# generated using pymatgen data_Li2Mn3(BO3)3 _symmetry_space_group_name_H-M 'P 1' _cell_length_a 14.75215802 _cell_length_b 14.75215802 _cell_length_c 8.24519799 _cell_angle_alpha 89.93845161 _cell_angle_beta 89.93845161 _cell_angle_gamma 24.81583148 _symmetry_Int_Tables_number 1 _chemical_formula_structural Li2Mn3(BO3)3 _chemical_formula_sum 'Li8 Mn12 B12 O36' _cell_volume 753.10217733 _cell_formula_units_Z 4 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 0.74363400 0.74363400 0.70595000 1.0 Li Li1 1 0.24367600 0.24367600 0.71048800 1.0 Li Li2 1 0.42895400 0.42895400 0.66040500 1.0 Li Li3 1 0.07367400 0.07367400 0.62805200 1.0 Li Li4 1 0.99404200 0.99404200 0.21093700 1.0 Li Li5 1 0.49356900 0.49356900 0.21053200 1.0 Li Li6 1 0.67893500 0.67893500 0.16285300 1.0 Li Li7 1 0.82320300 0.82320300 0.12665900 1.0 Mn Mn8 1 0.75147500 0.25221400 0.85616300 1.0 Mn Mn9 1 0.25221400 0.75147500 0.85616300 1.0 Mn Mn10 1 0.90611200 0.40081700 0.82912100 1.0 Mn Mn11 1 0.40081700 0.90611200 0.82912100 1.0 Mn Mn12 1 0.59079400 0.09118700 0.81162900 1.0 Mn Mn13 1 0.09118700 0.59079400 0.81162900 1.0 Mn Mn14 1 0.49905800 0.00411300 0.35644900 1.0 Mn Mn15 1 0.00411300 0.49905800 0.35644900 1.0 Mn Mn16 1 0.65779000 0.15076000 0.32908900 1.0 Mn Mn17 1 0.15076000 0.65779000 0.32908900 1.0 Mn Mn18 1 0.84349000 0.33740000 0.31490900 1.0 Mn Mn19 1 0.33740000 0.84349000 0.31490900 1.0 B B20 1 0.99236500 0.50371000 0.99322800 1.0 B B21 1 0.50371000 0.99236500 0.99322800 1.0 B B22 1 0.91561200 0.91561200 0.00136500 1.0 B B23 1 0.41735600 0.41735600 0.00429700 1.0 B B24 1 0.08105200 0.08105200 0.99722300 1.0 B B25 1 0.58144300 0.58144300 0.00772600 1.0 B B26 1 0.75123200 0.24509200 0.49522800 1.0 B B27 1 0.24509200 0.75123200 0.49522800 1.0 B B28 1 0.33119800 0.33119800 0.50687800 1.0 B B29 1 0.83123500 0.83123500 0.49505500 1.0 B B30 1 0.66752000 0.66752000 0.50383000 1.0 B B31 1 0.16509300 0.16509300 0.50337000 1.0 O O32 1 0.46509100 0.46509100 0.98207400 1.0 O O33 1 0.96315200 0.96315200 0.98179000 1.0 O O34 1 0.62988700 0.62988700 0.98815400 1.0 O O35 1 0.12856300 0.12856300 0.97499100 1.0 O O36 1 0.05216300 0.05216300 0.86091100 1.0 O O37 1 0.55285100 0.55285100 0.87717700 1.0 O O38 1 0.88482200 0.88482200 0.87362000 1.0 O O39 1 0.38886500 0.38886500 0.86913500 1.0 O O40 1 0.97713400 0.47426400 0.84310300 1.0 O O41 1 0.47426400 0.97713400 0.84310300 1.0 O O42 1 0.81268000 0.81268000 0.65028300 1.0 O O43 1 0.31321400 0.31321400 0.66513300 1.0 O O44 1 0.65102600 0.65102600 0.66095800 1.0 O O45 1 0.14605800 0.14605800 0.65870100 1.0 O O46 1 0.70536600 0.23988500 0.63447200 1.0 O O47 1 0.23988500 0.70536600 0.63447200 1.0 O O48 1 0.82049600 0.27085900 0.50208400 1.0 O O49 1 0.27085900 0.82049600 0.50208400 1.0 O O50 1 0.21256500 0.21256500 0.48330700 1.0 O O51 1 0.71507300 0.71507300 0.47801900 1.0 O O52 1 0.87889600 0.87889600 0.47327000 1.0 O O53 1 0.37957300 0.37957300 0.48672600 1.0 O O54 1 0.80255300 0.80255300 0.35906400 1.0 O O55 1 0.30223400 0.30223400 0.37697800 1.0 O O56 1 0.63830800 0.63830800 0.36999100 1.0 O O57 1 0.13442000 0.13442000 0.37521800 1.0 O O58 1 0.72818600 0.22439400 0.34389200 1.0 O O59 1 0.22439400 0.72818600 0.34389200 1.0 O O60 1 0.06229400 0.06229400 0.15203900 1.0 O O61 1 0.56331300 0.56331300 0.16598800 1.0 O O62 1 0.89647400 0.89647400 0.15670900 1.0 O O63 1 0.40058500 0.40058500 0.16087400 1.0 O O64 1 0.95821200 0.48699900 0.13394600 1.0 O O65 1 0.48699900 0.95821200 0.13394600 1.0 O O66 1 0.56346500 0.02958300 0.99846500 1.0 O O67 1 0.02958300 0.56346500 0.99846500 1.0