# generated using pymatgen data_La7SmMn7CuO20 _symmetry_space_group_name_H-M 'P 1' _cell_length_a 11.34844578 _cell_length_b 11.73302220 _cell_length_c 17.85156416 _cell_angle_alpha 109.30211606 _cell_angle_beta 108.56344683 _cell_angle_gamma 90.01441399 _symmetry_Int_Tables_number 1 _chemical_formula_structural La7SmMn7CuO20 _chemical_formula_sum 'La28 Sm4 Mn28 Cu4 O80' _cell_volume 2111.80156495 _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 La La0 1 0.29212600 0.06207000 0.11016900 1.0 La La1 1 0.29874000 0.06542900 0.61162500 1.0 La La2 1 0.29894700 0.56494700 0.61378300 1.0 La La3 1 0.79947900 0.06574300 0.61313600 1.0 La La4 1 0.80322600 0.57042800 0.10669900 1.0 La La5 1 0.80008900 0.56555600 0.61358100 1.0 La La6 1 0.18628200 0.43347900 0.38614000 1.0 La La7 1 0.18175300 0.43621800 0.89164100 1.0 La La8 1 0.18543800 0.93349200 0.38443700 1.0 La La9 1 0.18424900 0.93529100 0.89038000 1.0 La La10 1 0.68525700 0.43527300 0.38553300 1.0 La La11 1 0.68550300 0.93344700 0.38733400 1.0 La La12 1 0.68776100 0.93249400 0.89367200 1.0 La La13 1 0.04662700 0.28840200 0.10900100 1.0 La La14 1 0.04929100 0.29899400 0.61359800 1.0 La La15 1 0.04885000 0.79813000 0.61261400 1.0 La La16 1 0.54943800 0.28410000 0.10859500 1.0 La La17 1 0.54867400 0.29830300 0.61417100 1.0 La La18 1 0.55014000 0.79937200 0.11022900 1.0 La La19 1 0.54938500 0.79801100 0.61347000 1.0 La La20 1 0.43586200 0.20209900 0.38671800 1.0 La La21 1 0.43953900 0.20564800 0.88982100 1.0 La La22 1 0.43498500 0.70009700 0.38446200 1.0 La La23 1 0.44415600 0.71091200 0.89249700 1.0 La La24 1 0.93454000 0.20216300 0.38569300 1.0 La La25 1 0.93690700 0.20971200 0.89153600 1.0 La La26 1 0.93427000 0.70054400 0.38499400 1.0 La La27 1 0.93165300 0.71130300 0.89362100 1.0 Sm Sm28 1 0.28669600 0.56990000 0.10893900 1.0 Sm Sm29 1 0.79432200 0.06319800 0.10801600 1.0 Sm Sm30 1 0.69020000 0.43521600 0.89278700 1.0 Sm Sm31 1 0.04209700 0.78924900 0.10784200 1.0 Mn Mn32 1 0.00133800 0.99975400 0.49936800 1.0 Mn Mn33 1 0.00106100 0.49999800 0.49940900 1.0 Mn Mn34 1 0.50075400 0.99937000 0.49939300 1.0 Mn Mn35 1 0.50227600 0.50202900 0.00244500 1.0 Mn Mn36 1 0.50119300 0.49992600 0.49966800 1.0 Mn Mn37 1 0.25272500 0.25241700 0.00259600 1.0 Mn Mn38 1 0.25073700 0.24987200 0.49956100 1.0 Mn Mn39 1 0.25007600 0.75043100 0.00020600 1.0 Mn Mn40 1 0.25132200 0.74959700 0.49946000 1.0 Mn Mn41 1 0.75153500 0.24936300 0.00073100 1.0 Mn Mn42 1 0.75086200 0.25000800 0.49968000 1.0 Mn Mn43 1 0.75055600 0.74938400 0.49921500 1.0 Mn Mn44 1 0.10400900 0.09628300 0.24971000 1.0 Mn Mn45 1 0.10786900 0.10188800 0.75184400 1.0 Mn Mn46 1 0.10804000 0.59914500 0.25055300 1.0 Mn Mn47 1 0.10773400 0.60201000 0.75292000 1.0 Mn Mn48 1 0.60812900 0.09839500 0.25176600 1.0 Mn Mn49 1 0.60819500 0.10092100 0.75137400 1.0 Mn Mn50 1 0.60264500 0.59737700 0.24378200 1.0 Mn Mn51 1 0.60594000 0.59674300 0.74965400 1.0 Mn Mn52 1 0.35581600 0.39998800 0.24621600 1.0 Mn Mn53 1 0.35944700 0.40193200 0.75330300 1.0 Mn Mn54 1 0.35240200 0.89579000 0.24661400 1.0 Mn Mn55 1 0.35666700 0.90120200 0.74854600 1.0 Mn Mn56 1 0.85474600 0.39805200 0.24686200 1.0 Mn Mn57 1 0.85432100 0.40204800 0.74915800 1.0 Mn Mn58 1 0.85916500 0.90319000 0.25041400 1.0 Mn Mn59 1 0.85578200 0.90096800 0.74954300 1.0 Cu Cu60 1 0.99740500 0.99898000 0.00127300 1.0 Cu Cu61 1 0.99846200 0.50021300 0.00097700 1.0 Cu Cu62 1 0.49688200 0.00052000 0.99995900 1.0 Cu Cu63 1 0.74835800 0.75105400 0.00149700 1.0 O O64 1 0.11184400 0.11670200 0.47565500 1.0 O O65 1 0.11299900 0.12079700 0.98196600 1.0 O O66 