# generated using pymatgen
data_Li3Fe8(BO3)8
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   5.29401900
_cell_length_b   9.10230230
_cell_length_c   11.36653019
_cell_angle_alpha   113.11869855
_cell_angle_beta   103.38605851
_cell_angle_gamma   89.75783162
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Li3Fe8(BO3)8
_chemical_formula_sum   'Li3 Fe8 B8 O24'
_cell_volume   487.75110341
_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  0.81190000  0.17414800  0.33412100  1
  Li  Li1  1  0.07491700  0.40773100  0.84033900  1
  Li  Li2  1  0.57327300  0.90610600  0.83667700  1
  Fe  Fe3  1  0.60050000  0.59028400  0.87411900  1
  Fe  Fe4  1  0.90548900  0.88825500  0.11894300  1
  Fe  Fe5  1  0.16140300  0.48190800  0.62245700  1
  Fe  Fe6  1  0.34526400  0.02036400  0.37351500  1
  Fe  Fe7  1  0.65653200  0.98159800  0.62145100  1
  Fe  Fe8  1  0.84645300  0.52755000  0.36891100  1
  Fe  Fe9  1  0.09915300  0.09180300  0.87563600  1
  Fe  Fe10  1  0.39491400  0.39598600  0.11865700  1
  B  B11  1  0.36047400  0.35614000  0.37019400  1
  B  B12  1  0.10205600  0.76557200  0.87117100  1
  B  B13  1  0.84862700  0.85690300  0.37170200  1
  B  B14  1  0.60293400  0.26337600  0.87211400  1
  B  B15  1  0.15284900  0.14559100  0.62820700  1
  B  B16  1  0.39586000  0.72840900  0.11914400  1
  B  B17  1  0.65566200  0.64317300  0.62288600  1
  B  B18  1  0.90284100  0.23458400  0.12925900  1
  O  O19  1  0.87296700  0.78800200  0.91721200  1
  O  O20  1  0.52865000  0.54237000  0.66088400  1
  O  O21  1  0.81781700  0.10234400  0.14365000  1
  O  O22  1  0.48091300  0.22563200  0.37039700  1
  O  O23  1  0.12259300  0.38813000  0.41262700  1
  O  O24  1  0.18179700  0.60858200  0.82300900  1
  O  O25  1  0.73745400  0.38684700  0.86750800  1
  O  O26  1  0.93785700  0.96247700  0.32318800  1
  O  O27  1  0.27481600  0.86886900  0.16235500  1
  O  O28  1  0.36510300  0.09490700  0.57798500  1
  O  O29  1  0.06883200  0.29344600  0.64102700  1
  O  O30  1  0.62027600  0.73115500  0.07587200  1
  O  O31  1  0.37371900  0.28731500  0.91822700  1
  O  O32  1  0.64000200  0.89997900  0.42932500  1
  O  O33  1  0.68580100  0.10825600  0.83001100  1
  O  O34  1  0.02422400  0.05007100  0.66976200  1
  O  O35  1  0.29057500  0.58892800  0.11352000  1
  O  O36  1  0.77501500  0.37519400  0.17023500  1
  O  O37  1  0.86473200  0.58935300  0.56521700  1
  O  O38  1  0.58364500  0.79364500  0.64752200  1
  O  O39  1  0.95649000  0.71758800  0.36207500  1
  O  O40  1  0.24124300  0.88925000  0.87042000  1
  O  O41  1  0.46153700  0.46431700  0.32760400  1
  O  O42  1  0.11588900  0.23480600  0.07906900  1
