# generated using pymatgen data_Sr2Ca2FeCo3O10 _symmetry_space_group_name_H-M 'P 1' _cell_length_a 10.78714324 _cell_length_b 11.23753033 _cell_length_c 17.46665291 _cell_angle_alpha 108.73557463 _cell_angle_beta 107.98698990 _cell_angle_gamma 90.14474535 _symmetry_Int_Tables_number 1 _chemical_formula_structural Sr2Ca2FeCo3O10 _chemical_formula_sum 'Sr16 Ca16 Fe8 Co24 O80' _cell_volume 1894.93181426 _cell_formula_units_Z 8 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 0.30399878 0.56597255 0.60925113 1.0 Sr Sr1 1 0.80661706 0.06219031 0.60888849 1.0 Sr Sr2 1 0.80973213 0.56007759 0.61042818 1.0 Sr Sr3 1 0.19288351 0.43896060 0.38235834 1.0 Sr Sr4 1 0.20218581 0.43776244 0.89571529 1.0 Sr Sr5 1 0.69380225 0.43139562 0.38355393 1.0 Sr Sr6 1 0.69560086 0.93198824 0.38220005 1.0 Sr Sr7 1 0.69930443 0.94189630 0.89360372 1.0 Sr Sr8 1 0.05416429 0.29396831 0.60998266 1.0 Sr Sr9 1 0.06195113 0.79754028 0.60940553 1.0 Sr Sr10 1 0.55857833 0.29657097 0.61076683 1.0 Sr Sr11 1 0.55452884 0.79875236 0.61031097 1.0 Sr Sr12 1 0.44433180 0.20219358 0.38345650 1.0 Sr Sr13 1 0.45284801 0.20574485 0.89316628 1.0 Sr Sr14 1 0.94096445 0.19905086 0.38448939 1.0 Sr Sr15 1 0.94551030 0.20211995 0.89420328 1.0 Ca Ca16 1 0.30127660 0.06771139 0.10722547 1.0 Ca Ca17 1 0.30352437 0.06540120 0.60724709 1.0 Ca Ca18 1 0.30933465 0.56554056 0.11133605 1.0 Ca Ca19 1 0.80498599 0.06983715 0.10901550 1.0 Ca Ca20 1 0.80348198 0.56658199 0.11107245 1.0 Ca Ca21 1 0.19288403 0.92885241 0.38788061 1.0 Ca Ca22 1 0.19601382 0.93211786 0.89713609 1.0 Ca Ca23 1 0.69637973 0.43319827 0.89803534 1.0 Ca Ca24 1 0.05475742 0.28911490 0.10840209 1.0 Ca Ca25 1 0.05635024 0.79249787 0.10985931 1.0 Ca Ca26 1 0.55189144 0.29600445 0.10752549 1.0 Ca Ca27 1 0.55250160 0.78889214 0.10760825 1.0 Ca Ca28 1 0.44004692 0.70243036 0.38582504 1.0 Ca Ca29 1 0.44301022 0.71284802 0.89569139 1.0 Ca Ca30 1 0.95160900 0.70542149 0.38751851 1.0 Ca Ca31 1 0.95019578 0.71565407 0.89740797 1.0 Fe Fe32 1 0.11510289 0.09085540 0.75674556 1.0 Fe Fe33 1 0.10922697 0.59614018 0.75442745 1.0 Fe Fe34 1 0.60971540 0.59348675 0.75599914 1.0 Fe Fe35 1 0.36056150 0.41133077 0.75247224 1.0 Fe Fe36 1 0.35223439 0.90425285 0.24643505 1.0 Fe Fe37 1 0.35894395 0.91086780 0.75484399 1.0 Fe Fe38 1 0.85781819 0.41535390 0.75914808 1.0 Fe Fe39 1 0.86143736 0.90746739 0.75162736 1.0 Co Co40 1 0.00920623 0.00192418 0.00634428 1.0 Co Co41 1 0.00393992 0.99733802 0.49604935 1.0 Co Co42 1 0.00566013 0.49994975 0.00459474 1.0 Co Co43 1 0.00147691 0.49870158 0.49593614 1.0 Co Co44 1 0.50894059 0.00414047 0.00613372 1.0 Co Co45 1 0.49924229 0.99454672 0.49239097 1.0 Co Co46 1 0.50838871 0.50309943 0.00403714 1.0 Co Co47 1 0.50497165 0.50159894 0.50105072 1.0 Co Co48 1 0.25674503 0.25125794 0.00413795 1.0 Co Co49 1 0.25196478 0.24768428 0.49694026 1.0 Co Co50 1 0.25966450 0.75242042 0.00721683 1.0 Co Co51 1 0.25471604 0.75075139 0.49756061 1.0 Co Co52 1 0.76110471 0.25829885 0.01364547 1.0 Co Co53 1 0.75173093 0.24736209 0.49844300 1.0 Co Co54 1 0.75837551 0.75130323 0.00259181 1.0 Co Co55 1 0.75303610 0.74547715 0.49532846 1.0 Co Co56 1 0.10656132 0.08937216 0.24700225 1.0 Co Co57 1 0.10558809 0.59541677 0.24334740 1.0 Co Co58 1 0.60478496 0.08767247 0.24174998 1.0 Co Co59 1 0.60522226 0.09813354 0.74850075 1.0 Co Co60 1 0.60836851 0.59328725 0.24699327 1.0 Co Co61 1 0.35341019 0.40681934 0.24219911 1.0 Co Co62 1 0.85640204 0.40961469 0.24658877 1.0 Co Co63 1 0.85937220 0.89958000 0.24324527 1.0 O O64 1 0.11909253 0.11110169 0.48934876 1.0 O O65 1 0.12864000 0.11985815 0.99451016 