0.34693100  0.01955300  0.37637000  1
  B  B20  1  0.10733000  0.10311500  0.87570200  1
  O  O21  1  0.14066200  0.88427300  0.09913900  1
  O  O22  1  0.47716600  0.88144100  0.34291900  1
  O  O23  1  0.22297100  0.96706300  0.86688500  1
  O  O24  1  0.51380200  0.86609500  0.64079700  1
  O  O25  1  0.88064100  0.96099800  0.58672400  1
  O  O26  1  0.81143700  0.78848900  0.17664600  1
  O  O27  1  0.25921800  0.51829200  0.13201900  1
  O  O28  1  0.05814900  0.63684300  0.66124800  1
  O  O29  1  0.70141000  0.71727100  0.83800000  1
  O  O30  1  0.62535200  0.52107600  0.41995200  1
  O  O31  1  0.93754500  0.65114900  0.35967300  1
  O  O32  1  0.38310900  0.64645300  0.93120400  1
  O  O33  1  0.63414800  0.37327900  0.08242800  1
  O  O34  1  0.38219300  0.45756400  0.58285100  1
  O  O35  1  0.31855900  0.27772300  0.17009200  1
  O  O36  1  0.97850500  0.38095300  0.33739600  1
  O  O37  1  0.69491700  0.46177900  0.85545000  1
  O  O38  1  0.22438900  0.21534500  0.84307200  1
  O  O39  1  0.12634400  0.02362900  0.42446600  1
  O  O40  1  0.43866900  0.14952900  0.36016500  1
  O  O41  1  0.00673500  0.35986200  0.62859000  1
  O  O42  1  0.74215900  0.01072900  0.10934500  1
  O  O43  1  0.56470900  0.14316200  0.67352700  1
  O  O44  1  0.86645200  0.13224100  0.91341800  1
