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{
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"structure_string": "Bi8 O12\n1.0\n0.000000 5.934150 -0.032529\n8.139181 0.000000 0.000000\n0.000000 -2.839589 -6.901743\nBi O\n8 12\ndirect\n0.038145 0.543761 0.274786 Bi\n0.961855 0.043761 0.225214 Bi\n0.961854 0.456239 0.725214 Bi\n0.038145 0.956239 0.774786 Bi\n0.522169 0.689839 0.869144 Bi\n0.477830 0.189839 0.630855 Bi\n0.477830 0.310161 0.130855 Bi\n0.522170 0.810161 0.369145 Bi\n0.221715 0.207329 0.793227 O\n0.778285 0.707329 0.706773 O\n0.236634 0.946367 0.122266 O\n0.763366 0.446367 0.377734 O\n0.763366 0.053632 0.877734 O\n0.727820 0.034389 0.483981 O\n0.272179 0.965611 0.516018 O\n0.727820 0.465611 0.983981 O\n0.221715 0.292671 0.293227 O\n0.272179 0.534389 0.016019 O\n0.236634 0.553632 0.622266 O\n0.778285 0.792671 0.206773 O\n",
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"structure_string": "Li4 Fe4 F12\n1.0\n5.001558 -0.032942 0.082724\n-2.491362 4.510547 -0.018994\n-1.548922 -1.931891 9.892364\nLi Fe F\n4 4 12\ndirect\n0.252674 0.512053 0.947568 Li\n0.022075 0.289587 0.570094 Li\n-0.040016 0.717591 0.443378 Li\n0.768541 0.503420 0.056736 Li\n0.577855 0.965981 0.248341 Fe\n0.151943 0.250869 0.246370 Fe\n0.779312 0.751891 0.755033 Fe\n0.492347 0.034197 0.750597 Fe\n0.573114 0.655107 0.354739 F\n0.472572 0.218802 0.136669 F\n0.159558 0.553142 0.123821 F\n0.193307 0.790398 0.863221 F\n0.930852 0.337817 0.391673 F\n0.893050 0.141928 0.880535 F\n0.385941 0.653651 0.621556 F\n0.547595 0.444721 0.875315 F\n0.252622 0.991252 0.355619 F\n0.060056 0.969527 0.621363 F\n0.732347 0.347723 0.644216 F\n0.794272 0.870155 0.113150 F\n",
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{
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"updated_at": "2022-09-04T14:36:31.221182Z",
"structure_string": "Mg4 Sn2 Ir2 O12\n1.0\n0.000000 5.278839 0.002659\n5.381170 0.000000 0.000000\n0.000000 -5.261142 -7.687008\nMg Sn Ir O\n4 2 2 12\ndirect\n0.250141 0.045138 0.254484 Mg\n0.749859 0.545138 0.245516 Mg\n0.250142 0.454862 0.754484 Mg\n0.749859 0.954862 0.745516 Mg\n0.000000 0.500000 0.000000 Sn\n0.000000 0.000000 0.500000 Sn\n0.500000 0.500000 0.500000 Ir\n0.500000 0.000000 -0.000000 Ir\n0.748098 0.171493 0.924399 O\n0.596941 0.675504 0.933653 O\n0.251903 0.671493 0.575601 O\n0.878143 0.912302 0.245475 O\n0.121857 0.087698 0.754525 O\n0.251902 0.828507 0.075601 O\n0.403060 0.324496 0.066347 O\n0.596940 0.824496 0.433653 O\n0.403060 0.175504 0.566347 O\n0.878143 0.587698 0.745475 O\n0.748098 0.328507 0.424399 O\n0.121857 0.412302 0.254525 O\n",
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{
"id": "jvasp-95306",
"created_at": "2022-09-04T14:36:17.310342Z",
"updated_at": "2022-09-04T14:36:17.310367Z",
