# generated using pymatgen data_Li5Mn6(BO3)6 _symmetry_space_group_name_H-M 'P 1' _cell_length_a 8.82749934 _cell_length_b 8.82749934 _cell_length_c 14.38452104 _cell_angle_alpha 89.44451561 _cell_angle_beta 89.44451561 _cell_angle_gamma 42.26909727 _symmetry_Int_Tables_number 1 _chemical_formula_structural Li5Mn6(BO3)6 _chemical_formula_sum 'Li10 Mn12 B12 O36' _cell_volume 753.89854896 _cell_formula_units_Z 2 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 0.89543400 0.89543400 0.00994100 1.0 Li Li1 1 0.92118300 0.92118300 0.64159300 1.0 Li Li2 1 0.68495800 0.68495800 0.85140800 1.0 Li Li3 1 0.67032800 0.67032800 0.14193800 1.0 Li Li4 1 0.64478900 0.64478900 0.50827000 1.0 Li Li5 1 0.43524800 0.43524800 0.35060500 1.0 Li Li6 1 0.41963600 0.41963600 0.64111800 1.0 Li Li7 1 0.39600100 0.39600100 0.00931400 1.0 Li Li8 1 0.17045700 0.17045700 0.14100000 1.0 Li Li9 1 0.14700300 0.14700300 0.51164600 1.0 Mn Mn10 1 0.82457500 0.31882100 0.98932800 1.0 Mn Mn11 1 0.84094300 0.33670800 0.69030300 1.0 Mn Mn12 1 0.57599800 0.06763400 0.48919100 1.0 Mn Mn13 1 0.59030800 0.08709700 0.19045700 1.0 Mn Mn14 1 0.84334600 0.33837300 0.31949500 1.0 Mn Mn15 1 0.58833600 0.09288900 0.81931400 1.0 Mn Mn16 1 0.09288900 0.58833600 0.81931400 1.0 Mn Mn17 1 0.33837300 0.84334600 0.31949500 1.0 Mn Mn18 1 0.08709700 0.59030800 0.19045700 1.0 Mn Mn19 1 0.06763400 0.57599800 0.48919100 1.0 Mn Mn20 1 0.33670800 0.84094300 0.69030300 1.0 Mn Mn21 1 0.31882100 0.82457500 0.98932800 1.0 B B22 1 0.99714400 0.50610900 0.00374700 1.0 B B23 1 0.75019600 0.75019600 0.66498700 1.0 B B24 1 0.00014100 0.00014100 0.16269500 1.0 B B25 1 0.99603500 0.99603500 0.83366200 1.0 B B26 1 0.50610900 0.99714400 0.00374700 1.0 B B27 1 0.74692900 0.25648300 0.50357000 1.0 B B28 1 0.49894800 0.49894800 0.83250500 1.0 B B29 1 0.24922500 0.24922500 0.33234500 1.0 B B30 1 0.74585000 0.74585000 0.33375400 1.0 B B31 1 0.50079700 0.50079700 0.16366300 1.0 B B32 1 0.25101300 0.25101300 0.66046200 1.0 B B33 1 0.25648300 0.74692900 0.50357000 1.0 O O34 1 0.91806300 0.91806300 0.87208700 1.0 O O35 1 0.75680200 0.75680200 0.23710600 1.0 O O36 1 0.81917900 0.81917900 0.71926800 1.0 O O37 1 0.81278800 0.81278800 0.39022900 1.0 O O38 1 0.75602600 0.75602600 0.56905200 1.0 O O39 1 0.92168800 0.92168800 0.19690500 1.0 O O40 1 0.82825900 0.32792900 0.54491100 1.0 O O41 1 0.68261400 0.18143400 0.55998200 1.0 O O42 1 0.93085400 0.43294400 0.06018700 1.0 O O43 1 0.57535100 0.08067000 0.04510100 1.0 O O44 1 0.97572500 0.51296800 0.90911600 1.0 O O45 1 0.72584300 0.26300800 0.40888300 1.0 O O46 1 0.56911700 0.56911700 0.21902600 1.0 O O47 1 0.56809800 0.56809800 0.88754100 1.0 O O48 1 0.50765100 0.50765100 0.06761700 1.0 O O49 1 0.67434700 0.67434700 0.70918200 1.0 O O50 1 0.50840100 0.50840100 0.73578900 1.0 O O51 1 0.42467800 0.42467800 0.20722500 1.0 O O52 1 0.42190100 0.42190100 0.87223700 1.0 O O53 1 0.31689000 0.31689000 0.71992600 1.0 O O54 1 0.31880900 0.31880900 0.38627000 1.0 O O55 1 0.25813900 0.25813900 0.23549900 1.0 O O56 1 0.26374600 0.26374600 0.56477200 1.0 O O57 1 0.66776200 0.66776200 0.37177200 1.0 O O58 1 0.26300800 0.72584300 0.40888300 1.0 O O59 1 0.51296800 0.97572500 0.90911600 1.0 O O60 1 0.08067000 0.57535100 0.04510100 1.0 O O61 1 0.43294400 0.93085400 0.06018700 1.0 O O62 1 0.18143400 0.68261400 0.55998200 1.0 O O63 1 0.32792900 0.82825900 0.54491100 1.0 O O64 1 0.06694100 0.06694100 0.22084800 1.0 O O65 1 0.17237600 0.17237600 0.37273200 1.0 O O66 1 0.06327700 0.06327700 0.88943200 1.0 O O67 1 0.00679900 0.00679900 0.73687500 1.0 O O68 1 0.01161500 0.01161500 0.06698700 1.0 O O69 1 0.17206800 0.17206800 0.69350600 1.0