# generated using pymatgen data_Li11V12(OF)24 _symmetry_space_group_name_H-M 'P 1' _cell_length_a 4.89196300 _cell_length_b 7.84465417 _cell_length_c 22.23519397 _cell_angle_alpha 84.44737481 _cell_angle_beta 89.32415255 _cell_angle_gamma 89.06380848 _symmetry_Int_Tables_number 1 _chemical_formula_structural Li11V12(OF)24 _chemical_formula_sum 'Li11 V12 O24 F24' _cell_volume 849.13045461 _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 0.75995000 0.97474000 0.87590400 1.0 Li Li1 1 0.24989900 0.36257300 0.79068300 1.0 Li Li2 1 0.24714400 0.86791100 0.80134300 1.0 Li Li3 1 0.22218500 0.77149600 0.69411100 1.0 Li Li4 1 0.75432100 0.30792300 0.54308100 1.0 Li Li5 1 0.25240700 0.20146900 0.46828600 1.0 Li Li6 1 0.25115000 0.69525800 0.45704300 1.0 Li Li7 1 0.22126200 0.10905600 0.36021400 1.0 Li Li8 1 0.75827300 0.63589000 0.20777900 1.0 Li Li9 1 0.24534700 0.02881000 0.12493300 1.0 Li Li10 1 0.21487400 0.46025800 0.04387400 1.0 V V11 1 0.22753900 0.21136200 0.94059300 1.0 V V12 1 0.27373100 0.71802500 0.94485400 1.0 V V13 1 0.76987200 0.12182800 0.71979900 1.0 V V14 1 0.71666600 0.60909400 0.71941600 1.0 V V15 1 0.27097300 0.05261500 0.61280200 1.0 V V16 1 0.22059900 0.54227400 0.60755300 1.0 V V17 1 0.77457300 0.45357400 0.38723200 1.0 V V18 1 0.71708000 0.94255300 0.38611500 1.0 V V19 1 0.27535600 0.38770700 0.27535900 1.0 V V20 1 0.22018400 0.87420300 0.27393800 1.0 V V21 1 0.72314800 0.27380700 0.05531700 1.0 V V22 1 0.76847400 0.79070800 0.05617200 1.0 O O23 1 0.96216900 0.30215300 0.98896000 1.0 O O24 1 0.10632300 0.01848200 0.93885600 1.0 O O25 1 0.55400500 0.80415200 0.98886900 1.0 O O26 1 0.37186100 0.51903500 0.94191100 1.0 O O27 1 0.89259400 0.31408000 0.72631200 1.0 O O28 1 0.06371100 0.01533300 0.68086800 1.0 O O29 1 0.59633700 0.80693300 0.72717400 1.0 O O30 1 0.44754300 0.53139800 0.67676500 1.0 O O31 1 0.56199400 0.14549500 0.65516000 1.0 O O32 1 0.95475800 0.63789500 0.65379700 1.0 O O33 1 0.10212700 0.34868800 0.60679600 1.0 O O34 1 0.37613700 0.85533300 0.60818100 1.0 O O35 1 0.59557300 0.14025600 0.39405300 1.0 O O36 1 0.89258300 0.64785400 0.39304200 1.0 O O37 1 0.06065700 0.35359400 0.34703200 1.0 O O38 1 0.44777700 0.86494300 0.34333200 1.0 O O39 1 0.55531900 0.47344600 0.32343500 1.0 O O40 1 0.37578600 0.18836000 0.27369400 1.0 O O41 1 0.95541100 0.97140500 0.32080700 1.0 O O42 1 0.09923500 0.68167100 0.27311300 1.0 O O43 1 0.61650400 0.47325100 0.05990200 1.0 O O44 1 0.45214200 0.19975100 0.00889100 1.0 O O45 1 0.89434000 0.98282300 0.05878300 1.0 O O46 1 0.05338300 0.68895900 0.01249300 1.0 F F47 1 0.55423500 0.18139700 0.89808700 1.0 F F48 1 0.97405400 0.73668500 0.89435100 1.0 F F49 1 0.09273100 0.31855900 0.86929900 1.0 F F50 1 0.44688400 0.83120200 0.87298900 1.0 F F51 1 0.58355000 0.49812000 0.79119600 1.0 F F52 1 0.45426000 0.12351900 0.77050300 1.0 F F53 1 0.92238100 0.00442600 0.79452300 1.0 F F54 1 0.06099900 0.64584300 0.76459000 1.0 F F55 1 0.97154000 0.06788300 0.56274900 1.0 F F56 1 0.54930300 0.51507400 0.56551600 1.0 F F57 1 0.44277400 0.16645500 0.54052100 1.0 F F58 1 0.09189100 0.64961600 0.53569600 1.0 F F59 1 0.92554800 0.33689800 0.46200400 1.0 F F60 1 0.58406700 0.83125400 0.45776000 1.0 F F61 1 0.45726300 0.45536100 0.43839800 1.0 F F62 1 0.06076200 0.98004700 0.43128500 1.0 F F63 1 0.96181500 0.39466000 0.23147500 1.0 F F64 1 0.08737000 0.98294000 0.20315700 1.0 F F65 1 0.54726100 0.84710900 0.23210800 1.0 F F66 1 0.44255800 0.49722500 0.20812100 1.0 F F67 1 0.57184600 0.16538300 0.12464200 1.0 F F68 1 0.90674700 0.67784300 0.12697100 1.0 F F69 1 0.05414300 0.28336500 0.09951700 1.0 F F70 1 0.44731900 0.81555900 0.10076400 1.0