# generated using pymatgen data_Li5Mn6(BO3)6 _symmetry_space_group_name_H-M 'P 1' _cell_length_a 10.41850390 _cell_length_b 10.41850390 _cell_length_c 8.29394655 _cell_angle_alpha 66.80941447 _cell_angle_beta 66.80941447 _cell_angle_gamma 75.47693656 _symmetry_Int_Tables_number 1 _chemical_formula_structural Li5Mn6(BO3)6 _chemical_formula_sum 'Li10 Mn12 B12 O36' _cell_volume 755.76779235 _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 0.48699100 0.98185600 0.29780300 1.0 Li Li1 1 0.02497400 0.02497400 0.98219800 1.0 Li Li2 1 0.27370900 0.77509600 0.98392800 1.0 Li Li3 1 0.98185600 0.48699100 0.29780300 1.0 Li Li4 1 0.73549300 0.73549300 0.29749600 1.0 Li Li5 1 0.11566500 0.61622700 0.71973900 1.0 Li Li6 1 0.61622700 0.11566500 0.71973900 1.0 Li Li7 1 0.36632400 0.36632400 0.71283300 1.0 Li Li8 1 0.52567000 0.52567000 0.97626800 1.0 Li Li9 1 0.77509600 0.27370900 0.98392800 1.0 Mn Mn10 1 0.56780400 0.81563800 0.00299200 1.0 Mn Mn11 1 0.06899700 0.31769300 0.01877400 1.0 Mn Mn12 1 0.31769300 0.06899700 0.01877400 1.0 Mn Mn13 1 0.00533000 0.75610000 0.37392700 1.0 Mn Mn14 1 0.17575300 0.93050900 0.62925500 1.0 Mn Mn15 1 0.81563800 0.56780400 0.00299200 1.0 Mn Mn16 1 0.25186200 0.49865600 0.35744000 1.0 Mn Mn17 1 0.49865600 0.25186200 0.35744000 1.0 Mn Mn18 1 0.75610000 0.00533000 0.37392700 1.0 Mn Mn19 1 0.93050900 0.17575300 0.62925500 1.0 Mn Mn20 1 0.42975800 0.68056900 0.62150800 1.0 Mn Mn21 1 0.68056900 0.42975800 0.62150800 1.0 B B22 1 0.04316900 0.04316900 0.33246800 1.0 B B23 1 0.28880300 0.79288900 0.33404300 1.0 B B24 1 0.00362500 0.74478700 0.00985900 1.0 B B25 1 0.74478700 0.00362500 0.00985900 1.0 B B26 1 0.54097100 0.54097100 0.32600700 1.0 B B27 1 0.79288900 0.28880300 0.33404300 1.0 B B28 1 0.45541600 0.95852100 0.66903600 1.0 B B29 1 0.20490300 0.20490300 0.67807400 1.0 B B30 1 0.70715200 0.70715200 0.65975000 1.0 B B31 1 0.25037100 0.50865800 0.99018800 1.0 B B32 1 0.50865800 0.25037100 0.99018800 1.0 B B33 1 0.95852100 0.45541600 0.66903600 1.0 O O34 1 0.13829600 0.13829600 0.21432200 1.0 O O35 1 0.38898400 0.88544100 0.22090600 1.0 O O36 1 0.18282200 0.46652100 0.17875300 1.0 O O37 1 0.46652100 0.18282200 0.17875300 1.0 O O38 1 0.69843400 0.94203600 0.20398400 1.0 O O39 1 0.00611300 0.00611300 0.52310700 1.0 O O40 1 0.24698200 0.75525300 0.52727400 1.0 O O41 1 0.48339400 0.48339400 0.24720800 1.0 O O42 1 0.98168500 0.98168500 0.25979800 1.0 O O43 1 0.40000400 0.90565400 0.58334600 1.0 O O44 1 0.22860600 0.73639400 0.25689300 1.0 O O45 1 0.73639400 0.22860600 0.25689300 1.0 O O46 1 0.14086500 0.14086500 0.61676900 1.0 O O47 1 0.80334300 0.80334300 0.54169700 1.0 O O48 1 0.88544100 0.38898400 0.22090600 1.0 O O49 1 0.63810500 0.63810500 0.21372100 1.0 O O50 1 0.30099400 0.30099400 0.55712200 1.0 O O51 1 0.05273200 0.55600500 0.55935400 1.0 O O52 1 0.55600500 0.05273200 0.55935400 1.0 O O53 1 0.09833600 0.84578100 0.92287100 1.0 O O54 1 0.94203600 0.69843400 0.20398400 1.0 O O55 1 0.50100300 0.50100300 0.51880400 1.0 O O56 1 0.75525300 0.24698200 0.52727400 1.0 O O57 1 0.41257900 0.91912800 0.86099500 1.0 O O58 1 0.17035600 0.17035600 0.86874000 1.0 O O59 1 0.21716400 0.46219600 0.87566400 1.0 O O60 1 0.46219600 0.21716400 0.87566400 1.0 O O61 1 0.68919600 0.97299700 0.90568600 1.0 O O62 1 0.65073100 0.65073100 0.57893200 1.0 O O63 1 0.90565400 0.40000400 0.58334600 1.0 O O64 1 0.35255400 0.60195800 0.90936100 1.0 O O65 1 0.60195800 0.35255400 0.90936100 1.0 O O66 1 0.84578100 0.09833600 0.92287100 1.0 O O67 1 0.66739600 0.66739600 0.85114500 1.0 O O68 1 0.91912800 0.41257900 0.86099500 1.0 O O69 1 0.97299700 0.68919600 0.90568600 1.0