# generated using pymatgen data_Sr6La14Ti3Mn17O60 _symmetry_space_group_name_H-M 'P 1' _cell_length_a 5.54819225 _cell_length_b 5.55826390 _cell_length_c 55.66915613 _cell_angle_alpha 60.74957067 _cell_angle_beta 60.59692427 _cell_angle_gamma 60.96750560 _symmetry_Int_Tables_number 1 _chemical_formula_structural Sr6La14Ti3Mn17O60 _chemical_formula_sum 'Sr6 La14 Ti3 Mn17 O60' _cell_volume 1235.01843765 _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 0.25663665 0.25266972 0.02321899 1.0 Sr Sr1 1 0.24821608 0.25458520 0.12378070 1.0 Sr Sr2 1 0.24650049 0.24184611 0.62678945 1.0 Sr Sr3 1 0.24850429 0.25211086 0.72531339 1.0 Sr Sr4 1 0.25092146 0.25286270 0.82427901 1.0 Sr Sr5 1 0.25010393 0.25593477 0.92325635 1.0 La La6 1 0.25002495 0.25410094 0.22538919 1.0 La La7 1 0.75100927 0.74861427 0.07312360 1.0 La La8 1 0.24918027 0.25304072 0.32562513 1.0 La La9 1 0.75673384 0.76134173 0.17248323 1.0 La La10 1 0.24714439 0.24623151 0.42609469 1.0 La La11 1 0.74937742 0.74881070 0.27613525 1.0 La La12 1 0.24207775 0.24351598 0.52748871 1.0 La La13 1 0.74884028 0.75168129 0.37570606 1.0 La La14 1 0.74785707 0.74623050 0.47626342 1.0 La La15 1 0.74258484 0.73910097 0.57809610 1.0 La La16 1 0.74882798 0.74548783 0.67609488 1.0 La La17 1 0.75073234 0.75075146 0.77462847 1.0 La La18 1 0.74982096 0.75674047 0.87341371 1.0 La La19 1 0.75921412 0.75430557 0.97193945 1.0 Ti Ti20 1 0.00361250 0.99957382 0.99899997 1.0 Ti Ti21 1 0.00464949 0.00530158 0.09820092 1.0 Ti Ti22 1 0.00380246 0.99707263 0.20003415 1.0 Mn Mn23 1 0.50793503 0.49905757 0.04889242 1.0 Mn Mn24 1 0.49556606 0.50731407 0.14967760 1.0 Mn Mn25 1 0.99778311 0.00102895 0.40024297 1.0 Mn Mn26 1 0.50009460 0.50595020 0.24987612 1.0 Mn Mn27 1 0.99634643 0.99804440 0.50057933 1.0 Mn Mn28 1 0.49902964 0.50217681 0.35018153 1.0 Mn Mn29 1 0.99820215 0.00472184 0.29990061 1.0 Mn Mn30 1 0.49890221 0.49689697 0.45047024 1.0 Mn Mn31 1 0.50151951 0.49301869 0.55064274 1.0 Mn Mn32 1 0.00125551 0.00218750 0.79962859 1.0 Mn Mn33 1 0.49730821 0.49367351 0.65083749 1.0 Mn Mn34 1 0.99519473 0.99550698 0.60100823 1.0 Mn Mn35 1 0.99889024 0.00739213 0.89892538 1.0 Mn Mn36 1 0.50078698 0.50248149 0.75003288 1.0 Mn Mn37 1 0.99888377 0.99879720 0.70035170 1.0 Mn Mn38 1 0.49840840 0.50340264 0.84958143 1.0 Mn Mn39 1 0.50208728 0.50312363 0.94898843 1.0 O O40 1 0.17826391 0.32045299 0.07559160 1.0 O O41 1 0.33551988 0.73211916 0.01831067 1.0 O O42 1 0.22267827 0.82302886 0.07065533 1.0 O O43 1 0.77909781 0.15709014 0.03109091 1.0 O O44 1 