# generated using pymatgen data_LiMn3Al2(HO2)6 _symmetry_space_group_name_H-M 'P 1' _cell_length_a 10.53346683 _cell_length_b 7.73136804 _cell_length_c 5.85237775 _cell_angle_alpha 100.97994151 _cell_angle_beta 105.96410267 _cell_angle_gamma 68.62014844 _symmetry_Int_Tables_number 1 _chemical_formula_structural LiMn3Al2(HO2)6 _chemical_formula_sum 'Li2 Mn6 Al4 H12 O24' _cell_volume 424.52137924 _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 0.50051300 0.01139000 0.25907800 1.0 Li Li1 1 0.49944500 0.32202000 0.57425100 1.0 Mn Mn2 1 0.00238200 0.99925000 0.00017200 1.0 Mn Mn3 1 0.00118400 0.99930100 0.49984000 1.0 Mn Mn4 1 0.99895800 0.33401500 0.33338300 1.0 Mn Mn5 1 0.99924600 0.66726900 0.16666000 1.0 Mn Mn6 1 0.99744800 0.33401300 0.83345800 1.0 Mn Mn7 1 0.00081000 0.66611200 0.66633400 1.0 Al Al8 1 0.50190400 0.00615900 0.74815700 1.0 Al Al9 1 0.49806600 0.32726900 0.08521900 1.0 Al Al10 1 0.50000200 0.66668200 0.41669400 1.0 Al Al11 1 0.49993000 0.66670300 0.91666500 1.0 H H12 1 0.70984700 0.02535700 0.09726000 1.0 H H13 1 0.28945600 0.32413300 0.20299900 1.0 H H14 1 0.71055800 0.00913300 0.63024100 1.0 H H15 1 0.28718500 0.65189800 0.05708100 1.0 H H16 1 0.29003300 0.30813400 0.73598200 1.0 H H17 1 0.70491400 0.36214100 0.42694500 1.0 H H18 1 0.29569500 0.65806200 0.55875100 1.0 H H19 1 0.70426100 0.67527800 0.27416000 1.0 H H20 1 0.69997700 0.35896600 0.95540700 1.0 H H21 1 0.29505000 0.97126000 0.40642400 1.0 H H22 1 0.71271000 0.68152800 0.77682500 1.0 H H23 1 0.29995300 0.97426200 0.87799600 1.0 O O24 1 0.10323600 0.06631900 0.31809400 1.0 O O25 1 0.60650100 0.07273100 0.05456100 1.0 O O26 1 0.39206100 0.28489300 0.24998400 1.0 O O27 1 0.09800800 0.40018900 0.14879900 1.0 O O28 1 0.10344300 0.06698600 0.81703900 1.0 O O29 1 0.60791200 0.04857300 0.58340900 1.0 O O30 1 0.89649900 0.26611600 0.01625100 1.0 O O31 1 0.39159200 0.60929300 0.09589800 1.0 O O32 1 0.10038300 0.39833800 0.65135200 1.0 O O33 1 0.39347700 0.26066100 0.77877800 1.0 O O34 1 0.89683000 0.26726500 0.51529800 1.0 O O35 1 0.60192300 0.40843000 0.38617700 1.0 O O36 1 0.39887200 0.61562800 0.60337100 1.0 O O37 1 0.10374200 0.73137800 0.48328800 1.0 O O38 1 0.89632500 0.60214800 0.35016200 1.0 O O39 1 0.59696300 0.40908200 0.91713200 1.0 O O40 1 0.60105600 0.71776300 0.22989900 1.0 O O41 1 0.39803400 0.92498800 0.44721100 1.0 O O42 1 0.10503000 0.72978700 0.98499300 1.0 O O43 1 0.89950600 0.93487700 0.18191500 1.0 O O44 1 0.89495400 0.60310400 0.84765900 1.0 O O45 1 0.60839500 0.72418200 0.73767200 1.0 O O46 1 0.40294700 0.92436100 0.91625800 1.0 O O47 1 0.90218600 0.93277200 0.68441900 1.0