# generated using pymatgen
data_Li5Fe8(BO3)8
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   5.25138200
_cell_length_b   9.12913787
_cell_length_c   10.14163181
_cell_angle_alpha   88.09942862
_cell_angle_beta   89.24572777
_cell_angle_gamma   89.14734188
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Li5Fe8(BO3)8
_chemical_formula_sum   'Li5 Fe8 B8 O24'
_cell_volume   485.83548986
_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  0.17634200  0.16698400  0.15457200  1
  Li  Li1  1  0.32072800  0.33076100  0.42136300  1
  Li  Li2  1  0.33564600  0.32449900  0.90473800  1
  Li  Li3  1  0.65756600  0.67197800  0.65370800  1
  Li  Li4  1  0.83361600  0.82978500  0.39143800  1
  Fe  Fe5  1  0.16094200  0.84163300  0.63427200  1
  Fe  Fe6  1  0.17229600  0.50502800  0.13538600  1
  Fe  Fe7  1  0.31386700  0.99457900  0.87835900  1
  Fe  Fe8  1  0.34606900  0.66242700  0.37574900  1
  Fe  Fe9  1  0.67373300  0.33713200  0.63001800  1
  Fe  Fe10  1  0.66690400  0.99781000  0.12583700  1
  Fe  Fe11  1  0.83377600  0.15846500  0.38297600  1
  Fe  Fe12  1  0.83260500  0.49881700  0.88132500  1
  B  B13  1  0.16930600  0.50896500  0.63182100  1
  B  B14  1  0.16929500  0.83684200  0.13630900  1
  B  B15  1  0.33309500  0.99883600  0.37486200  1
  B  B16  1  0.32466900  0.65859500  0.86790800  1
  B  B17  1  0.66042500  0.99469900  0.62461900  1
  B  B18  1  0.66795800  0.32400100  0.11859200  1
  B  B19  1  0.83747100  0.49845800  0.38268600  1
  B  B20  1  0.83015900  0.17305000  0.88741600  1
  O  O21  1  0.09679400  0.48769600  0.34760600  1
  O  O22  1  0.08914900  0.17239500  0.88980000  1
  O  O23  1  0.19033200  0.78634700  0.83260800  1
  O  O24  1  0.20595100  0.87667900  0.42837700  1
  O  O25  1  0.21306000  0.13341100  0.35772200  1
  O  O26  1  0.19396200  0.53426300  0.91335400  1
  O  O27  1  0.29973300  0.38146900  0.61850800  1
  O  O28  1  0.30470700  0.96358500  0.09466800  1
  O  O29  1  0.28671600  0.64333500  0.59653600  1
  O  O30  1  0.29707500  0.70968100  0.16849300  1
  O  O31  1  0.40743700  0.32633200  0.11093900  1
  O  O32  1  0.40883800  0.98822800  0.66921100  1
  O  O33  1  0.58724900  0.98270600  0.33341500  1
  O  O34  1  0.58438100  0.64985200  0.85274300  1
  O  O35  1  0.69602900  0.30216700  0.84450600  1
  O  O36  1  0.70124900  0.37057600  0.41340500  1
  O  O37  1  0.72192400  0.63361900  0.39208600  1
  O  O38  1  0.68379000  0.05496400  0.93109500  1
  O  O39  1  0.81420300  0.44215600  0.07535800  1
  O  O40  1  0.79756000  0.86287600  0.61333800  1
  O  O41  1  0.76792500  0.12492500  0.58781700  1
  O  O42  1  0.79813500  0.19588900  0.16469500  1
  O  O43  1  0.90968100  0.84866900  0.14789700  1
  O  O44  1  0.91476600  0.51320400  0.67744000  1
