# generated using pymatgen
data_Li8Mn5Fe3(BO3)8
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   6.06155000
_cell_length_b   9.72430398
_cell_length_c   9.80697990
_cell_angle_alpha   65.02311669
_cell_angle_beta   79.50366096
_cell_angle_gamma   78.19838546
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Li8Mn5Fe3(BO3)8
_chemical_formula_sum   'Li8 Mn5 Fe3 B8 O24'
_cell_volume   509.92870448
_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  0.04619100  0.46713400  0.81588600  1
  Li  Li1  1  0.04611300  0.96671000  0.31579200  1
  Li  Li2  1  0.45448000  0.03305100  0.18733700  1
  Li  Li3  1  0.54624100  0.46718800  0.31594200  1
  Li  Li4  1  0.45361200  0.53327900  0.68584000  1
  Li  Li5  1  0.54408300  0.96532900  0.81490300  1
  Li  Li6  1  0.95399100  0.03308600  0.68468600  1
  Li  Li7  1  0.95346300  0.53382200  0.18606700  1
  Mn  Mn8  1  0.31209200  0.29375700  0.62407400  1
  Mn  Mn9  1  0.31184600  0.79164600  0.12558800  1
  Mn  Mn10  1  0.81282500  0.29332600  0.12705000  1
  Mn  Mn11  1  0.68563500  0.20568300  0.87372900  1
  Mn  Mn12  1  0.81145400  0.79227200  0.62512300  1
  Fe  Fe13  1  0.18450500  0.21027500  0.37115100  1
  Fe  Fe14  1  0.18485100  0.70940600  0.87059100  1
  Fe  Fe15  1  0.68541800  0.70957700  0.37067300  1
  B  B16  1  0.33386100  0.36819600  0.03927100  1
  B  B17  1  0.16807000  0.13269600  0.96288300  1
  B  B18  1  0.16571800  0.63298700  0.46201500  1
  B  B19  1  0.33500600  0.86727700  0.53776500  1
  B  B20  1  0.66602400  0.13241400  0.46193200  1
  B  B21  1  0.83306700  0.36814800  0.53600300  1
  B  B22  1  0.83607800  0.86473300  0.03774700  1
  B  B23  1  0.66605200  0.63287800  0.96166100  1
  O  O24  1  0.17850900  0.01571400  0.10549200  1
  O  O25  1  0.01296500  0.24562500  0.56119700  1
  O  O26  1  0.01589000  0.74327800  0.06216900  1
  O  O27  1  0.16434600  0.36387600  0.15744500  1
  O  O28  1  0.17478700  0.51677600  0.60559200  1
  O  O29  1  0.51353500  0.24607500  0.06481200  1
  O  O30  1  0.16782600  0.86285700  0.65703900  1
  O  O31  1  0.33939700  0.13576700  0.84676000  1
  O  O32  1  0.33863200  0.63498700  0.34739000  1
  O  O33  1  0.48470800  0.25319600  0.43353500  1
  O  O34  1  0.32135600  0.48590600  0.89828400  1
  O  O35  1  0.32104100  0.98674600  0.39752800  1
  O  O36  1  0.67570500  0.01591700  0.60525400  1
  O  O37  1  0.67602000  0.51685900  0.10524600  1
  O  O38  1  0.51413700  0.74499100  0.56074800  1
  O  O39  1  0.66198200  0.36431700  0.65262900  1
  O  O40  1  0.66845500  0.86257000  0.15610400  1
  O  O41  1  0.83956900  0.13448000  0.34758300  1
  O  O42  1  0.48416000  0.75321100  0.93396200  1
  O  O43  1  0.82341800  0.48730400  0.39530300  1
  O  O44  1  0.83878700  0.63519200  0.84684000  1
  O  O45  1  0.98650200  0.25353700  0.93577300  1
  O  O46  1  0.98437300  0.75386000  0.43394000  1
  O  O47  1  0.82322400  0.98208900  0.89567000  1
