# generated using pymatgen data_Li8Mn5Fe3(BO3)8 _symmetry_space_group_name_H-M 'P 1' _cell_length_a 5.24558400 _cell_length_b 6.04953980 _cell_length_c 16.18721499 _cell_angle_alpha 82.08500739 _cell_angle_beta 89.01367490 _cell_angle_gamma 89.01177461 _symmetry_Int_Tables_number 1 _chemical_formula_structural Li8Mn5Fe3(BO3)8 _chemical_formula_sum 'Li8 Mn5 Fe3 B8 O24' _cell_volume 508.64854325 _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 0.84992200 0.06299700 0.38936800 1.0 Li Li1 1 0.15065700 0.43560400 0.10938300 1.0 Li Li2 1 0.64995500 0.18756100 0.85946900 1.0 Li Li3 1 0.34928700 0.31147700 0.64078600 1.0 Li Li4 1 0.65064400 0.68768500 0.35841300 1.0 Li Li5 1 0.34923600 0.81244800 0.14128300 1.0 Li Li6 1 0.84941300 0.56430500 0.89102600 1.0 Li Li7 1 0.15230800 0.93636800 0.61007700 1.0 Mn Mn8 1 0.66754400 0.27347000 0.04097400 1.0 Mn Mn9 1 0.16663700 0.52114900 0.29102800 1.0 Mn Mn10 1 0.83435800 0.47681100 0.71051000 1.0 Mn Mn11 1 0.66596300 0.77508300 0.53910000 1.0 Mn Mn12 1 0.33221200 0.72686200 0.95914000 1.0 Fe Fe13 1 0.16025300 0.02525800 0.79055700 1.0 Fe Fe14 1 0.33126200 0.22460800 0.46209700 1.0 Fe Fe15 1 0.84087100 0.97386500 0.20925100 1.0 B B16 1 0.33113500 0.03728900 0.29771900 1.0 B B17 1 0.82738900 0.28587500 0.54652400 1.0 B B18 1 0.67086400 0.46285800 0.20257200 1.0 B B19 1 0.16924300 0.21477700 0.95090500 1.0 B B20 1 0.83043600 0.78537500 0.04907800 1.0 B B21 1 0.32933700 0.53698900 0.79729600 1.0 B B22 1 0.17056300 0.71480400 0.45221600 1.0 B B23 1 0.67022000 0.96340000 0.70310100 1.0 O O24 1 0.59044100 0.01278700 0.30845200 1.0 O O25 1 0.18595500 0.16898800 0.34633000 1.0 O O26 1 0.70634500 0.17034800 0.48975500 1.0 O O27 1 0.28761000 0.33059400 0.00764700 1.0 O O28 1 0.79338000 0.07799400 0.75999200 1.0 O O29 1 0.82064600 0.32701000 0.15671500 1.0 O O30 1 0.31761300 0.08112200 0.90348900 1.0 O O31 1 0.08771600 0.26346500 0.55816300 1.0 O O32 1 0.41159300 0.48565500 0.18875500 1.0 O O33 1 0.90992700 0.23603800 0.93849800 1.0 O O34 1 0.68163000 0.41838100 0.59461600 1.0 O O35 1 0.21455100 0.41805500 0.74081000 1.0 O O36 1 0.78737000 0.58150700 0.25877000 1.0 O O37 1 0.32068000 0.57900400 0.40667300 1.0 O O38 1 0.09000600 0.76442700 0.06148500 1.0 O O39 1 0.58835800 0.51478900 0.81159100 1.0 O O40 1 0.91127100 0.73636700 0.43818400 1.0 O O41 1 0.68163800 0.91885800 0.09649000 1.0 O O42 1 0.17872600 0.67263500 0.84294000 1.0 O O43 1 0.20684600 0.92430300 0.24072100 1.0 O O44 1 0.71232400 0.66973700 0.99215400 1.0 O O45 1 0.28559500 0.83301000 0.50904500 1.0 O O46 1 0.81844900 0.83118100 0.65525300 1.0 O O47 1 0.41161900 0.98683200 0.69159800 1.0