# generated using pymatgen data_Li5Mn6(BO3)6 _symmetry_space_group_name_H-M 'P 1' _cell_length_a 6.37353500 _cell_length_b 8.23440200 _cell_length_c 8.25139507 _cell_angle_alpha 60.69108928 _cell_angle_beta 90.00000000 _cell_angle_gamma 90.00000000 _symmetry_Int_Tables_number 1 _chemical_formula_structural Li5Mn6(BO3)6 _chemical_formula_sum 'Li5 Mn6 B6 O18' _cell_volume 377.61818124 _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 0.00000000 0.98056000 0.71823900 1.0 Li Li1 1 0.50000000 0.98369000 0.71669100 1.0 Li Li2 1 0.50000000 0.72198900 0.29779600 1.0 Li Li3 1 0.00000000 0.30143000 0.97845200 1.0 Li Li4 1 0.50000000 0.30010600 0.98320000 1.0 Mn Mn5 1 0.24773700 0.36851300 0.61825300 1.0 Mn Mn6 1 0.75226300 0.36851300 0.61825300 1.0 Mn Mn7 1 0.24690400 0.63257700 0.02199600 1.0 Mn Mn8 1 0.75309600 0.63257700 0.02199600 1.0 Mn Mn9 1 0.24796200 0.00036600 0.36177000 1.0 Mn Mn10 1 0.75203800 0.00036600 0.36177000 1.0 B B11 1 0.50000000 0.66651900 0.67194600 1.0 B B12 1 0.00000000 0.66085500 0.67703000 1.0 B B13 1 0.50000000 0.33206300 0.33456400 1.0 B B14 1 0.74390900 0.00729400 0.99231000 1.0 B B15 1 0.25609100 0.00729400 0.99231000 1.0 B B16 1 0.00000000 0.32455600 0.33275100 1.0 O O17 1 0.25100500 0.92373000 0.87965400 1.0 O O18 1 0.74899500 0.92373000 0.87965400 1.0 O O19 1 0.50000000 0.85913300 0.56060100 1.0 O O20 1 0.00000000 0.85195000 0.56116800 1.0 O O21 1 0.00000000 0.58697900 0.86856300 1.0 O O22 1 0.50000000 0.58432900 0.86382900 1.0 O O23 1 0.72989600 0.89854100 0.18171300 1.0 O O24 1 0.27010400 0.89854100 0.18171300 1.0 O O25 1 0.50000000 0.55748000 0.58476200 1.0 O O26 1 0.00000000 0.53785600 0.60784600 1.0 O O27 1 0.25071200 0.20177000 0.90884200 1.0 O O28 1 0.74928800 0.20177000 0.90884200 1.0 O O29 1 0.50000000 0.52567300 0.22473600 1.0 O O30 1 0.00000000 0.51461700 0.22181700 1.0 O O31 1 0.50000000 0.25553900 0.52856200 1.0 O O32 1 0.00000000 0.24836400 0.52682500 1.0 O O33 1 0.50000000 0.21756100 0.25607100 1.0 O O34 1 0.00000000 0.20678700 0.25552500 1.0