# generated using pymatgen data_Li5Mn6(BO3)6 _symmetry_space_group_name_H-M 'P 1' _cell_length_a 8.85952446 _cell_length_b 8.85952446 _cell_length_c 14.35294023 _cell_angle_alpha 89.53438985 _cell_angle_beta 89.53438985 _cell_angle_gamma 42.12875520 _symmetry_Int_Tables_number 1 _chemical_formula_structural Li5Mn6(BO3)6 _chemical_formula_sum 'Li10 Mn12 B12 O36' _cell_volume 755.67939539 _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 0.89496200 0.89496200 0.99201700 1.0 Li Li1 1 0.39510300 0.39510300 0.99096100 1.0 Li Li2 1 0.42116000 0.42116000 0.35965900 1.0 Li Li3 1 0.43420900 0.43420900 0.64982600 1.0 Li Li4 1 0.93435800 0.93435800 0.64936400 1.0 Li Li5 1 0.14469600 0.14469600 0.49217400 1.0 Li Li6 1 0.64537600 0.64537600 0.49084600 1.0 Li Li7 1 0.17112400 0.17112400 0.85966800 1.0 Li Li8 1 0.18405400 0.18405400 0.14851400 1.0 Li Li9 1 0.68451400 0.68451400 0.15091100 1.0 Mn Mn10 1 0.06662000 0.57081800 0.50113000 1.0 Mn Mn11 1 0.57081800 0.06662000 0.50113000 1.0 Mn Mn12 1 0.07981300 0.58628400 0.81509700 1.0 Mn Mn13 1 0.58628400 0.07981300 0.81509700 1.0 Mn Mn14 1 0.60051700 0.09494600 0.18398900 1.0 Mn Mn15 1 0.09494600 0.60051700 0.18398900 1.0 Mn Mn16 1 0.32104700 0.81655000 0.00126400 1.0 Mn Mn17 1 0.81655000 0.32104700 0.00126400 1.0 Mn Mn18 1 0.32960700 0.83627400 0.31521900 1.0 Mn Mn19 1 0.83627400 0.32960700 0.31521900 1.0 Mn Mn20 1 0.34991800 0.84570700 0.68401000 1.0 Mn Mn21 1 0.84570700 0.34991800 0.68401000 1.0 B B22 1 0.00529200 0.49649100 0.00226300 1.0 B B23 1 0.49649100 0.00529200 0.00226300 1.0 B B24 1 0.24940000 0.24940000 0.33339400 1.0 B B25 1 0.74635000 0.74635000 0.33162200 1.0 B B26 1 0.24988900 0.24988900 0.66574700 1.0 B B27 1 0.75229100 0.75229100 0.66412500 1.0 B B28 1 0.25510800 0.74669400 0.50233000 1.0 B B29 1 0.74669400 0.25510800 0.50233000 1.0 B B30 1 0.00236600 0.00236600 0.16403900 1.0 B B31 1 0.49969900 0.49969900 0.16566800 1.0 B B32 1 0.99910300 0.99910300 0.83328100 1.0 B B33 1 0.49670100 0.49670100 0.83173300 1.0 O O34 1 0.75525600 0.75525600 0.42768700 1.0 O O35 1 0.25540000 0.25540000 0.42989300 1.0 O O36 1 0.76169900 0.76169900 0.75929600 1.0 O O37 1 0.25689300 0.25689300 0.76248000 1.0 O O38 1 0.31800400 0.31800400 0.60884100 1.0 O O39 1 0.82004900 0.82004900 0.60509900 1.0 O O40 1 0.31979100 0.31979100 0.27939000 1.0 O O41 1 0.81216800 0.81216800 0.27188000 1.0 O O42 1 0.07764800 0.57826000 0.96078200 1.0 O O43 1 0.57826000 0.07764800 0.96078200 1.0 O O44 1 0.42247000 0.42247000 0.12656100 1.0 O O45 1 0.92450300 0.92450300 0.12623300 1.0 O O46 1 0.41924800 0.41924800 0.79408400 1.0 O O47 1 0.92419700 0.92419700 0.79065900 1.0 O O48 1 0.20236200 0.66395100 0.44842000 1.0 O O49 1 0.66395100 0.20236200 0.44842000 1.0 O O50 1 0.74662300 0.24216800 0.59979000 1.0 O O51 1 0.24216800 0.74662300 0.59979000 1.0 O O52 1 0.50596000 0.50596000 0.92798100 1.0 O O53 1 0.00475600 0.00475600 0.92956200 1.0 O O54 1 0.01181400 0.01181400 0.25933400 1.0 O O55 1 0.50677800 0.50677800 0.26225200 1.0 O O56 1 0.06985200 0.06985200 0.10506000 1.0 O O57 1 0.56810900 0.56810900 0.10871200 1.0 O O58 1 0.06967200 0.06967200 0.77948400 1.0 O O59 1 0.56220100 0.56220100 0.77164900 1.0 O O60 1 0.32771400 0.82824600 0.46084400 1.0 O O61 1 0.82824600 0.32771400 0.46084400 1.0 O O62 1 0.17243800 0.17243800 0.62699300 1.0 O O63 1 0.67459600 0.67459600 0.62592400 1.0 O O64 1 0.17441400 0.17441400 0.29115300 1.0 O O65 1 0.66901300 0.66901300 0.29352700 1.0 O O66 1 0.95171100 0.41454300 0.94829600 1.0 O O67 1 0.41454300 0.95171100 0.94829600 1.0 O O68 1 0.49552800 0.99310800 0.09973200 1.0 O O69 1 0.99310800 0.49552800 0.09973200 1.0