# generated using pymatgen
data_Li3Fe8(BO3)8
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   5.22017900
_cell_length_b   9.15205480
_cell_length_c   10.13627760
_cell_angle_alpha   89.09782868
_cell_angle_beta   89.57759269
_cell_angle_gamma   89.33641737
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Li3Fe8(BO3)8
_chemical_formula_sum   'Li3 Fe8 B8 O24'
_cell_volume   484.15932981
_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  0.15200200  0.17089300  0.64770200  1
  Li  Li1  1  0.33489100  0.31820500  0.91172800  1
  Li  Li2  1  0.68205800  0.67040200  0.15093700  1
  Fe  Fe3  1  0.17101800  0.82855800  0.63109200  1
  Fe  Fe4  1  0.18645600  0.48694200  0.13636000  1
  Fe  Fe5  1  0.32065300  0.98799500  0.87958100  1
  Fe  Fe6  1  0.32546700  0.66019300  0.37972700  1
  Fe  Fe7  1  0.64928600  0.34923900  0.62400900  1
  Fe  Fe8  1  0.67102900  0.01188900  0.12546300  1
  Fe  Fe9  1  0.83071800  0.16603800  0.37833000  1
  Fe  Fe10  1  0.83126800  0.50498600  0.87447200  1
  B  B11  1  0.14754800  0.49924100  0.62967000  1
  B  B12  1  0.17048700  0.83298400  0.13315600  1
  B  B13  1  0.33806500  0.99805300  0.38141200  1
  B  B14  1  0.33339500  0.65739800  0.87571700  1
  B  B15  1  0.66996800  0.00228900  0.62666000  1
  B  B16  1  0.67284600  0.33172900  0.12322400  1
  B  B17  1  0.83319900  0.49549600  0.37152500  1
  B  B18  1  0.83149000  0.17631500  0.87982200  1
  O  O19  1  0.09233900  0.50383000  0.34318400  1
  O  O20  1  0.08991300  0.16623000  0.85634800  1
  O  O21  1  0.21230400  0.78064300  0.82347800  1
  O  O22  1  0.25961200  0.86184800  0.43037900  1
  O  O23  1  0.17906400  0.11572400  0.38838000  1
  O  O24  1  0.19068100  0.53474700  0.91419800  1
  O  O25  1  0.27576500  0.36932300  0.63307900  1
  O  O26  1  0.32357100  0.94484900  0.08532400  1
  O  O27  1  0.26087900  0.62666400  0.57740100  1
  O  O28  1  0.29391400  0.70496100  0.17774800  1
  O  O29  1  0.41724000  0.32316900  0.10272300  1
  O  O30  1  0.40738700  0.99936200  0.66160400  1
  O  O31  1  0.58681000  0.01096600  0.32892300  1
  O  O32  1  0.59141000  0.65540700  0.89551000  1
  O  O33  1  0.69647700  0.30615200  0.84678200  1
  O  O34  1  0.73576900  0.36488300  0.41896600  1
  O  O35  1  0.67517700  0.61393200  0.34881100  1
  O  O36  1  0.68881600  0.06240800  0.93336800  1
  O  O37  1  0.80797700  0.45862300  0.08839400  1
  O  O38  1  0.82232500  0.88150400  0.63595000  1
  O  O39  1  0.77357100  0.13557100  0.58210900  1
  O  O40  1  0.80701500  0.20818500  0.17458800  1
  O  O41  1  0.90683300  0.84587100  0.13406000  1
  O  O42  1  0.89904200  0.51078900  0.67951200  1
