# generated using pymatgen
data_LiFe4(BO3)4
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   9.03237900
_cell_length_b   5.31760900
_cell_length_c   10.27883765
_cell_angle_alpha   89.63933341
_cell_angle_beta   90.00000000
_cell_angle_gamma   90.00000000
_symmetry_Int_Tables_number   1
_chemical_formula_structural   LiFe4(BO3)4
_chemical_formula_sum   'Li2 Fe8 B8 O24'
_cell_volume   493.68957350
_cell_formula_units_Z   2
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  0.99277100  0.64382200  0.82883000  1
  Li  Li1  1  0.00722900  0.64382200  0.32883000  1
  Fe  Fe2  1  0.83180900  0.86202200  0.11750400  1
  Fe  Fe3  1  0.82758100  0.15688800  0.37131300  1
  Fe  Fe4  1  0.65974400  0.65979000  0.87288900  1
  Fe  Fe5  1  0.66787700  0.33694400  0.62521300  1
  Fe  Fe6  1  0.34025600  0.65979000  0.37288900  1
  Fe  Fe7  1  0.16819100  0.86202200  0.61750400  1
  Fe  Fe8  1  0.33212300  0.33694400  0.12521300  1
  Fe  Fe9  1  0.17241900  0.15688800  0.87131300  1
  B  B10  1  0.82606800  0.83095800  0.62807900  1
  B  B11  1  0.67602500  0.66472400  0.37628300  1
  B  B12  1  0.83547500  0.16514000  0.86691400  1
  B  B13  1  0.66552200  0.35105000  0.12366400  1
  B  B14  1  0.32397500  0.66472400  0.87628300  1
  B  B15  1  0.33447800  0.35105000  0.62366400  1
  B  B16  1  0.17393200  0.83095800  0.12807900  1
  B  B17  1  0.16452500  0.16514000  0.36691400  1
  O  O18  1  0.96442500  0.74023100  0.64439600  1
  O  O19  1  0.82209200  0.91324600  0.90452800  1
  O  O20  1  0.97171800  0.28187100  0.87023400  1
  O  O21  1  0.80298300  0.79616800  0.33461100  1
  O  O22  1  0.70341700  0.69399400  0.67480700  1
  O  O23  1  0.78419200  0.22439700  0.18307200  1
  O  O24  1  0.79907000  0.06384000  0.56792000  1
  O  O25  1  0.69213400  0.57713600  0.05936400  1
  O  O26  1  0.53885600  0.75803600  0.36291800  1
  O  O27  1  0.70085600  0.42806000  0.43284900  1
  O  O28  1  0.71078200  0.29829800  0.82472000  1
  O  O29  1  0.46114400  0.75803600  0.86291800  1
  O  O30  1  0.52882400  0.24521600  0.12773200  1
  O  O31  1  0.29658300  0.69399400  0.17480700  1
  O  O32  1  0.30786600  0.57713600  0.55936400  1
  O  O33  1  0.47117600  0.24521600  0.62773200  1
  O  O34  1  0.29914400  0.42806000  0.93284900  1
  O  O35  1  0.17790800  0.91324600  0.40452800  1
  O  O36  1  0.19701700  0.79616800  0.83461100  1
  O  O37  1  0.28921800  0.29829800  0.32472000  1
  O  O38  1  0.21580800  0.22439700  0.68307200  1
  O  O39  1  0.03557500  0.74023100  0.14439600  1
  O  O40  1  0.20093000  0.06384000  0.06792000  1
  O  O41  1  0.02828200  0.28187100  0.37023400  1