"structure_string": "Ba4 Sr2 U2 O12\n1.0\n6.289890 0.000000 -0.025304\n0.000000 6.334720 0.000000\n0.001489 0.000000 8.888867\nBa Sr U O\n4 2 2 12\ndirect\n0.491512 0.533882 0.249210 Ba\n0.008488 0.033882 0.250790 Ba\n0.991512 0.966118 0.749210 Ba\n0.508488 0.466118 0.750791 Ba\n0.500000 0.000000 0.000000 Sr\n0.000000 0.500000 0.500000 Sr\n0.500000 0.000000 0.500000 U\n0.000000 0.500000 0.000000 U\n0.689517 0.733965 0.551050 O\n0.810483 0.233965 0.948951 O\n0.912750 0.471134 0.227452 O\n0.265134 0.307706 0.042686 O\n0.234866 0.807706 0.457314 O\n0.734866 0.692294 0.957314 O\n0.765134 0.192294 0.542687 O\n0.412750 0.028866 0.727452 O\n0.087250 0.528866 0.772549 O\n0.587250 0.971134 0.272549 O\n0.189517 0.766035 0.051050 O\n0.310483 0.266035 0.448951 O\n",
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{
"id": "jvasp-96498",
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"updated_at": "2022-09-04T14:36:15.330661Z",
"structure_string": "Ca1 Mn7 O12\n1.0\n6.032577 0.013761 -2.141368\n-3.036361 5.212742 -2.141369\n0.007888 0.013761 6.401358\nCa Mn O\n1 7 12\ndirect\n0.000000 0.000000 0.000000 Ca\n0.500000 0.500000 0.500000 Mn\n0.000000 0.500000 0.500000 Mn\n0.500000 -0.000000 0.500000 Mn\n0.000000 -0.000000 0.500000 Mn\n0.500000 -0.000000 -0.000000 Mn\n-0.000000 0.500000 -0.000000 Mn\n0.500000 0.500000 -0.000000 Mn\n0.691606 0.869882 0.178245 O\n0.130118 0.821755 0.308394 O\n0.486743 0.178304 0.308426 O\n0.178245 0.691606 0.869882 O\n0.869883 0.178245 0.691606 O\n0.691574 0.513257 0.821696 O\n0.821696 0.691573 0.513257 O\n0.513257 0.821695 0.691574 O\n0.308426 0.486743 0.178304 O\n0.178304 0.308426 0.486743 O\n0.308394 0.130118 0.821755 O\n0.821755 0.308394 0.130118 O\n",
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"spacegroup": 204
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{
"id": "jvasp-87902",
"created_at": "2022-09-04T14:36:15.296854Z",
"updated_at": "2022-09-04T14:36:15.296874Z",
"structure_string": "Y4 Ni4 O12\n1.0\n5.192288 0.000000 -0.003673\n0.000000 5.567142 0.000000\n0.005077 0.000000 7.384056\nY Ni O\n4 4 12\ndirect\n0.979848 0.076045 0.250007 Y\n0.020153 0.923955 0.749994 Y\n0.479848 0.423955 0.750007 Y\n0.520153 0.576045 0.249994 Y\n0.500000 0.000000 0.000000 Ni\n0.000000 0.500000 0.500000 Ni\n0.500000 0.000000 0.500000 Ni\n0.000000 0.500000 0.000000 Ni\n0.600919 0.029370 0.750004 O\n0.899083 0.529370 0.749997 O\n0.693223 0.302624 0.450229 O\n0.693226 0.302638 0.049771 O\n0.806774 0.802638 0.450230 O\n0.306775 0.697361 0.950230 O\n0.193227 0.197361 0.549771 O\n0.193224 0.197375 0.950229 O\n0.306778 0.697375 0.549772 O\n0.806777 0.802624 0.049772 O\n0.100918 0.470630 0.250004 O\n0.399082 0.970630 0.249997 O\n",
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{
"id": "jvasp-88744",
"created_at": "2022-09-04T14:36:15.284652Z",
"updated_at": "2022-09-04T14:36:15.284673Z",
