# generated using pymatgen data_Li24TiCr11O36 _symmetry_space_group_name_H-M 'P 1' _cell_length_a 8.74595344 _cell_length_b 8.74595344 _cell_length_c 9.75834013 _cell_angle_alpha 81.81706304 _cell_angle_beta 81.81706304 _cell_angle_gamma 59.76867787 _symmetry_Int_Tables_number 1 _chemical_formula_structural Li24TiCr11O36 _chemical_formula_sum 'Li24 Ti1 Cr11 O36' _cell_volume 636.16767438 _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 0.82847000 0.00698000 0.25066700 1.0 Li Li1 1 0.74992100 0.25007900 0.00000000 1.0 Li Li2 1 0.66796900 0.16443900 0.75016300 1.0 Li Li3 1 0.58414400 0.08347200 0.49997800 1.0 Li Li4 1 0.50355000 0.32722500 0.25021900 1.0 Li Li5 1 0.49935800 0.99937900 0.24972900 1.0 Li Li6 1 0.33965300 0.16357000 0.74938400 1.0 Li Li7 1 0.32502800 0.50585800 0.75048500 1.0 Li Li8 1 0.24950300 0.75049700 0.50000000 1.0 Li Li9 1 0.16169900 0.33783400 0.24860700 1.0 Li Li10 1 0.16935200 0.66554300 0.25078500 1.0 Li Li11 1 0.08305000 0.58292300 0.00025900 1.0 Li Li12 1 0.00537400 0.82715500 0.74948300 1.0 Li Li13 1 0.00062100 0.50064200 0.75027100 1.0 Li Li14 1 0.99302000 0.17153000 0.74933300 1.0 Li Li15 1 0.91652800 0.41585600 0.50002200 1.0 Li Li16 1 0.83643000 0.66034700 0.25061600 1.0 Li Li17 1 0.83556100 0.33203100 0.24983700 1.0 Li Li18 1 0.67277500 0.49645000 0.74978100 1.0 Li Li19 1 0.66216600 0.83830100 0.75139300 1.0 Li Li20 1 0.49414200 0.67497200 0.24951500 1.0 Li Li21 1 0.41707700 0.91695000 0.99974100 1.0 Li Li22 1 0.33445700 0.83064800 0.74921500 1.0 Li Li23 1 0.17284500 0.99462600 0.25051700 1.0 Ti Ti24 1 0.58268000 0.41732000 0.50000000 1.0 Cr Cr25 1 0.92195400 0.07804600 0.50000000 1.0 Cr Cr26 1 0.42409300 0.57590700 0.00000000 1.0 Cr Cr27 1 0.40979500 0.25182600 0.99863600 1.0 Cr Cr28 1 0.24691300 0.41844000 0.50151100 1.0 Cr Cr29 1 0.24941400 0.08885500 0.49471700 1.0 Cr Cr30 1 0.08909000 0.91091000 0.00000000 1.0 Cr Cr31 1 0.07908200 0.24765900 0.00061200 1.0 Cr Cr32 1 0.91114500 0.75058600 0.50528300 1.0 Cr Cr33 1 0.75234100 0.92091800 0.99938800 1.0 Cr Cr34 1 0.74817400 0.59020500 0.00136400 1.0 Cr Cr35 1 0.58156000 0.75308700 0.49848900 1.0 O O36 1 0.87927000 0.02250600 0.88803700 1.0 O O37 1 0.71740900 0.21331600 0.38463500 1.0 O O38 1 0.61912200 0.11450500 0.11348300 1.0 O O39 1 0.54537300 0.05285300 0.88475700 1.0 O O40 1 0.52244700 0.38604200 0.88684300 1.0 O O41 1 0.45047400 0.30805000 0.61279100 1.0 O O42 1 0.31247500 0.44503600 0.11253000 1.0 O O43 1 0.37826600 0.52359400 0.38733100 1.0 O O44 1 0.28118200 0.14501100 0.11110500 1.0 O O45 1 0.35885500 0.21149600 0.38680700 1.0 O O46 1 0.21769300 0.71373900 0.88638200 1.0 O O47 1 0.21509500 0.35580100 0.88787600 1.0 O O48 1 0.18722600 0.04481300 0.88697700 1.0 O O49 1 0.14503500 0.28847200 0.61124000 1.0 O O50 1 0.11800600 0.62012900 0.61723900 1.0 O O51 1 0.97749400 0.12073000 0.11196300 1.0 O O52 1 0.04982100 0.55021500 0.38785500 1.0 O O53 1 0.05227100 0.19002900 0.38637200 1.0 O O54 1 0.95518700 0.81277400 0.11302300 1.0 O O55 1 0.94714700 0.45462700 0.11524300 1.0 O O56 1 0.02151300 0.88486100 0.38905000 1.0 O O57 1 0.88549500 0.38087800 0.88651700 1.0 O O58 1 0.85498900 0.71881800 0.88889500 1.0 O O59 1 0.80997100 0.94772900 0.61362800 1.0 O O60 1 0.78850400 0.64114500 0.61319300 1.0 O O61 1 0.78668400 0.28259100 0.61536500 1.0 O O62 1 0.64419900 0.78490500 0.11212400 1.0 O O63 1 0.71152800 0.85496500 0.38876000 1.0 O O64 1 0.61395800 0.47755300 0.11315700 1.0 O O65 1 0.69195000 0.54952600 0.38720900 1.0 O O66 1 0.55496400 0.68752500 0.88747000 1.0 O O67 1 0.47640600 0.62173400 0.61266900 1.0 O O68 1 0.44978500 0.95017900 0.61214500 1.0 O O69 1 0.37987100 0.88199400 0.38276100 1.0 O O70 1 0.28626100 0.78230700 0.11361800 1.0 O O71 1 0.11513900 0.97848700 0.61095000 1.0