# generated using pymatgen data_Sr3La9Mn11NiO36 _symmetry_space_group_name_H-M 'P 1' _cell_length_a 5.57836300 _cell_length_b 9.58407837 _cell_length_c 13.56696965 _cell_angle_alpha 90.07810892 _cell_angle_beta 90.00434565 _cell_angle_gamma 90.04029922 _symmetry_Int_Tables_number 1 _chemical_formula_structural Sr3La9Mn11NiO36 _chemical_formula_sum 'Sr3 La9 Mn11 Ni1 O36' _cell_volume 725.33639435 _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 Sr Sr0 1 0.00493500 0.83120300 0.41951400 1.0 Sr Sr1 1 0.50576000 0.33543600 0.41571300 1.0 Sr Sr2 1 0.50572200 0.00230700 0.74667600 1.0 La La3 1 0.00465400 0.16729100 0.08548300 1.0 La La4 1 0.00380300 0.49720000 0.75190700 1.0 La La5 1 0.49342600 0.99685000 0.25618900 1.0 La La6 1 0.49257500 0.66670400 0.58362400 1.0 La La7 1 0.49120200 0.33221300 0.91893700 1.0 La La8 1 0.50514000 0.66632300 0.08156000 1.0 La La9 1 0.99174500 0.50329800 0.24891100 1.0 La La10 1 0.99246600 0.16701100 0.57870400 1.0 La La11 1 0.99035800 0.83492100 0.91262000 1.0 Mn Mn12 1 0.00041900 0.16705900 0.33405400 1.0 Mn Mn13 1 0.99903900 0.83436600 0.66640800 1.0 Mn Mn14 1 0.00198000 0.83293500 0.16639700 1.0 Mn Mn15 1 0.00017600 0.49999500 0.49951900 1.0 Mn Mn16 1 0.99699800 0.16636700 0.83306600 1.0 Mn Mn17 1 0.50054100 0.33353700 0.16722300 1.0 Mn Mn18 1 0.49976400 0.66651500 0.83338100 1.0 Mn Mn19 1 0.49956500 0.00003100 0.50013200 1.0 Mn Mn20 1 0.49971200 0.99985200 0.99980900 1.0 Mn Mn21 1 0.49935400 0.66663000 0.33426400 1.0 Mn Mn22 1 0.50136100 0.33246400 0.66598700 1.0 Ni Ni23 1 0.99940100 0.50017500 0.99996700 1.0 O O24 1 0.06962800 0.66940600 0.08679700 1.0 O O25 1 0.05345900 0.33141600 0.41769700 1.0 O O26 1 0.05554300 0.99802600 0.75444700 1.0 O O27 1 0.24969500 0.38614200 0.07371400 1.0 O O28 1 0.24801200 0.06218700 0.40578400 1.0 O O29 1 0.24650600 0.71987100 0.74005700 1.0 O O30 1 0.25116000 0.77175500 0.26011000 1.0 O O31 1 0.24423300 0.44100200 0.59964200 1.0 O O32 1 0.24356600 0.10861600 0.93301200 1.0 O O33 1 0.25917700 0.22172300 0.23719600 1.0 O O34 1 0.26185000 0.55618000 0.90377900 1.0 O O35 1 0.25994000 0.89068500 0.57694200 1.0 O O36 1 0.25563600 0.94157700 0.09844500 1.0 O O37 1 0.26354900 0.60155100 0.43202100 1.0 O O38 1 0.25694300 0.27547700 0.76574000 1.0 O O39 1 0.43011300 0.50136000 0.24814100 1.0 O O40 1 0.43013600 0.16684100 0.58391400 1.0 O O41 1 0.42892600 0.83037900 0.91994800 1.0 O O42 1 0.56791200 0.16723100 0.08303700 1.0 O O43 1 0.55314100 0.83553000 0.41440100 1.0 O O44 1 0.56681900 0.50077300 0.74844500 1.0 O O45 1 0.74342100 0.72609600 0.23375700 1.0 O O46 1 0.74990400 0.39538300 0.57303900 1.0 O O47 1 0.74991600 0.06202300 0.90709300 1.0 O O48 1 0.73769800 0.44341600 0.09615700 1.0 O O49 1 0.74956000 0.10432900 0.42548900 1.0 O O50 1 0.74712400 0.77017400 0.76189700 1.0 O O51 1 0.75582400 0.89106900 0.06757000 1.0 O O52 1 0.76309900 0.56648500 0.40164800 1.0 O O53 1 0.76259700 0.23257900 0.73416700 1.0 O O54 1 0.76144700 0.27710200 0.25502500 1.0 O O55 1 0.74977300 0.61338800 0.92621000 1.0 O O56 1 0.76164400 0.94134900 0.59087100 1.0 O O57 1 0.93063600 0.00218200 0.24387400 1.0 O O58 1 0.93362100 0.66526400 0.58665000 1.0 O O59 1 0.92769600 0.33075200 0.91323700 1.0