"structure_string": "Li4 Cu8 O8\n1.0\n2.881536 -0.000000 0.000000\n0.000000 5.709600 0.000000\n0.000000 0.000000 12.542180\nLi Cu O\n4 8 8\ndirect\n0.750001 0.868611 0.429301 Li\n0.250000 0.131389 0.570699 Li\n0.750001 0.368611 0.070699 Li\n0.250000 0.631389 0.929301 Li\n0.250000 0.122075 0.257747 Cu\n0.750001 0.377925 0.757747 Cu\n0.250000 0.622075 0.242253 Cu\n0.750001 0.877844 0.097613 Cu\n0.250000 0.122156 0.902387 Cu\n0.250000 0.622156 0.597613 Cu\n0.750001 0.377844 0.402387 Cu\n0.750001 0.877925 0.742253 Cu\n0.750001 0.866512 0.592290 O\n0.750001 0.366512 0.907709 O\n0.250000 0.633488 0.092291 O\n0.750001 0.882034 0.890767 O\n0.250000 0.117966 0.109233 O\n0.750001 0.382034 0.609233 O\n0.250000 0.617966 0.390767 O\n0.250000 0.133488 0.407709 O\n",
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{
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"created_at": "2022-09-04T14:36:15.180552Z",
"updated_at": "2022-09-04T14:36:15.180578Z",
"structure_string": "Ni8 Pd4 Se8\n1.0\n5.249131 0.000000 2.043494\n2.624566 7.516784 1.021747\n-0.102374 -0.000000 8.026449\nNi Pd Se\n8 4 8\ndirect\n0.096701 0.500000 0.806601 Ni\n0.403301 0.193399 0.500000 Ni\n0.596701 0.806600 0.500000 Ni\n0.903301 0.500000 0.193399 Ni\n0.903301 0.193399 0.500000 Ni\n0.096701 0.806600 0.500000 Ni\n0.403301 0.500000 0.193399 Ni\n0.596701 0.500000 0.806601 Ni\n0.000001 0.500000 0.500000 Pd\n0.500001 0.500000 0.500000 Pd\n0.000000 0.000000 0.000000 Pd\n0.500000 -0.000000 -0.000000 Pd\n0.500001 0.755693 0.244307 Se\n0.500001 0.244306 0.755693 Se\n0.831045 0.000000 0.337909 Se\n0.168955 0.000000 0.662090 Se\n0.255694 0.244306 0.244307 Se\n0.168955 0.662090 0.000000 Se\n0.831045 0.337909 -0.000000 Se\n0.744308 0.755693 0.755693 Se\n",
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{
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"created_at": "2022-09-04T14:36:15.075311Z",
"updated_at": "2022-09-04T14:36:15.075341Z",
"structure_string": "Er4 Mn4 O12\n1.0\n5.229926 0.000000 0.000000\n-0.000000 5.644356 0.000000\n0.000000 0.000000 7.520106\nEr Mn O\n4 4 12\ndirect\n0.979401 0.077183 0.250000 Er\n0.520600 0.577183 0.250000 Er\n0.020599 0.922818 0.750000 Er\n0.479401 0.422818 0.750000 Er\n0.500000 0.000000 0.000000 Mn\n0.000000 0.500000 0.000000 Mn\n0.000000 0.500000 0.500000 Mn\n0.500000 0.000000 0.500000 Mn\n0.884646 0.539036 0.750000 O\n0.384645 0.960965 0.250000 O\n0.693945 0.311329 0.442452 O\n0.693945 0.311329 0.057549 O\n0.193945 0.188672 0.942452 O\n0.806056 0.811329 0.442452 O\n0.306055 0.688672 0.557549 O\n0.306055 0.688672 0.942452 O\n0.806056 0.811329 0.057549 O\n0.193945 0.188672 0.557549 O\n0.115355 0.460965 0.250000 O\n0.615355 0.039036 0.750000 O\n",
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{
