# generated using pymatgen data_Li11(NiO4)2 _symmetry_space_group_name_H-M 'P 1' _cell_length_a 6.55803729 _cell_length_b 6.55803729 _cell_length_c 9.37127958 _cell_angle_alpha 89.97678973 _cell_angle_beta 89.97678973 _cell_angle_gamma 91.47113490 _symmetry_Int_Tables_number 1 _chemical_formula_structural Li11(NiO4)2 _chemical_formula_sum 'Li22 Ni4 O16' _cell_volume 402.90570053 _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 0.54274100 0.04997700 0.99877100 1.0 Li Li1 1 0.54164600 0.03396600 0.50384100 1.0 Li Li2 1 0.97334000 0.02666000 0.00000000 1.0 Li Li3 1 0.26922800 0.27680600 0.96956900 1.0 Li Li4 1 0.25377500 0.24801500 0.72234900 1.0 Li Li5 1 0.23009000 0.22621600 0.47486000 1.0 Li Li6 1 0.24906600 0.25016000 0.21892100 1.0 Li Li7 1 0.52032900 0.47967100 0.50000000 1.0 Li Li8 1 0.95002300 0.45725900 0.00122900 1.0 Li Li9 1 0.96603400 0.45835400 0.49615900 1.0 Li Li10 1 0.03466200 0.53034000 0.74940300 1.0 Li Li11 1 0.47277700 0.52292700 0.76520900 1.0 Li Li12 1 0.03043500 0.53057700 0.25082200 1.0 Li Li13 1 0.47707300 0.52722300 0.23479100 1.0 Li Li14 1 0.74984000 0.75093400 0.78107900 1.0 Li Li15 1 0.72319400 0.73077200 0.03043100 1.0 Li Li16 1 0.75198500 0.74622500 0.27765100 1.0 Li Li17 1 0.77378400 0.76991000 0.52513900 1.0 Li Li18 1 0.02773400 0.97526600 0.73089100 1.0 Li Li19 1 0.02473400 0.97226600 0.26910900 1.0 Li Li20 1 0.46942300 0.96956500 0.74917800 1.0 Li Li21 1 0.46966000 0.96533800 0.25059700 1.0 Ni Ni22 1 0.75128100 0.24964200 0.74821000 1.0 Ni Ni23 1 0.75035800 0.24871900 0.25179000 1.0 Ni Ni24 1 0.25321500 0.74678500 0.00000000 1.0 Ni Ni25 1 0.24525100 0.75474900 0.50000000 1.0 O O26 1 0.25085400 0.00044900 0.10431600 1.0 O O27 1 0.26938200 0.00737800 0.60762300 1.0 O O28 1 0.48329000 0.24700500 0.35138900 1.0 O O29 1 0.01552800 0.24998500 0.85454900 1.0 O O30 1 0.01487100 0.25577200 0.34194900 1.0 O O31 1 0.48955700 0.24469900 0.84508400 1.0 O O32 1 0.24713700 0.48533100 0.60385000 1.0 O O33 1 0.23497200 0.50382400 0.10537900 1.0 O O34 1 0.75299500 0.51671000 0.64861100 1.0 O O35 1 0.75530100 0.51044300 0.15491600 1.0 O O36 1 0.99262200 0.73061800 0.39237700 1.0 O O37 1 0.99955100 0.74914600 0.89568400 1.0 O O38 1 0.49617600 0.76502800 0.89462100 1.0 O O39 1 0.51466900 0.75286300 0.39615000 1.0 O O40 1 0.74422800 0.98512900 0.65805100 1.0 O O41 1 0.75001500 0.98447200 0.14545100 1.0