# generated using pymatgen
data_Li5Fe8(BO3)8
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   5.25743700
_cell_length_b   9.08977118
_cell_length_c   11.35071626
_cell_angle_alpha   113.16161300
_cell_angle_beta   103.34945012
_cell_angle_gamma   90.16822337
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Li5Fe8(BO3)8
_chemical_formula_sum   'Li5 Fe8 B8 O24'
_cell_volume   482.56969964
_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  0.29515800  0.27923100  0.90186800  1
  Li  Li1  1  0.48777100  0.51055900  0.66533700  1
  Li  Li2  1  0.27201600  0.24719000  0.16531600  1
  Li  Li3  1  0.97868200  0.00443500  0.65906900  1
  Li  Li4  1  0.77599400  0.74949500  0.16736400  1
  Fe  Fe5  1  0.01608600  0.35263400  0.38240400  1
  Fe  Fe6  1  0.26920300  0.92545900  0.87985700  1
  Fe  Fe7  1  0.46688900  0.15847200  0.62737400  1
  Fe  Fe8  1  0.25288000  0.56332100  0.13207500  1
  Fe  Fe9  1  0.77235900  0.44910200  0.88304900  1
  Fe  Fe10  1  0.51503100  0.85423600  0.38265600  1
  Fe  Fe11  1  0.96051500  0.65099200  0.62917500  1
  Fe  Fe12  1  0.75139600  0.05777300  0.12621600  1
  B  B13  1  0.01919200  0.68328000  0.37642500  1
  B  B14  1  0.27066800  0.59938900  0.87527200  1
  B  B15  1  0.47397100  0.81664800  0.62972400  1
  B  B16  1  0.23762400  0.89563500  0.12906500  1
  B  B17  1  0.51875200  0.18291300  0.37415100  1
  B  B18  1  0.76286100  0.10389400  0.87617500  1
  B  B19  1  0.97443700  0.31556900  0.62854700  1
  B  B20  1  0.73728200  0.39713300  0.12750000  1
  O  O21  1  0.02257100  0.08558600  0.86572100  1
  O  O22  1  0.11989200  0.71296900  0.84275600  1
  O  O23  1  0.16779000  0.49753100  0.92144900  1
  O  O24  1  0.10186200  0.18993800  0.64251100  1
  O  O25  1  0.09111200  0.41807500  0.58343900  1
  O  O26  1  0.24229400  0.85210700  0.67473300  1
  O  O27  1  0.25674300  0.67968200  0.34150800  1
  O  O28  1  0.51582000  0.59143200  0.85603600  1
  O  O29  1  0.62659700  0.21699100  0.84197200  1
  O  O30  1  0.44890600  0.07301400  0.42049200  1
  O  O31  1  0.35178800  0.29268500  0.35700700  1
  O  O32  1  0.63718900  0.00865500  0.92025800  1
  O  O33  1  0.33759900  0.00169500  0.08251800  1
  O  O34  1  0.59164400  0.68410600  0.62873000  1
  O  O35  1  0.58278700  0.92281800  0.58626700  1
  O  O36  1  0.41017100  0.79910800  0.17297800  1
  O  O37  1  0.46809100  0.37609600  0.11061500  1
  O  O38  1  0.73610500  0.34783400  0.66021100  1
  O  O39  1  0.75493300  0.17815300  0.33828700  1
  O  O40  1  0.95102900  0.57319400  0.42306800  1
  O  O41  1  0.85474100  0.79607900  0.36388700  1
  O  O42  1  0.84569000  0.51479300  0.09873300  1
  O  O43  1  0.90218800  0.29748900  0.17180100  1
  O  O44  1  0.98232000  0.88998400  0.13275600  1
