# generated using pymatgen
data_Li5Fe8(BO3)8
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   5.27622300
_cell_length_b   9.08401282
_cell_length_c   11.37150746
_cell_angle_alpha   113.17468936
_cell_angle_beta   102.45657138
_cell_angle_gamma   90.05904914
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Li5Fe8(BO3)8
_chemical_formula_sum   'Li5 Fe8 B8 O24'
_cell_volume   487.00855383
_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  0.17140300  0.83587900  0.65876800  1
  Li  Li1  1  0.61146600  0.94816700  0.90320900  1
  Li  Li2  1  0.92239800  0.56911000  0.16097200  1
  Li  Li3  1  0.11074000  0.44791600  0.89733600  1
  Li  Li4  1  0.42385200  0.07144600  0.16523300  1
  Fe  Fe5  1  0.40285800  0.72090600  0.13064800  1
  Fe  Fe6  1  0.09145500  0.76924000  0.87986000  1
  Fe  Fe7  1  0.84225900  0.85981000  0.37987600  1
  Fe  Fe8  1  0.65272900  0.64609700  0.62745100  1
  Fe  Fe9  1  0.34796400  0.36066900  0.38335700  1
  Fe  Fe10  1  0.15401900  0.15791000  0.63310200  1
  Fe  Fe11  1  0.90659600  0.22174400  0.12837100  1
  Fe  Fe12  1  0.60629400  0.28155700  0.87800800  1
  B  B13  1  0.63872800  0.98260300  0.62922000  1
  B  B14  1  0.90045400  0.89669600  0.12922700  1
  B  B15  1  0.14998500  0.48452100  0.62894600  1
  B  B16  1  0.40166000  0.39223000  0.12698900  1
  B  B17  1  0.84850800  0.51831500  0.37319700  1
  B  B18  1  0.60750300  0.60962200  0.88384800  1
  B  B19  1  0.34615100  0.02158900  0.37925600  1
  B  B20  1  0.09924200  0.10247400  0.87215200  1
  O  O21  1  0.14177100  0.88233900  0.09771200  1
  O  O22  1  0.47251000  0.88129000  0.34563600  1
  O  O23  1  0.23430400  0.97055600  0.86212000  1
  O  O24  1  0.52222300  0.85382500  0.63528000  1
  O  O25  1  0.88219200  0.97250100  0.59013600  1
  O  O26  1  0.81207600  0.79073300  0.17877900  1
  O  O27  1  0.24749300  0.51023000  0.11289500  1
  O  O28  1  0.05175600  0.63437900  0.66677200  1
  O  O29  1  0.69935500  0.72459700  0.84565000  1
  O  O30  1  0.62458400  0.52054100  0.41712300  1
  O  O31  1  0.94255400  0.65322800  0.36163800  1
  O  O32  1  0.36874300  0.62697900  0.92087200  1
  O  O33  1  0.64175800  0.37989800  0.09351600  1
  O  O34  1  0.36513000  0.46414600  0.57430600  1
  O  O35  1  0.31146700  0.28144300  0.17001800  1
  O  O36  1  0.97795900  0.38028200  0.33696000  1
  O  O37  1  0.75306300  0.48761100  0.88951200  1
  O  O38  1  0.19494600  0.21937900  0.83453800  1
  O  O39  1  0.12616200  0.02773800  0.43193300  1
  O  O40  1  0.43002800  0.14694100  0.35618900  1
  O  O41  1  0.04502300  0.35989600  0.64867100  1
  O  O42  1  0.74318700  0.01034500  0.11001100  1
  O  O43  1  0.52786900  0.12835100  0.66289400  1
  O  O44  1  0.86812700  0.12284600  0.91377200  1
