# generated using pymatgen data_Li6MnO6 _symmetry_space_group_name_H-M 'P 1' _cell_length_a 5.78081159 _cell_length_b 5.43492544 _cell_length_c 5.78187542 _cell_angle_alpha 121.75431059 _cell_angle_beta 119.84778131 _cell_angle_gamma 58.13931377 _symmetry_Int_Tables_number 1 _chemical_formula_structural Li6MnO6 _chemical_formula_sum 'Li6 Mn1 O6' _cell_volume 124.96291858 _cell_formula_units_Z 1 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 0.28493600 0.28538700 0.49296500 1.0 Li Li1 1 0.07846300 0.71378200 0.28608500 1.0 Li Li2 1 0.49514100 0.70905900 0.92225200 1.0 Li Li3 1 0.50485900 0.29094100 0.07774800 1.0 Li Li4 1 0.92153700 0.28621800 0.71391500 1.0 Li Li5 1 0.71506400 0.71461300 0.50703500 1.0 Mn Mn6 1 0.00000000 0.00000000 0.00000000 1.0 O O7 1 0.09350000 0.75712500 0.64800900 1.0 O O8 1 0.20133500 0.24441500 0.09051100 1.0 O O9 1 0.64610500 0.23871600 0.79468200 1.0 O O10 1 0.35389500 0.76128400 0.20531800 1.0 O O11 1 0.79866500 0.75558500 0.90948900 1.0 O O12 1 0.90650000 0.24287500 0.35199100 1.0