# generated using pymatgen data_Li9Fe4(BO3)8 _symmetry_space_group_name_H-M 'P 1' _cell_length_a 8.30593200 _cell_length_b 8.35491832 _cell_length_c 8.83675813 _cell_angle_alpha 68.24712049 _cell_angle_beta 68.18926459 _cell_angle_gamma 74.48215663 _symmetry_Int_Tables_number 1 _chemical_formula_structural Li9Fe4(BO3)8 _chemical_formula_sum 'Li9 Fe4 B8 O24' _cell_volume 522.76206415 _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 0.60011900 0.76292000 0.89382600 1.0 Li Li1 1 0.24623100 0.92999700 0.41687900 1.0 Li Li2 1 0.89594600 0.73738300 0.10267600 1.0 Li Li3 1 0.24329900 0.57874700 0.58086300 1.0 Li Li4 1 0.74973400 0.43006800 0.41858800 1.0 Li Li5 1 0.44477100 0.27271600 0.76053900 1.0 Li Li6 1 0.09416300 0.26528600 0.90053700 1.0 Li Li7 1 0.76009200 0.06976200 0.57747100 1.0 Li Li8 1 0.40028700 0.23327300 0.12473000 1.0 Fe Fe9 1 0.25424800 0.90574100 0.77931600 1.0 Fe Fe10 1 0.75861600 0.40869400 0.77599700 1.0 Fe Fe11 1 0.24172000 0.58924600 0.22403600 1.0 Fe Fe12 1 0.74367900 0.09097700 0.22351000 1.0 B B13 1 0.96586900 0.80020600 0.39837400 1.0 B B14 1 0.52964900 0.69931200 0.59965900 1.0 B B15 1 0.30500400 0.95528300 0.05899800 1.0 B B16 1 0.21010800 0.54076800 0.93077000 1.0 B B17 1 0.79557200 0.45249700 0.06632100 1.0 B B18 1 0.69588600 0.05144000 0.93082300 1.0 B B19 1 0.46596700 0.30089900 0.41425700 1.0 B B20 1 0.03347200 0.20103400 0.60165500 1.0 O O21 1 0.70834000 0.96279200 0.82691200 1.0 O O22 1 0.82402600 0.93419600 0.40627500 1.0 O O23 1 0.48970200 0.79214900 0.71457500 1.0 O O24 1 0.76107700 0.97394800 0.07009200 1.0 O O25 1 0.12780900 0.71566700 0.90527200 1.0 O O26 1 0.73698800 0.53393800 0.92310600 1.0 O O27 1 0.42583200 0.74050700 0.49917400 1.0 O O28 1 0.07105900 0.76630000 0.49569700 1.0 O O29 1 0.66716800 0.56115700 0.59740500 1.0 O O30 1 0.37013600 0.77789700 0.08563600 1.0 O O31 1 0.23841300 0.44958800 0.82205300 1.0 O O32 1 0.00522500 0.70657400 0.28422300 1.0 O O33 1 0.99397000 0.29277100 0.71846700 1.0 O O34 1 0.78082600 0.53797600 0.17364000 1.0 O O35 1 0.61277700 0.22793900 0.90064800 1.0 O O36 1 0.92754500 0.24110800 0.50345700 1.0 O O37 1 0.32518200 0.43790100 0.40821600 1.0 O O38 1 0.55526500 0.26301200 0.52766500 1.0 O O39 1 0.26250400 0.46157700 0.07849100 1.0 O O40 1 0.87508800 0.27757100 0.09080300 1.0 O O41 1 0.25804800 0.04633700 0.90828800 1.0 O O42 1 0.51405300 0.20965700 0.29487500 1.0 O O43 1 0.17269100 0.06448600 0.59627400 1.0 O O44 1 0.29224100 0.03821900 0.16784700 1.0