# generated using pymatgen data_LiMn2(BO3)2 _symmetry_space_group_name_H-M 'P 1' _cell_length_a 5.29448500 _cell_length_b 5.79367823 _cell_length_c 17.94741757 _cell_angle_alpha 83.83727860 _cell_angle_beta 82.20085083 _cell_angle_gamma 66.08554778 _symmetry_Int_Tables_number 1 _chemical_formula_structural LiMn2(BO3)2 _chemical_formula_sum 'Li4 Mn8 B8 O24' _cell_volume 497.77819228 _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 0.06566800 0.90254000 0.76683300 1.0 Li Li1 1 0.42342400 0.84888700 0.48548300 1.0 Li Li2 1 0.42669800 0.34818900 0.98665500 1.0 Li Li3 1 0.92186500 0.10099600 0.23628300 1.0 Mn Mn4 1 0.53570700 0.89351200 0.85155500 1.0 Mn Mn5 1 0.96298300 0.85467100 0.40284300 1.0 Mn Mn6 1 0.96346200 0.34830500 0.90246400 1.0 Mn Mn7 1 0.47063900 0.59019600 0.65810100 1.0 Mn Mn8 1 0.52926000 0.40731900 0.34823300 1.0 Mn Mn9 1 0.03034100 0.65840700 0.09646800 1.0 Mn Mn10 1 0.03689600 0.15502100 0.59733400 1.0 Mn Mn11 1 0.46191500 0.10251000 0.15406400 1.0 B B12 1 0.94799500 0.69417100 0.56406800 1.0 B B13 1 0.45349900 0.93934200 0.31535600 1.0 B B14 1 0.05610400 0.80687500 0.93039000 1.0 B B15 1 0.44431900 0.43714000 0.82088000 1.0 B B16 1 0.54895300 0.56098000 0.18172000 1.0 B B17 1 0.95294900 0.18599100 0.06601700 1.0 B B18 1 0.54693300 0.06004700 0.68805100 1.0 B B19 1 0.05071100 0.31113700 0.43174400 1.0 O O20 1 0.69564200 0.98170600 0.74785200 1.0 O O21 1 0.86503800 0.71317600 0.91516100 1.0 O O22 1 0.34590700 0.96563900 0.67653800 1.0 O O23 1 0.09702300 0.98516300 0.87372500 1.0 O O24 1 0.79899500 0.78192900 0.50261000 1.0 O O25 1 0.20822500 0.71684900 0.98886000 1.0 O O26 1 0.86246600 0.54504600 0.61941900 1.0 O O27 1 0.37250900 0.80237900 0.37668800 1.0 O O28 1 0.64884300 0.51135400 0.83414700 1.0 O O29 1 0.16857700 0.75661200 0.57429800 1.0 O O30 1 0.59445500 0.74834400 0.13130600 1.0 O O31 1 0.29369100 0.53284300 0.76018500 1.0 O O32 1 0.69524300 0.46313100 0.24130900 1.0 O O33 1 0.37551000 0.27897300 0.87825200 1.0 O O34 1 0.86257100 0.21791500 0.41293000 1.0 O O35 1 0.36230800 0.46690100 0.16200500 1.0 O O36 1 0.59583600 0.23451300 0.63371000 1.0 O O37 1 0.09523600 0.49885300 0.38161200 1.0 O O38 1 0.80514900 0.25619400 0.00480300 1.0 O O39 1 0.20111600 0.21184900 0.49078400 1.0 O O40 1 0.87430900 0.04865400 0.12788500 1.0 O O41 1 0.67830100 0.99973700 0.32053100 1.0 O O42 1 0.17390600 0.25289900 0.07149700 1.0 O O43 1 0.29955100 0.02044100 0.25498600 1.0