# generated using pymatgen data_Li8Mn2O9 _symmetry_space_group_name_H-M 'P 1' _cell_length_a 5.74174400 _cell_length_b 8.66739497 _cell_length_c 14.88346891 _cell_angle_alpha 87.13214779 _cell_angle_beta 100.80204979 _cell_angle_gamma 108.98378925 _symmetry_Int_Tables_number 1 _chemical_formula_structural Li8Mn2O9 _chemical_formula_sum 'Li32 Mn8 O36' _cell_volume 687.94605329 _cell_formula_units_Z 4 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 0.90259200 0.12212000 0.96879300 1.0 Li Li1 1 0.17163100 0.62289300 0.95105400 1.0 Li Li2 1 0.67164700 0.62824400 0.95952400 1.0 Li Li3 1 0.43660400 0.12670400 0.95971700 1.0 Li Li4 1 0.25814600 0.40805800 0.84696400 1.0 Li Li5 1 0.97463900 0.84585100 0.84830300 1.0 Li Li6 1 0.59234300 0.62584800 0.75895000 1.0 Li Li7 1 0.05135200 0.62557600 0.75640700 1.0 Li Li8 1 0.79190000 0.12330500 0.74132600 1.0 Li Li9 1 0.32988600 0.12263900 0.74107800 1.0 Li Li10 1 0.12611800 0.34188400 0.65616700 1.0 Li Li11 1 0.40286300 0.90326800 0.64783800 1.0 Li Li12 1 0.48286600 0.62881200 0.54147700 1.0 Li Li13 1 0.71256500 0.12752700 0.54216400 1.0 Li Li14 1 0.93595100 0.62278800 0.52974700 1.0 Li Li15 1 0.79155800 0.87795900 0.45296100 1.0 Li Li16 1 0.20844200 0.12204100 0.54703900 1.0 Li Li17 1 0.06404900 0.37721200 0.47025300 1.0 Li Li18 1 0.28743500 0.87247300 0.45783600 1.0 Li Li19 1 0.51713400 0.37118800 0.45852300 1.0 Li Li20 1 0.59713700 0.09673200 0.35216200 1.0 Li Li21 1 0.87388200 0.65811600 0.34383300 1.0 Li Li22 1 0.67011400 0.87736100 0.25892200 1.0 Li Li23 1 0.20810000 0.87669500 0.25867400 1.0 Li Li24 1 0.94864800 0.37442400 0.24359300 1.0 Li Li25 1 0.40765700 0.37415200 0.24105000 1.0 Li Li26 1 0.02536100 0.15414900 0.15169700 1.0 Li Li27 1 0.74185400 0.59194200 0.15303600 1.0 Li Li28 1 0.56339600 0.87329600 0.04028300 1.0 Li Li29 1 0.32835300 0.37175600 0.04047600 1.0 Li Li30 1 0.82836900 0.37710700 0.04894600 1.0 Li Li31 1 0.09740800 0.87788000 0.03120700 1.0 Mn Mn32 1 0.49619000 0.87861000 0.84867700 1.0 Mn Mn33 1 0.74087800 0.37001400 0.85551000 1.0 Mn Mn34 1 0.89020900 0.87162400 0.64897900 1.0 Mn Mn35 1 0.64426300 0.37970100 0.64750500 1.0 Mn Mn36 1 0.35573700 0.62029900 0.35249500 1.0 Mn Mn37 1 0.10979100 0.12837600 0.35102100 1.0 Mn Mn38 1 0.25912200 0.62998600 0.14449000 1.0 Mn Mn39 1 0.50381000 0.12139000 0.15132300 1.0 O O40 1 0.77455500 0.88334900 0.93942000 1.0 O O41 1 0.29836800 0.88377600 0.93442400 1.0 O O42 1 0.01923700 0.35879700 0.93828200 1.0 O O43 1 0.53819900 0.36660200 0.93977100 1.0 O O44 1 0.37714900 0.64895500 0.84504200 1.0 O O45 1 0.85776100 0.59889000 0.85814100 1.0 O O46 1 0.60962200 0.12228400 0.84597400 1.0 O O47 1 0.69355700 0.87576900 0.74993100 1.0 O O48 1 0.19207900 0.87312900 0.74750600 1.0 O O49 1 0.92176000 0.37449200 0.75025200 1.0 O O50 1 0.46410400 0.37405300 0.75168600 1.0 O O51 1 0.00771700 0.10051500 0.65410400 1.0 O O52 1 0.76846300 0.62734500 0.65418200 1.0 O O53 1 0.52623000 0.15086100 0.64217600 1.0 O O54 1 0.60747400 0.86908000 0.56178500 1.0 O O55 1 0.35981300 0.38942500 0.56603300 1.0 O O56 1 0.07497100 0.86292100 0.55969500 1.0 O O57 1 0.84049400 0.38599200 0.55969300 1.0 O O58 1 0.15950600 0.61400800 0.44030700 1.0 O O59 1 0.92502900 0.13707900 0.44030500 1.0 O O60 1 0.64018700 0.61057500 0.43396700 1.0 O O61 1 0.39252600 0.13092000 0.43821500 1.0 O O62 1 0.47377000 0.84913900 0.35782400 1.0 O O63 1 0.23153700 0.37265500 0.34581800 1.0 O O64 1 0.99228300 0.89948500 0.34589600 1.0 O O65 1 0.53589600 0.62594700 0.24831400 1.0 O O66 1 0.07824000 0.62550800 0.24974800 1.0 O O67 1 0.80792100 0.12687100 0.25249400 1.0 O O68 1 0.30644300 0.12423100 0.25006900 1.0 O O69 1 0.39037800 0.87771600 0.15402600 1.0 O O70 1 0.14223900 0.40111000 0.14185900 1.0 O O71 1 0.62285100 0.35104500 0.15495800 1.0 O O72 1 0.46180100 0.63339800 0.06022900 1.0 O O73 1 0.98076300 0.64120300 0.06171800 1.0 O O74 1 0.70163200 0.11622400 0.06557600 1.0 O O75 1 0.22544500 0.11665100 0.06058000 1.0