# generated using pymatgen
data_Li5Fe8(BO3)8
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   5.28798800
_cell_length_b   9.03423714
_cell_length_c   11.35121449
_cell_angle_alpha   113.27587217
_cell_angle_beta   102.14573993
_cell_angle_gamma   89.84956589
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Li5Fe8(BO3)8
_chemical_formula_sum   'Li5 Fe8 B8 O24'
_cell_volume   485.03424038
_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  0.83298100  0.17771400  0.34511600  1
  Li  Li1  1  0.63805200  0.29464200  0.58902500  1
  Li  Li2  1  0.38556400  0.04406000  0.09183000  1
  Li  Li3  1  0.89052000  0.54502600  0.09443100  1
  Li  Li4  1  0.57404500  0.90695000  0.83821500  1
  Fe  Fe5  1  0.60094500  0.58977600  0.87267600  1
  Fe  Fe6  1  0.90222600  0.88842800  0.11655600  1
  Fe  Fe7  1  0.15276100  0.48561000  0.62472600  1
  Fe  Fe8  1  0.33575300  0.00471900  0.36403100  1
  Fe  Fe9  1  0.65667900  0.97777600  0.62232300  1
  Fe  Fe10  1  0.84455000  0.51988700  0.36177100  1
  Fe  Fe11  1  0.08997600  0.10818200  0.87390700  1
  Fe  Fe12  1  0.39234300  0.40073600  0.12047300  1
  B  B13  1  0.36436200  0.35228900  0.37435200  1
  B  B14  1  0.10352800  0.77529800  0.87170400  1
  B  B15  1  0.84453500  0.85566100  0.36975600  1
  B  B16  1  0.60063300  0.26077600  0.87424300  1
  B  B17  1  0.14596300  0.14879900  0.62042800  1
  B  B18  1  0.39310800  0.72987900  0.11984500  1
  B  B19  1  0.65294300  0.63673000  0.61807200  1
  B  B20  1  0.90021400  0.23121400  0.13121000  1
  O  O21  1  0.86547200  0.78515100  0.90794500  1
  O  O22  1  0.53272300  0.52048900  0.64694600  1
  O  O23  1  0.76326700  0.11053900  0.14222400  1
  O  O24  1  0.49301700  0.22785000  0.38995200  1
  O  O25  1  0.11819700  0.38180300  0.40771100  1
  O  O26  1  0.19896400  0.62400200  0.81241500  1
  O  O27  1  0.73816600  0.39096200  0.87902100  1
  O  O28  1  0.94545500  0.96398400  0.32789500  1
  O  O29  1  0.30436800  0.88555300  0.15993800  1
  O  O30  1  0.38793700  0.12220400  0.58937300  1
  O  O31  1  0.01984900  0.27976900  0.60864300  1
  O  O32  1  0.62880000  0.70859200  0.07988700  1
  O  O33  1  0.38216500  0.27521400  0.92418900  1
  O  O34  1  0.63880500  0.89893300  0.43160400  1
  O  O35  1  0.68812100  0.10375000  0.82134900  1
  O  O36  1  0.02784600  0.04588000  0.65950500  1
  O  O37  1  0.24913800  0.60421400  0.11812600  1
  O  O38  1  0.80627000  0.38666900  0.16605300  1
  O  O39  1  0.86970000  0.59246900  0.56254400  1
  O  O40  1  0.56970800  0.78538900  0.64637800  1
  O  O41  1  0.94372800  0.71029100  0.35050400  1
  O  O42  1  0.25206800  0.91210100  0.89373500  1
  O  O43  1  0.47414400  0.45753700  0.33288400  1
  O  O44  1  0.13151200  0.20909300  0.09092000  1
