# generated using pymatgen
data_Li5Fe8(BO3)8
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   5.27073200
_cell_length_b   9.08123862
_cell_length_c   11.30262472
_cell_angle_alpha   113.05888185
_cell_angle_beta   102.77246269
_cell_angle_gamma   89.70714871
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Li5Fe8(BO3)8
_chemical_formula_sum   'Li5 Fe8 B8 O24'
_cell_volume   483.45088757
_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  0.16688800  0.84083500  0.65562300  1
  Li  Li1  1  0.61021900  0.95405900  0.91493400  1
  Li  Li2  1  0.93325000  0.56910300  0.16797900  1
  Li  Li3  1  0.11295200  0.44516300  0.90172400  1
  Li  Li4  1  0.65597400  0.32657000  0.63712600  1
  Fe  Fe5  1  0.41271200  0.73088300  0.13343200  1
  Fe  Fe6  1  0.09526800  0.76966500  0.87747300  1
  Fe  Fe7  1  0.84626200  0.86076200  0.38132300  1
  Fe  Fe8  1  0.64551000  0.65767300  0.62347700  1
  Fe  Fe9  1  0.35098000  0.35273800  0.37225300  1
  Fe  Fe10  1  0.14837900  0.15752300  0.62636700  1
  Fe  Fe11  1  0.90184400  0.21886200  0.13744300  1
  Fe  Fe12  1  0.60062600  0.27687900  0.88274000  1
  B  B13  1  0.64598200  0.98719800  0.63044200  1
  B  B14  1  0.89382800  0.88476400  0.12039700  1
  B  B15  1  0.15249600  0.48879800  0.63467100  1
  B  B16  1  0.39928400  0.40052000  0.12797500  1
  B  B17  1  0.84957400  0.51868300  0.37747800  1
  B  B18  1  0.60463400  0.60466700  0.87195600  1
  B  B19  1  0.35492400  0.02625900  0.38297900  1
  B  B20  1  0.09493300  0.10229500  0.87875900  1
  O  O21  1  0.11627100  0.84847500  0.06964600  1
  O  O22  1  0.47678500  0.88422500  0.34085800  1
  O  O23  1  0.21753100  0.96048300  0.86109200  1
  O  O24  1  0.51232600  0.86464000  0.63859000  1
  O  O25  1  0.88107900  0.96012300  0.58650200  1
  O  O26  1  0.81503000  0.78193600  0.17526000  1
  O  O27  1  0.24951500  0.51755500  0.10547900  1
  O  O28  1  0.05871900  0.64359900  0.67416700  1
  O  O29  1  0.71090700  0.72513400  0.84308400  1
  O  O30  1  0.62395800  0.52251600  0.42200400  1
  O  O31  1  0.94168700  0.65080500  0.36323300  1
  O  O32  1  0.36534000  0.62696300  0.90818700  1
  O  O33  1  0.64425800  0.38249100  0.09851300  1
  O  O34  1  0.38363700  0.46703200  0.59114600  1
  O  O35  1  0.29918200  0.30012200  0.17682700  1
  O  O36  1  0.98034800  0.38096400  0.34744100  1
  O  O37  1  0.73296900  0.47275700  0.86575200  1
  O  O38  1  0.20429300  0.21803200  0.84840600  1
  O  O39  1  0.12052700  0.02268100  0.41935800  1
  O  O40  1  0.46715900  0.16647000  0.39300700  1
  O  O41  1  0.01976600  0.36823100  0.64517800  1
  O  O42  1  0.75383800  0.00563600  0.10968900  1
  O  O43  1  0.55477300  0.13882800  0.66616000  1
  O  O44  1  0.86413200  0.12128600  0.91982900  1