1 0.11079200 0.61652600 0.47473700 1.0 O O67 1 0.11447000 0.61948600 0.98558200 1.0 O O68 1 0.61059200 0.11600000 0.47432600 1.0 O O69 1 0.61279800 0.12029800 0.98343000 1.0 O O70 1 0.61061100 0.61632400 0.47416300 1.0 O O71 1 0.61572300 0.61419900 0.97605700 1.0 O O72 1 0.13441400 0.38487100 0.02178400 1.0 O O73 1 0.13590200 0.38340100 0.52448400 1.0 O O74 1 0.12956100 0.87956800 0.02384700 1.0 O O75 1 0.13641400 0.88348300 0.52516800 1.0 O O76 1 0.63338200 0.38037400 0.01942800 1.0 O O77 1 0.63529000 0.38276800 0.52424400 1.0 O O78 1 0.63322800 0.88436500 0.02069400 1.0 O O79 1 0.63595600 0.88313900 0.52305500 1.0 O O80 1 0.36171700 0.10867700 0.47649000 1.0 O O81 1 0.36526200 0.11264400 0.97894000 1.0 O O82 1 0.36091500 0.60721700 0.47361600 1.0 O O83 1 0.36390400 0.61044500 0.97875100 1.0 O O84 1 0.86140000 0.10823300 0.47491100 1.0 O O85 1 0.86432900 0.11043200 0.98158800 1.0 O O86 1 0.86148200 0.60861000 0.47450700 1.0 O O87 1 0.86086900 0.60686100 0.98118500 1.0 O O88 1 0.38414400 0.39576700 0.02531400 1.0 O O89 1 0.38593900 0.39060700 0.52375600 1.0 O O90 1 0.38454600 0.89057500 0.02097100 1.0 O O91 1 0.38732600 0.89159600 0.52554400 1.0 O O92 1 0.88219300 0.38746600 0.01597300 1.0 O O93 1 0.88671300 0.39191700 0.52471000 1.0 O O94 1 0.88220900 0.89128600 0.02412200 1.0 O O95 1 0.88484300 0.89044300 0.52235800 1.0 O O96 1 0.12333600 0.13338500 0.15324400 1.0 O O97 1 0.10167600 0.12006000 0.64067300 1.0 O O98 1 0.12205200 0.63384700 0.15156300 1.0 O O99 1 0.10178500 0.61990200 0.64114800 1.0 O O100 1 0.62869300 0.12717900 0.15271600 1.0 O O101 1 0.60242700 0.11976000 0.64029100 1.0 O O102 1 0.61464900 0.62456500 0.14010500 1.0 O O103 1 0.60129300 0.61710400 0.63916500 1.0 O O104 1 0.46073900 0.38034400 0.35767100 1.0 O O105 1 0.47329000 0.38000500 0.85937900 1.0 O O106 1 0.45780300 0.88000700 0.35877400 1.0 O O107 1 0.47065100 0.87038100 0.84892200 1.0 O O108 1 0.96059600 0.38023300 0.35870000 1.0 O O109 1 0.96783700 0.36949200 0.84909500 1.0 O O110 1 0.96361100 0.88162900 0.36056900 1.0 O O111 1 0.97063200 0.87047300 0.85013700 1.0 O O112 1 0.35845800 0.26772300 0.14038700 1.0 O O113 1 0.35309600 0.27277100 0.64109700 1.0 O O114 1 0.35928700 0.76995000 0.13914800 1.0 O O115 1 0.35126500 0.76968000 0.63827700 1.0 O O116 1 0.85404400 0.26832800 0.13853300 1.0 O O117 1 0.84918600 0.27130200 0.63844000 1.0 O O118 1 0.87705200 0.77214900 0.15172900 1.0 O O119 1 0.85011800 0.77105000 0.63794900 1.0 O O120 1 0.21059200 0.22652000 0.36101200 1.0 O O121 1 0.21703400 0.22939700 0.86123400 1.0 O O122 1 0.21303700 0.73034600 0.36150200 1.0 O O123 1 0.21781900 0.72895100 0.86156500 1.0 O O124 1 0.71268100 0.23036000 0.36162800 1.0 O O125 1 0.71273400 0.22939300 0.86117100 1.0 O O126 1 0.70809400 0.72614000 0.35727000 1.0 O O127 1 0.71783600 0.72883800 0.85087900 1.0 O O128 1 0.42305800 0.06664600 0.25064000 1.0 O O129 1 0.42124200 0.07149600 0.74945700 1.0 O O130 1 0.41540800 0.57043600 0.24350000 1.0 O O131 1 0.42129600 0.56951100 0.75014400 1.0 O O132 1 0.91655900 0.07150000 0.24553700 1.0 O O133 1 0.92168700 0.07042600 0.74996500 1.0 O O134 1 0.92297300 0.56761000 0.24929800 1.0 O O135 1 0.92114900 0.57040500 0.75062500 1.0 O O136 1 0.17233100 0.42992000 0.25002100 1.0 O O137 1 0.17263700 0.43085600 0.75077300 1.0 O O138 1 0.16605200 0.92523300 0.24458200 1.0 O O139 1 0.17238100 0.93125000 0.75004400 1.0 O O140 1 0.67005900 0.43053200 0.24872700 1.0 O O141 1 0.67117300 0.42863100 0.75579000 1.0 O O142 1 0.67414700 0.92948500 0.25134200 1.0 O O143 1 0.67174700 0.93165300 0.74979300 1.0