# generated using pymatgen data_Li5Mn6(BO3)6 _symmetry_space_group_name_H-M 'P 1' _cell_length_a 14.68826585 _cell_length_b 14.68826585 _cell_length_c 8.25832036 _cell_angle_alpha 89.55328158 _cell_angle_beta 89.55328158 _cell_angle_gamma 25.02083621 _symmetry_Int_Tables_number 1 _chemical_formula_structural Li5Mn6(BO3)6 _chemical_formula_sum 'Li10 Mn12 B12 O36' _cell_volume 753.53897124 _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 0.24563500 0.24563500 0.29072700 1.0 Li Li1 1 0.74584400 0.74584400 0.28943200 1.0 Li Li2 1 0.92987000 0.92987000 0.34159600 1.0 Li Li3 1 0.07446500 0.07446500 0.36772700 1.0 Li Li4 1 0.57507400 0.57507400 0.36956600 1.0 Li Li5 1 0.49568400 0.49568400 0.79012800 1.0 Li Li6 1 0.99585700 0.99585700 0.79038700 1.0 Li Li7 1 0.17985600 0.17985600 0.84143200 1.0 Li Li8 1 0.82505800 0.82505800 0.86846000 1.0 Li Li9 1 0.32456700 0.32456700 0.86899000 1.0 Mn Mn10 1 0.74846300 0.25285700 0.13757000 1.0 Mn Mn11 1 0.25285700 0.74846300 0.13757000 1.0 Mn Mn12 1 0.90459000 0.41038700 0.16597800 1.0 Mn Mn13 1 0.41038700 0.90459000 0.16597800 1.0 Mn Mn14 1 0.58957600 0.09447800 0.19549800 1.0 Mn Mn15 1 0.09447700 0.58957600 0.19549800 1.0 Mn Mn16 1 0.50268400 0.99870800 0.63758100 1.0 Mn Mn17 1 0.99870800 0.50268400 0.63758100 1.0 Mn Mn18 1 0.65404700 0.16098100 0.66581300 1.0 Mn Mn19 1 0.16098100 0.65404700 0.66581300 1.0 Mn Mn20 1 0.83924400 0.34487700 0.69551800 1.0 Mn Mn21 1 0.34487700 0.83924400 0.69551800 1.0 B B22 1 0.00475900 0.49721500 0.00167700 1.0 B B23 1 0.49721500 0.00475900 0.00167700 1.0 B B24 1 0.41583100 0.41583100 0.99557700 1.0 B B25 1 0.91671000 0.91671000 0.99654700 1.0 B B26 1 0.58219700 0.58219700 0.00403800 1.0 B B27 1 0.08300700 0.08300700 0.99998500 1.0 B B28 1 0.75551100 0.24648100 0.50181800 1.0 B B29 1 0.24648100 0.75551100 0.50181800 1.0 B B30 1 0.83307800 0.83307800 0.50026700 1.0 B B31 1 0.33202900 0.33202900 0.50369100 1.0 B B32 1 0.16646400 0.16646400 0.49603300 1.0 B B33 1 0.66610500 0.66610500 0.49620100 1.0 O O34 1 0.96492000 0.96492000 0.01049200 1.0 O O35 1 0.46389200 0.46389200 0.01147100 1.0 O O36 1 0.13147500 0.13147500 0.01508600 1.0 O O37 1 0.62971000 0.62971000 0.02208400 1.0 O O38 1 0.55273200 0.55273200 0.13976700 1.0 O O39 1 0.05440800 0.05440800 0.13572700 1.0 O O40 1 0.38613600 0.38613600 0.12745600 1.0 O O41 1 0.88947300 0.88947300 0.13702600 1.0 O O42 1 0.98075300 0.47975600 0.15597200 1.0 O O43 1 0.47975600 0.98075300 0.15597200 1.0 O O44 1 0.31290700 0.31290700 0.34782500 1.0 O O45 1 0.81379100 0.81379100 0.34523500 1.0 O O46 1 0.14553400 0.14553400 0.34513600 1.0 O O47 1 0.64677900 0.64677900 0.34221500 1.0 O O48 1 0.74223500 0.20582200 0.36603500 1.0 O O49 1 0.20582200 0.74223500 0.36603500 1.0 O O50 1 0.79877600 0.30077900 0.48895200 1.0 O O51 1 0.30077900 0.79877600 0.48895200 1.0 O O52 1 0.71429900 0.71429900 0.51241800 1.0 O O53 1 0.21456500 0.21456500 0.50948200 1.0 O O54 1 0.37959500 0.37959500 0.52168400 1.0 O O55 1 0.88147700 0.88147700 0.51551500 1.0 O O56 1 0.30257300 0.30257300 0.63900100 1.0 O O57 1 0.80445300 0.80445300 0.63638800 1.0 O O58 1 0.13926900 0.13926900 0.63675700 1.0 O O59 1 0.63643600 0.63643600 0.62786300 1.0 O O60 1 0.73069900 0.22981700 0.65605500 1.0 O O61 1 0.22981700 0.73069900 0.65605500 1.0 O O62 1 0.56291900 0.56291900 0.84854800 1.0 O O63 1 0.06383500 0.06383500 0.84463300 1.0 O O64 1 0.39629600 0.39629600 0.84176500 1.0 O O65 1 0.89596500 0.89596500 0.84545700 1.0 O O66 1 0.99151800 0.45650200 0.86593700 1.0 O O67 1 0.45650200 0.99151800 0.86593700 1.0 O O68 1 0.55241600 0.04711100 0.98887600 1.0 O O69 1 0.04711100 0.55241600 0.98887600 1.0