# generated using pymatgen data_La17Mn18O54 _symmetry_space_group_name_H-M 'P 1' _cell_length_a 9.69194000 _cell_length_b 9.72189091 _cell_length_c 12.40180624 _cell_angle_alpha 82.56483296 _cell_angle_beta 74.10859442 _cell_angle_gamma 80.50653598 _symmetry_Int_Tables_number 1 _chemical_formula_structural La17Mn18O54 _chemical_formula_sum 'La17 Mn18 O54' _cell_volume 1104.11643024 _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 La La0 1 0.86081000 0.22050800 0.80591100 1.0 La La1 1 0.30330000 0.11079300 0.02791900 1.0 La La2 1 0.37444300 0.21574500 0.30167900 1.0 La La3 1 0.53009100 0.55592900 0.14167300 1.0 La La4 1 0.80725100 0.10622100 0.51736900 1.0 La La5 1 0.97472500 0.44378500 0.36059400 1.0 La La6 1 0.24994500 0.99956800 0.74927500 1.0 La La7 1 0.41830000 0.33371700 0.58132200 1.0 La La8 1 0.02815800 0.55650800 0.63847400 1.0 La La9 1 0.19329600 0.89061000 0.46936400 1.0 La La10 1 0.47131100 0.44405600 0.86208400 1.0 La La11 1 0.63885400 0.77908500 0.69439100 1.0 La La12 1 0.90844800 0.32417500 0.09015500 1.0 La La13 1 0.08067900 0.66662000 0.91822200 1.0 La La14 1 0.69335800 0.89136700 0.98312100 1.0 La La15 1 0.12811100 0.78494200 0.19763600 1.0 La La16 1 0.58983300 0.67604700 0.40994000 1.0 Mn Mn17 1 0.99792600 0.99994200 0.00184000 1.0 Mn Mn18 1 0.66623300 0.33239100 0.33337300 1.0 Mn Mn19 1 0.11058700 0.22242900 0.55464500 1.0 Mn Mn20 1 0.55639200 0.11090700 0.77796100 1.0 Mn Mn21 1 0.33392600 0.66677500 0.66644700 1.0 Mn Mn22 1 0.61276800 0.22231800 0.05612600 1.0 Mn Mn23 1 0.77795600 0.55520300 0.88825500 1.0 Mn Mn24 1 0.05668900 0.11036000 0.27701300 1.0 Mn Mn25 1 0.22155700 0.44472400 0.11163100 1.0 Mn Mn26 1 0.50140700 0.00004300 0.49836100 1.0 Mn Mn27 1 0.27632500 0.55597800 0.38916500 1.0 Mn Mn28 1 0.44639900 0.88833300 0.22295400 1.0 Mn Mn29 1 0.72229600 0.44393500 0.60967200 1.0 Mn Mn30 1 0.88791100 0.77934700 0.44415200 1.0 Mn Mn31 1 0.16610100 0.33354600 0.83334100 1.0 Mn Mn32 1 0.94329200 0.88891900 0.72299100 1.0 Mn Mn33 1 0.38879800 0.77729000 0.94557300 1.0 Mn Mn34 1 0.83373000 0.66761700 0.16662300 1.0 O O35 1 0.31701400 0.14121500 0.53698900 1.0 O O36 1 0.05791900 0.04726200 0.65257800 1.0 O O37 1 0.76546700 0.02984000 0.75620800 1.0 O O38 1 0.12161900 0.31465300 0.68669600 1.0 O O39 1 0.05663100 0.17483400 0.90020200 1.0 O O40 1 0.79564900 0.09165900 0.00586200 1.0 O O41 1 0.56739900 0.20438500 0.90814500 1.0 O O42 1 0.98811000 0.47420200 0.86575100 1.0 O O43 1 0.49788700 0.06363800 0.12330200 1.0 O O44 1 0.72490000 0.38166700 0.98325200 1.0 O O45 1 0.64447500 0.26479500 0.19723100 1.0 O O46 1 0.03370500 0.09469900 0.12551100 1.0 O O47 1 0.42938100 0.36652600 0.08796200 1.0 O O48 1 0.79309600 0.64528500 0.02000900 1.0 O O49 1 0.17444000 0.27244700 0.21094500 1.0 O O50 1 0.72421600 0.50693300 0.23724200 1.0 O O51 1 0.10088300 0.13234900 0.42234900 1.0 O O52 1 0.45404800 0.41907200 0.35393900 1.0 O O53 1 0.87984400 0.25099400 0.31347100 1.0 O O54 1 0.23122900 0.54233300 0.24237600 1.0 O O55 1 0.64411200 0.78841200 0.19733100 1.0 O O56 1 0.59918600 0.17390300 0.44138800 1.0 O O57 1 0.16404400 0.39799300 0.45913300 1.0 O O58 1 0.38645100 0.71548000 0.32218800 1.0 O O59 1 0.53957200 0.01976300 0.64895300 1.0 O O60 1 0.90104800 0.29941900 0.57188700 1.0 O O61 1 0.31752300 0.57432000 0.53615300 1.0 O O62 1 0.67946200 0.43183800 0.46364500 1.0 O O63 1 0.09635500 0.69292300 0.42708400 1.0 O O64 1 0.43983400 0.97383100 0.36117100 1.0 O O65 1 0.60760100 0.28846800 0.67963700 1.0 O O66 1 0.83756500 0.59905700 0.54193700 1.0 O O67 1 0.38494000 0.84061300 0.57145000 1.0 O O68 1 0.34533300 0.19229000 0.79839200 1.0 O O69 1 0.76536500 0.46215700 0.75496000 1.0 O O70 1 0.12312700 0.74786100 0.68875300 1.0 O O71 1 0.54277300 0.58547300 0.64722100 1.0 O O72 1 0.89950300 0.86686900 0.57934300 1.0 O O73 1 0.28058700 0.49206500 0.76462300 1.0 O O74 1 0.83145600 0.72825200 0.79136200 1.0 O O75 1 0.21073600 0.35241600 0.97927100 1.0 O O76 1 0.56693600 0.63518200 0.91148400 1.0 O O77 1 0.98790800 0.90900500 0.86643600 1.0 O O78 1 0.34836600 0.75917700 0.79828400 1.0 O O79 1 0.27338500 0.61662200 0.01234500 1.0 O O80 1 0.50475200 0.93615700 0.87829800 1.0 O O81 1 0.01246300 0.51752500 0.13389400 1.0 O O82 1 0.42786500 0.79714400 0.09149600 1.0 O O83 1 0.21028800 0.91769500 0.97666100 1.0 O O84 1 0.95554300 0.81144200 0.08624400 1.0 O O85 1 0.87808600 0.68427300 0.31270500 1.0 O O86 1 0.23703100 0.97357100 0.23959600 1.0 O O87 1 0.96260100 0.94738700 0.35650600 1.0 O O88 1 0.67908700 0.85289700 0.48089900 1.0