0.18204417 0.30931896 0.17624488 1.0 O O45 1 0.68952506 0.26454828 0.08008630 1.0 O O46 1 0.29333683 0.77893695 0.11742871 1.0 O O47 1 0.80833191 0.69268037 0.02614700 1.0 O O48 1 0.25002077 0.79371217 0.17018497 1.0 O O49 1 0.73622716 0.20577814 0.13174325 1.0 O O50 1 0.18589124 0.32934426 0.27351932 1.0 O O51 1 0.69583308 0.22166298 0.18363765 1.0 O O52 1 0.33428093 0.74809726 0.21638748 1.0 O O53 1 0.79425636 0.71026030 0.12673780 1.0 O O54 1 0.23765825 0.83813197 0.26798480 1.0 O O55 1 0.77651560 0.15631145 0.23158981 1.0 O O56 1 0.18049592 0.32951794 0.37424217 1.0 O O57 1 0.67607910 0.25837882 0.28217316 1.0 O O58 1 0.32034322 0.75271085 0.31765409 1.0 O O59 1 0.82976088 0.67709950 0.22515332 1.0 O O60 1 0.24577426 0.83055990 0.36808231 1.0 O O61 1 0.75456184 0.17299630 0.33186253 1.0 O O62 1 0.18101433 0.32240733 0.47401476 1.0 O O63 1 0.67848310 0.25007849 0.38249353 1.0 O O64 1 0.31811171 0.75468307 0.41787973 1.0 O O65 1 0.81977314 0.67331960 0.32461626 1.0 O O66 1 0.24539114 0.82113311 0.46850456 1.0 O O67 1 0.75087078 0.17169675 0.43221289 1.0 O O68 1 0.18708906 0.31501456 0.57347802 1.0 O O69 1 0.67943843 0.24678747 0.48249000 1.0 O O70 1 0.31517200 0.75233947 0.51831231 1.0 O O71 1 0.81869281 0.67138376 0.42483127 1.0 O O72 1 0.25399226 0.80846560 0.56909549 1.0 O O73 1 0.74765343 0.17395214 0.53222395 1.0 O O74 1 0.18443310 0.30725493 0.67522577 1.0 O O75 1 0.70647061 0.24745311 0.57969882 1.0 O O76 1 0.30568882 0.74340915 0.61950794 1.0 O O77 1 0.81513821 0.67655739 0.52416246 1.0 O O78 1 0.24761988 0.79170659 0.67093476 1.0 O O79 1 0.74700847 0.18453512 0.63137262 1.0 O O80 1 0.19190470 0.31493362 0.77480418 1.0 O O81 1 0.70379983 0.24613252 0.67974613 1.0 O O82 1 0.31082943 0.75241846 0.71894985 1.0 O O83 1 0.79552256 0.69840014 0.62407444 1.0 O O84 1 0.25381028 0.79938194 0.77021291 1.0 O O85 1 0.75048920 0.19245526 0.73096923 1.0 O O86 1 0.18354842 0.31766938 0.87478888 1.0 O O87 1 0.70838024 0.25484728 0.77929946 1.0 O O88 1 0.31186039 0.74865309 0.81886510 1.0 O O89 1 0.79808458 0.70468132 0.72506279 1.0 O O90 1 0.24271992 0.79838800 0.87026360 1.0 O O91 1 0.75400016 0.19014163 0.83051655 1.0 O O92 1 0.19365224 0.30119725 0.97582635 1.0 O O93 1 0.69612680 0.25303302 0.87934097 1.0 O O94 1 0.29655296 0.76446102 0.91873538 1.0 O O95 1 0.79422709 0.70690474 0.82526601 1.0 O O96 1 0.25856401 0.78580143 0.97095531 1.0 O O97 1 0.73993258 0.19934631 0.93127274 1.0 O O98 1 0.72063908 0.22714812 0.98069114 1.0 O O99 1 0.79225111 0.70240434 0.92662330 1.0