# generated using pymatgen
data_LiFe2(BO3)2
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   5.24445000
_cell_length_b   9.08336185
_cell_length_c   10.17436491
_cell_angle_alpha   89.48007039
_cell_angle_beta   88.81761778
_cell_angle_gamma   89.65272346
_symmetry_Int_Tables_number   1
_chemical_formula_structural   LiFe2(BO3)2
_chemical_formula_sum   'Li4 Fe8 B8 O24'
_cell_volume   484.54711844
_cell_formula_units_Z   4
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  0.14998000  0.17735900  0.66680100  1
  Li  Li1  1  0.19036100  0.16474000  0.16029000  1
  Li  Li2  1  0.32972100  0.33251300  0.40218200  1
  Li  Li3  1  0.68479300  0.66392800  0.15335500  1
  Fe  Fe4  1  0.16504600  0.83347400  0.63398300  1
  Fe  Fe5  1  0.18810700  0.49329900  0.12345000  1
  Fe  Fe6  1  0.32501000  0.99330300  0.87826600  1
  Fe  Fe7  1  0.32233200  0.66831400  0.37836900  1
  Fe  Fe8  1  0.65327400  0.34629100  0.63471000  1
  Fe  Fe9  1  0.67602700  0.00240200  0.12425700  1
  Fe  Fe10  1  0.83277800  0.15102300  0.38731800  1
  Fe  Fe11  1  0.82868100  0.49889000  0.87702700  1
  B  B12  1  0.15283100  0.50014000  0.62174000  1
  B  B13  1  0.16856100  0.83561100  0.13383400  1
  B  B14  1  0.34280900  0.99811500  0.37379300  1
  B  B15  1  0.33046300  0.66130600  0.87642100  1
  B  B16  1  0.67157900  0.00294100  0.63067500  1
  B  B17  1  0.67869300  0.32774700  0.12936600  1
  B  B18  1  0.82189300  0.49409900  0.37309800  1
  B  B19  1  0.82679200  0.16972200  0.88014200  1
  O  O20  1  0.08703400  0.50025200  0.34569900  1
  O  O21  1  0.08036800  0.15427200  0.85547100  1
  O  O22  1  0.21988000  0.78686700  0.82183800  1
  O  O23  1  0.23746700  0.87025600  0.42829100  1
  O  O24  1  0.20800100  0.12854400  0.36974300  1
  O  O25  1  0.17294400  0.54972100  0.92415500  1
  O  O26  1  0.27972400  0.36830300  0.60329200  1
  O  O27  1  0.30498800  0.96086000  0.09397800  1
  O  O28  1  0.26230400  0.63166800  0.57407700  1
  O  O29  1  0.30266600  0.71128900  0.17750000  1
  O  O30  1  0.41923300  0.32319500  0.14507800  1
  O  O31  1  0.40573000  0.00361400  0.65736100  1
  O  O32  1  0.58767800  0.99481300  0.31911700  1
  O  O33  1  0.58673900  0.65079800  0.89168200  1
  O  O34  1  0.70185700  0.30147900  0.84644800  1
  O  O35  1  0.71341100  0.36478400  0.41927100  1
  O  O36  1  0.67101500  0.61497500  0.34820200  1
  O  O37  1  0.68155300  0.05549900  0.93601600  1
  O  O38  1  0.80249700  0.45661000  0.08888600  1
  O  O39  1  0.81515400  0.87808200  0.63692800  1
  O  O40  1  0.78798100  0.13601500  0.59531900  1
  O  O41  1  0.82511900  0.20121000  0.15979300  1
  O  O42  1  0.90816400  0.83685300  0.12976100  1
  O  O43  1  0.91470400  0.50571600  0.68189600  1
