# generated using pymatgen data_LiMn7O12 _symmetry_space_group_name_H-M 'P 1' _cell_length_a 6.43458964 _cell_length_b 6.43468548 _cell_length_c 6.43465836 _cell_angle_alpha 109.45339074 _cell_angle_beta 109.46866652 _cell_angle_gamma 109.48992740 _symmetry_Int_Tables_number 1 _chemical_formula_structural LiMn7O12 _chemical_formula_sum 'Li1 Mn7 O12' _cell_volume 205.09767551 _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 0.00000000 0.00000200 0.00000100 1.0 Mn Mn1 1 0.49999800 0.00000100 0.00000200 1.0 Mn Mn2 1 0.50000400 0.49999200 0.99999500 1.0 Mn Mn3 1 0.49999800 0.99998800 0.49999700 1.0 Mn Mn4 1 0.99999700 0.50000100 0.00000100 1.0 Mn Mn5 1 0.00000100 0.00000500 0.49999700 1.0 Mn Mn6 1 0.50000100 0.49999900 0.49999500 1.0 Mn Mn7 1 0.99999800 0.50000200 0.50000500 1.0 O O8 1 0.81766700 0.12866900 0.31099200 1.0 O O9 1 0.87135300 0.68902600 0.18232500 1.0 O O10 1 0.49330000 0.31097400 0.18232200 1.0 O O11 1 0.31096400 0.18230600 0.49327700 1.0 O O12 1 0.68903600 0.18230500 0.87135400 1.0 O O13 1 0.81766500 0.50668500 0.68902400 1.0 O O14 1 0.18233300 0.49331800 0.31097900 1.0 O O15 1 0.31096200 0.81769600 0.12864700 1.0 O O16 1 0.68904100 0.81769600 0.50672600 1.0 O O17 1 0.12864900 0.31097600 0.81767600 1.0 O O18 1 0.50670200 0.68902600 0.81767800 1.0 O O19 1 0.18233200 0.87133300 0.68900900 1.0