# generated using pymatgen data_LiMn2(BO3)2 _symmetry_space_group_name_H-M 'P 1' _cell_length_a 5.30232300 _cell_length_b 5.81772735 _cell_length_c 16.44325660 _cell_angle_alpha 99.66100574 _cell_angle_beta 90.25037976 _cell_angle_gamma 90.71922394 _symmetry_Int_Tables_number 1 _chemical_formula_structural LiMn2(BO3)2 _chemical_formula_sum 'Li4 Mn8 B8 O24' _cell_volume 499.98904809 _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 0.16240100 0.06006400 0.61500000 1.0 Li Li1 1 0.32938300 0.19240000 0.13471500 1.0 Li Li2 1 0.67061700 0.80760000 0.86528500 1.0 Li Li3 1 0.83759900 0.93993600 0.38500000 1.0 Mn Mn4 1 0.30053600 0.29973700 0.95826600 1.0 Mn Mn5 1 0.80698500 0.03568800 0.21300200 1.0 Mn Mn6 1 0.68448100 0.21743800 0.53523800 1.0 Mn Mn7 1 0.80780800 0.54483100 0.70764500 1.0 Mn Mn8 1 0.19219200 0.45516900 0.29235500 1.0 Mn Mn9 1 0.31551900 0.78256200 0.46476200 1.0 Mn Mn10 1 0.19301500 0.96431200 0.78699800 1.0 Mn Mn11 1 0.69946400 0.70026300 0.04173400 1.0 B B12 1 0.67464100 0.04703200 0.70460300 1.0 B B13 1 0.17472200 0.28673600 0.45813900 1.0 B B14 1 0.32286800 0.46982000 0.79623800 1.0 B B15 1 0.82333400 0.20611600 0.04967300 1.0 B B16 1 0.17666600 0.79388400 0.95032700 1.0 B B17 1 0.67713200 0.53018000 0.20376200 1.0 B B18 1 0.82527800 0.71326400 0.54186100 1.0 B B19 1 0.32535900 0.95296800 0.29539700 1.0 O O20 1 0.41701000 0.03264100 0.69623600 1.0 O O21 1 0.81556800 0.17461100 0.65447500 1.0 O O22 1 0.30536800 0.15282500 0.50842600 1.0 O O23 1 0.67341500 0.34739300 0.00956400 1.0 O O24 1 0.19633600 0.07373600 0.24205300 1.0 O O25 1 0.19559100 0.29879800 0.83310300 1.0 O O26 1 0.68591800 0.05464300 0.09369400 1.0 O O27 1 0.92225100 0.25358100 0.44484900 1.0 O O28 1 0.57422100 0.50135900 0.80289200 1.0 O O29 1 0.07872500 0.21795000 0.05212900 1.0 O O30 1 0.30645900 0.44079400 0.41687000 1.0 O O31 1 0.83101900 0.38159000 0.24085700 1.0 O O32 1 0.16898100 0.61841000 0.75914300 1.0 O O33 1 0.69354100 0.55920600 0.58313000 1.0 O O34 1 0.92127500 0.78205000 0.94787100 1.0 O O35 1 0.42577900 0.49864100 0.19710800 1.0 O O36 1 0.07774900 0.74641900 0.55515100 1.0 O O37 1 0.31408200 0.94535700 0.90630600 1.0 O O38 1 0.80440900 0.70120200 0.16689700 1.0 O O39 1 0.80366400 0.92626400 0.75794700 1.0 O O40 1 0.32658500 0.65260700 0.99043600 1.0 O O41 1 0.69463200 0.84717500 0.49157400 1.0 O O42 1 0.18443200 0.82538900 0.34552500 1.0 O O43 1 0.58299000 0.96735900 0.30376400 1.0