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"created_at": "2022-09-04T14:36:14.965871Z",
"updated_at": "2022-09-04T14:36:14.965898Z",
"structure_string": "Zn10 S10\n1.0\n3.840890 0.000000 -0.000000\n-1.920445 3.326308 0.000000\n-0.000000 -0.000000 31.401286\nZn S\n10 10\ndirect\n0.666667 0.333333 0.199985 Zn\n0.000000 0.000000 0.299910 Zn\n0.333332 0.666667 0.400003 Zn\n0.000000 0.000000 0.000161 Zn\n0.666667 0.333333 0.600062 Zn\n0.000000 0.000000 0.500161 Zn\n0.333332 0.666667 0.699985 Zn\n0.666667 0.333333 0.900003 Zn\n0.000000 0.000000 0.799910 Zn\n0.333332 0.666667 0.100061 Zn\n0.666667 0.333333 0.975085 S\n0.666667 0.333333 0.274915 S\n0.000000 0.000000 0.075061 S\n0.666667 0.333333 0.674989 S\n0.000000 0.000000 0.874829 S\n0.333332 0.666667 0.774915 S\n0.000000 0.000000 0.575061 S\n0.333332 0.666667 0.174989 S\n0.333332 0.666667 0.475085 S\n0.000000 0.000000 0.374828 S\n",
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{
"id": "jvasp-91391",
"created_at": "2022-09-04T14:36:13.136218Z",
"updated_at": "2022-09-04T14:36:13.136235Z",
"structure_string": "Li2 Fe2 Si4 O12\n1.0\n5.106368 0.002878 1.361254\n1.534667 6.146494 0.727836\n0.032237 0.024351 6.376732\nLi Fe Si O\n2 2 4 12\ndirect\n0.750001 0.261343 0.738656 Li\n0.250001 0.738656 0.261344 Li\n0.750001 0.915339 0.084660 Fe\n0.250001 0.084660 0.915339 Fe\n0.758035 0.795881 0.607577 Si\n0.241967 0.204119 0.392422 Si\n0.258035 0.607577 0.795881 Si\n0.741967 0.392422 0.204119 Si\n0.051992 0.645435 0.636223 O\n0.551993 0.636223 0.645435 O\n0.143411 0.801140 0.975129 O\n0.177547 0.099264 0.637704 O\n0.856591 0.198859 0.024870 O\n0.948009 0.354564 0.363776 O\n0.356591 0.024871 0.198859 O\n0.822455 0.900735 0.362295 O\n0.677547 0.637704 0.099264 O\n0.322455 0.362295 0.900735 O\n0.448009 0.363776 0.354564 O\n0.643411 0.975129 0.801141 O\n",
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{
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"created_at": "2022-09-04T14:36:12.885077Z",
"updated_at": "2022-09-04T14:36:12.885104Z",
"structure_string": "Sr4 Mn2 W2 O12\n1.0\n5.669842 0.000000 0.000000\n0.000000 5.681923 -0.007340\n0.000000 -0.000362 7.976228\nSr Mn W O\n4 2 2 12\ndirect\n0.978655 0.996621 0.749525 Sr\n0.478655 0.503378 0.750475 Sr\n0.521344 0.496621 0.249525 Sr\n0.021345 0.003379 0.250475 Sr\n0.000000 0.500000 0.000000 Mn\n0.500000 0.000000 0.500000 Mn\n0.500000 0.000000 0.000000 W\n0.000000 0.500000 0.500000 W\n0.491126 0.941814 0.241462 O\n0.991126 0.558185 0.258538 O\n0.268214 0.287962 0.469284 O\n0.285945 0.266368 0.030010 O\n0.785945 0.233632 0.469990 O\n0.714055 0.733632 0.969990 O\n0.214055 0.766368 0.530010 O\n0.231786 0.787962 0.969284 O\n0.731786 0.712038 0.530716 O\n0.768214 0.212038 0.030716 O\n0.008873 0.441815 0.741463 O\n0.508873 0.058185 0.758538 O\n",
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]
}