# generated using pymatgen data_Li11Nb12O36 _symmetry_space_group_name_H-M 'P 1' _cell_length_a 5.26560800 _cell_length_b 5.58054011 _cell_length_c 26.08784247 _cell_angle_alpha 92.66580577 _cell_angle_beta 89.92000107 _cell_angle_gamma 118.14633676 _symmetry_Int_Tables_number 1 _chemical_formula_structural Li11Nb12O36 _chemical_formula_sum 'Li11 Nb12 O36' _cell_volume 675.02186747 _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 0.37470300 0.75137100 0.95320400 1.0 Li Li1 1 0.70885500 0.41751200 0.78640100 1.0 Li Li2 1 0.97369200 0.94649400 0.87869100 1.0 Li Li3 1 0.04283200 0.08392400 0.61960400 1.0 Li Li4 1 0.30614500 0.61313600 0.71170000 1.0 Li Li5 1 0.37559500 0.74877200 0.45288400 1.0 Li Li6 1 0.63820600 0.27971400 0.54494700 1.0 Li Li7 1 0.97132000 0.94094900 0.37903100 1.0 Li Li8 1 0.96797000 0.93597300 0.12915800 1.0 Li Li9 1 0.30300200 0.60261600 0.21112500 1.0 Li Li10 1 0.63661000 0.27271200 0.04605000 1.0 Nb Nb11 1 0.01048400 0.02464000 0.99893000 1.0 Nb Nb12 1 0.34665500 0.69492400 0.83169200 1.0 Nb Nb13 1 0.67810600 0.35973300 0.91490800 1.0 Nb Nb14 1 0.68072900 0.36238200 0.66468300 1.0 Nb Nb15 1 0.01374700 0.02914000 0.74803100 1.0 Nb Nb16 1 0.01210700 0.02708500 0.49786300 1.0 Nb Nb17 1 0.34743000 0.69468900 0.58112600 1.0 Nb Nb18 1 0.35093200 0.69154100 0.33150800 1.0 Nb Nb19 1 0.68063000 0.35829500 0.41413000 1.0 Nb Nb20 1 0.68310100 0.35073700 0.16660800 1.0 Nb Nb21 1 0.00272300 0.01354600 0.25320200 1.0 Nb Nb22 1 0.34247400 0.67601600 0.08175100 1.0 O O23 1 0.61753800 0.98862000 0.87689800 1.0 O O24 1 0.78221000 0.19394400 0.97932200 1.0 O O25 1 0.24896300 0.11141200 0.93862800 1.0 O O26 1 0.07716000 0.54001500 0.89594900 1.0 O O27 1 0.54395100 0.45842000 0.85518200 1.0 O O28 1 0.95002600 0.65475600 0.71003000 1.0 O O29 1 0.71039100 0.66593100 0.95768900 1.0 O O30 1 0.11467800 0.86054600 0.81262200 1.0 O O31 1 0.58182500 0.77839200 0.77160800 1.0 O O32 1 0.41274900 0.20746500 0.72929600 1.0 O O33 1 0.87782000 0.12539800 0.68815800 1.0 O O34 1 0.28211100 0.32149800 0.54345400 1.0 O O35 1 0.04265700 0.33080700 0.79099600 1.0 O O36 1 0.44761100 0.52707300 0.64600000 1.0 O O37 1 0.91501600 0.44508900 0.60480500 1.0 O O38 1 0.74627600 0.87390700 0.56262300 1.0 O O39 1 0.21279400 0.79398000 0.52153200 1.0 O O40 1 0.61990300 0.99284200 0.37676900 1.0 O O41 1 0.37656900 0.99664800 0.62433900 1.0 O O42 1 0.78031700 0.19495300 0.47925600 1.0 O O43 1 0.24816000 0.11155600 0.43808900 1.0 O O44 1 0.07753300 0.54838300 0.39430700 1.0 O O45 1 0.53587700 0.47441600 0.35900600 1.0 O O46 1 0.95754800 0.66634200 0.20726900 1.0 O O47 1 0.71448800 0.66275300 0.45885100 1.0 O O48 1 0.11947200 0.87229400 0.31272200 1.0 O O49 1 0.57934100 0.79408800 0.26993100 1.0 O O50 1 0.38784300 0.19675900 0.22219000 1.0 O O51 1 0.87048300 0.12817700 0.18899700 1.0 O O52 1 0.29019900 0.33093700 0.04179100 1.0 O O53 1 0.07409700 0.33898200 0.29053400 1.0 O O54 1 0.47027000 0.54956600 0.14501600 1.0 O O55 1 0.91893600 0.46344000 0.10442300 1.0 O O56 1 0.74607900 0.87467200 0.06202500 1.0 O O57 1 0.21446600 0.79791400 0.02238100 1.0 O O58 1 0.38232800 0.00358900 0.12311800 1.0