# generated using pymatgen data_LiMnO2 _symmetry_space_group_name_H-M 'P 1' _cell_length_a 5.97114081 _cell_length_b 8.42782810 _cell_length_c 5.97135231 _cell_angle_alpha 90.30333668 _cell_angle_beta 90.54711843 _cell_angle_gamma 89.92139458 _symmetry_Int_Tables_number 1 _chemical_formula_structural LiMnO2 _chemical_formula_sum 'Li8 Mn8 O16' _cell_volume 300.48265681 _cell_formula_units_Z 8 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 0.25309500 0.74849200 0.25291500 1.0 Li Li1 1 0.74687200 0.25146000 0.74715200 1.0 Li Li2 1 0.25167100 0.25163300 0.25335400 1.0 Li Li3 1 0.74842800 0.74832900 0.74667800 1.0 Li Li4 1 0.74484100 0.75327000 0.24594400 1.0 Li Li5 1 0.25529400 0.24651300 0.75414600 1.0 Li Li6 1 0.49996800 0.99996800 0.99997000 1.0 Li Li7 1 0.00003600 0.49996300 0.49994900 1.0 Mn Mn8 1 0.50000000 0.50007000 0.50023100 1.0 Mn Mn9 1 0.99992000 0.99992400 0.00046000 1.0 Mn Mn10 1 0.00019300 0.49997100 0.99963900 1.0 Mn Mn11 1 0.50018000 0.00006600 0.49994100 1.0 Mn Mn12 1 0.74864700 0.25142700 0.25171800 1.0 Mn Mn13 1 0.25131700 0.74874400 0.74821200 1.0 Mn Mn14 1 0.49976700 0.50002500 0.00011700 1.0 Mn Mn15 1 0.99996200 0.00004300 0.50007300 1.0 O O16 1 0.51748500 0.27191100 0.01750200 1.0 O O17 1 0.01828500 0.76320100 0.51798500 1.0 O O18 1 0.98155700 0.23687700 0.48200100 1.0 O O19 1 0.48236800 0.72811600 0.98239800 1.0 O O20 1 0.72826000 0.99218600 0.24690500 1.0 O O21 1 0.24862200 0.48353800 0.78478400 1.0 O O22 1 0.75132700 0.51641300 0.21476700 1.0 O O23 1 0.27177100 0.00776300 0.75298600 1.0 O O24 1 0.28494300 0.50089800 0.24776100 1.0 O O25 1 0.75487200 0.00004000 0.72357500 1.0 O O26 1 0.51408400 0.26837700 0.48571300 1.0 O O27 1 0.01495300 0.73790100 0.98423500 1.0 O O28 1 0.24508600 0.99994800 0.27658400 1.0 O O29 1 0.71511200 0.49914300 0.75238700 1.0 O O30 1 0.98504900 0.26204800 0.01567900 1.0 O O31 1 0.48603500 0.73174400 0.51423900 1.0