1.0 O O66 1 0.11886524 0.62428430 0.48408798 1.0 O O67 1 0.13105663 0.63248156 0.99229738 1.0 O O68 1 0.61703086 0.11384756 0.49050070 1.0 O O69 1 0.62975494 0.13284690 0.99818665 1.0 O O70 1 0.61525859 0.61204991 0.48734144 1.0 O O71 1 0.63149457 0.62956019 0.99108653 1.0 O O72 1 0.13263436 0.38844073 0.01707048 1.0 O O73 1 0.13590932 0.36864378 0.50386425 1.0 O O74 1 0.13719747 0.88332231 0.01881625 1.0 O O75 1 0.14000727 0.87870785 0.50471776 1.0 O O76 1 0.64073467 0.38791505 0.01783882 1.0 O O77 1 0.63182489 0.37049785 0.50434564 1.0 O O78 1 0.63154532 0.88825905 0.01691917 1.0 O O79 1 0.63496827 0.86426756 0.50141720 1.0 O O80 1 0.36293460 0.12301604 0.48740000 1.0 O O81 1 0.37842896 0.11014412 0.99470092 1.0 O O82 1 0.37076233 0.62435169 0.48467352 1.0 O O83 1 0.38148603 0.62182074 0.99209301 1.0 O O84 1 0.86911435 0.12066500 0.49084956 1.0 O O85 1 0.87771574 0.11974666 0.99820049 1.0 O O86 1 0.86949651 0.62588695 0.48839711 1.0 O O87 1 0.88230184 0.61194035 0.99062915 1.0 O O88 1 0.38803398 0.38510252 0.01824401 1.0 O O89 1 0.38501331 0.38706911 0.50361806 1.0 O O90 1 0.38180417 0.87700376 0.01647367 1.0 O O91 1 0.38404144 0.88566032 0.50402225 1.0 O O92 1 0.88309361 0.38200566 0.01696635 1.0 O O93 1 0.88041023 0.37722942 0.50543016 1.0 O O94 1 0.88507127 0.87728583 0.01558544 1.0 O O95 1 0.89023501 0.88238638 0.50305319 1.0 O O96 1 0.09536895 0.10501524 0.14558223 1.0 O O97 1 0.09629845 0.09249006 0.64579760 1.0 O O98 1 0.08686310 0.60381853 0.13761873 1.0 O O99 1 0.08002490 0.59437549 0.64221807 1.0 O O100 1 0.58687557 0.10761922 0.14010773 1.0 O O101 1 0.57889196 0.08944161 0.63902563 1.0 O O102 1 0.58987193 0.60695062 0.14313572 1.0 O O103 1 0.58151698 0.59102734 0.64225086 1.0 O O104 1 0.43241493 0.40008647 0.34770790 1.0 O O105 1 0.44940107 0.40254928 0.86093704 1.0 O O106 1 0.44054528 0.89804846 0.35718648 1.0 O O107 1 0.44874988 0.90226691 0.86467354 1.0 O O108 1 0.93204514 0.40494496 0.35342621 1.0 O O109 1 0.94818515 0.40263262 0.86584318 1.0 O O110 1 0.94154202 0.89879213 0.35252736 1.0 O O111 1 0.95178067 0.89774883 0.86061534 1.0 O O112 1 0.33204511 0.29080170 0.13668289 1.0 O O113 1 0.33374446 0.29268218 0.64127508 1.0 O O114 1 0.33978665 0.78026490 0.14137153 1.0 O O115 1 0.33277711 0.79590311 0.64497519 1.0 O O116 1 0.84645396 0.29008297 0.14524544 1.0 O O117 1 0.83210454 0.30035148 0.64820663 1.0 O O118 1 0.84293707 0.78332409 0.13903712 1.0 O O119 1 0.83131225 0.79550080 0.63909110 1.0 O O120 1 0.18448489 0.20064879 0.35473890 1.0 O O121 1 0.19506858 0.20603314 0.86838373 1.0 O O122 1 0.19244644 0.70610296 0.34885988 1.0 O O123 1 0.20449738 0.71472807 0.86138950 1.0 O O124 1 0.68177561 0.19249022 0.35057249 1.0 O O125 1 0.68365450 0.21061627 0.85398453 1.0 O O126 1 0.69716179 0.69692489 0.35581303 1.0 O O127 1 0.70767527 0.71154353 0.86289234 1.0 O O128 1 0.42223362 0.05592179 0.23864818 1.0 O O129 1 0.42244738 0.06508701 0.74568673 1.0 O O130 1 0.42730647 0.56891608 0.24757857 1.0 O O131 1 0.43130764 0.57480411 0.75876986 1.0 O O132 1 0.92415323 0.05706305 0.23923378 1.0 O O133 1 0.93517963 0.06474131 0.75188193 1.0 O O134 1 0.92671105 0.57003656 0.24730901 1.0 O O135 1 0.93298568 0.57450118 0.76188315 1.0 O O136 1 0.17278001 0.43439111 0.23775959 1.0 O O137 1 0.18240834 0.43811276 0.75303339 1.0 O O138 1 0.17362477 0.92737605 0.24805108 1.0 O O139 1 0.18255648 0.93390694 0.76160738 1.0 O O140 1 0.67308749 0.43057427 0.23874265 1.0 O O141 1 0.67837080 0.43652061 0.76113621 1.0 O O142 1 0.67776440 0.92852589 0.23761918 1.0 O O143 1 0.68566312 0.94252077 0.75290595 1.0