# generated using pymatgen data_LiMn3Al2(HO2)6 _symmetry_space_group_name_H-M 'P 1' _cell_length_a 5.99564400 _cell_length_b 7.85043147 _cell_length_c 10.52153695 _cell_angle_alpha 105.51094530 _cell_angle_beta 106.13106026 _cell_angle_gamma 101.19591195 _symmetry_Int_Tables_number 1 _chemical_formula_structural LiMn3Al2(HO2)6 _chemical_formula_sum 'Li2 Mn6 Al4 H12 O24' _cell_volume 438.70392890 _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 0.07952300 0.84408500 0.49862800 1.0 Li Li1 1 0.92047700 0.15591500 0.50137200 1.0 Mn Mn2 1 0.82639000 0.83210200 0.99633400 1.0 Mn Mn3 1 0.32873100 0.83140800 0.99877400 1.0 Mn Mn4 1 0.17361000 0.16789800 0.00366600 1.0 Mn Mn5 1 0.00000000 0.50000000 0.00000000 1.0 Mn Mn6 1 0.67126900 0.16859200 0.00122600 1.0 Mn Mn7 1 0.50000000 0.50000000 0.00000000 1.0 Al Al8 1 0.58746400 0.83839300 0.49716100 1.0 Al Al9 1 0.41253600 0.16160700 0.50283900 1.0 Al Al10 1 0.75687500 0.50130700 0.50117100 1.0 Al Al11 1 0.24312500 0.49869300 0.49882900 1.0 H H12 1 0.25005800 0.86059800 0.29123300 1.0 H H13 1 0.74994200 0.13940200 0.70876700 1.0 H H14 1 0.70980800 0.84338000 0.29030400 1.0 H H15 1 0.59142600 0.48737400 0.70802000 1.0 H H16 1 0.29019200 0.15662000 0.70969600 1.0 H H17 1 0.56380500 0.19440500 0.30141300 1.0 H H18 1 0.10375600 0.49292700 0.70934800 1.0 H H19 1 0.40857400 0.51262600 0.29198000 1.0 H H20 1 0.08507100 0.19426200 0.29671100 1.0 H H21 1 0.91492900 0.80573800 0.70328900 1.0 H H22 1 0.89624400 0.50707300 0.29065200 1.0 H H23 1 0.43619500 0.80559500 0.69858700 1.0 O O24 1 0.04932100 0.89898000 0.89721100 1.0 O O25 1 0.31863800 0.90704700 0.39456600 1.0 O O26 1 0.68136200 0.09295300 0.60543400 1.0 O O27 1 0.89201600 0.23158800 0.89871800 1.0 O O28 1 0.55017700 0.90230400 0.89624700 1.0 O O29 1 0.77402500 0.88268900 0.39275000 1.0 O O30 1 0.95067900 0.10102000 0.10278900 1.0 O O31 1 0.53634800 0.43701900 0.60334800 1.0 O O32 1 0.38951700 0.23256900 0.90076000 1.0 O O33 1 0.22597500 0.11731100 0.60725000 1.0 O O34 1 0.44982300 0.09769600 0.10375300 1.0 O O35 1 0.61716400 0.24589800 0.40423300 1.0 O O36 1 0.04217600 0.46092900 0.60636600 1.0 O O37 1 0.21633700 0.56072000 0.89781000 1.0 O O38 1 0.31117800 0.42670000 0.11029200 1.0 O O39 1 0.15667700 0.24259500 0.39966000 1.0 O O40 1 0.46365200 0.56298100 0.39665200 1.0 O O41 1 0.84332300 0.75740500 0.60034000 1.0 O O42 1 0.68882200 0.57330000 0.88970800 1.0 O O43 1 0.10798400 0.76841200 0.10128200 1.0 O O44 1 0.78366300 0.43928000 0.10219000 1.0 O O45 1 0.95782400 0.53907100 0.39363400 1.0 O O46 1 0.38283600 0.75410200 0.59576700 1.0 O O47 1 0.61048300 0.76743100 0.09924000 1.0