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{
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{
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"structure_string": "Zn4 P16\n1.0\n5.061528 -0.000000 -0.000000\n0.000000 5.061528 0.000000\n0.000000 -0.000000 14.661577\nZn P\n4 16\ndirect\n0.804829 0.804829 0.500000 Zn\n0.695172 0.304829 0.750000 Zn\n0.304829 0.695172 0.250000 Zn\n0.195171 0.195171 0.000000 Zn\n0.427622 0.180645 0.451522 P\n0.680645 0.072378 0.201522 P\n0.013299 0.897558 0.125203 P\n0.986701 0.102443 0.625203 P\n0.897558 0.013299 0.874798 P\n0.397557 0.486701 0.875203 P\n0.602443 0.513299 0.375203 P\n0.513299 0.602443 0.624798 P\n0.572378 0.819355 0.951522 P\n0.102443 0.986701 0.374798 P\n0.819355 0.572378 0.048478 P\n0.319355 0.927622 0.701522 P\n0.072378 0.680645 0.798479 P\n0.927622 0.319355 0.298478 P\n0.486701 0.397557 0.124798 P\n0.180645 0.427622 0.548478 P\n",
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{
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"updated_at": "2022-09-04T14:37:32.830717Z",
"structure_string": "Th8 S12\n1.0\n3.937936 -0.000000 0.000000\n-0.000000 10.944467 0.000000\n0.000000 0.000000 10.902713\nTh S\n8 12\ndirect\n0.250000 0.315307 0.981979 Th\n0.250000 0.985685 0.803721 Th\n0.750001 0.485685 0.696279 Th\n0.250000 0.514315 0.303721 Th\n0.750001 0.815307 0.518020 Th\n0.250000 0.184693 0.481979 Th\n0.750001 0.014315 0.196279 Th\n0.750001 0.684693 0.018021 Th\n0.250000 0.555553 0.875844 S\n0.250000 0.295846 0.720039 S\n0.750001 0.377156 0.447286 S\n0.250000 0.204154 0.220039 S\n0.250000 0.622844 0.552713 S\n0.250000 0.877156 0.052714 S\n0.750001 0.795846 0.779961 S\n0.750001 0.122844 0.947286 S\n0.250000 0.944448 0.375844 S\n0.750001 0.055553 0.624155 S\n0.750001 0.704154 0.279961 S\n0.750001 0.444448 0.124155 S\n",
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{
"id": "jvasp-21833",
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"updated_at": "2022-09-04T14:37:31.323071Z",
"structure_string": "Tb4 Si10 Rh6\n1.0\n5.431061 -0.011456 -1.874746\n-2.985061 7.560763 -0.467403\n-0.029068 0.024588 8.142036\nTb Si Rh\n4 10 6\ndirect\n0.736824 0.598922 0.866306 Tb\n0.263175 0.401078 0.133694 Tb\n0.236825 0.866306 0.598923 Tb\n0.763175 0.133694 0.401078 Tb\n0.250000 0.212427 0.787573 Si\n0.750000 0.787572 0.212427 Si\n0.162013 0.057363 0.264892 Si\n0.750000 0.489703 0.510296 Si\n0.250000 0.510296 0.489704 Si\n0.662012 0.264891 0.057363 Si\n0.837987 0.942636 0.735109 Si\n0.337987 0.735108 0.942637 Si\n0.250000 0.775228 0.224771 Si\n0.750000 0.224771 0.775229 Si\n0.750000 0.997874 0.002125 Rh\n0.123929 0.462693 0.742180 Rh\n0.623929 0.742179 0.462693 Rh\n0.876070 0.537306 0.257820 Rh\n0.250000 0.002125 0.997875 Rh\n0.376070 0.257820 0.537307 Rh\n",
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{
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"created_at": "2022-09-04T14:37:05.761901Z",
"updated_at": "2022-09-04T14:37:05.761918Z",
"structure_string": "Er8 Te12\n1.0\n7.326579 0.002714 -1.362649\n-2.772575 6.781710 -1.362649\n-0.002172 -0.003237 13.600515\nEr Te\n8 12\ndirect\n0.792200 0.042199 0.084401 Er\n0.207801 0.957799 0.915599 Er\n0.042201 0.792200 0.584401 Er\n0.125228 0.375227 0.750457 Er\n0.624773 0.874771 0.749544 Er\n0.874773 0.624772 0.249544 Er\n0.375228 0.125227 0.250456 Er\n0.957800 0.207799 0.415599 Er\n0.871536 0.621535 0.750000 Te\n0.378464 0.128464 0.750000 Te\n0.540626 0.292575 0.083378 Te\n0.957248 0.209196 0.916623 Te\n0.292575 0.540625 0.583378 Te\n0.790803 0.042751 0.583378 Te\n0.459375 0.707424 0.916623 Te\n0.042753 0.790802 0.083378 Te\n0.707425 0.459374 0.416622 Te\n0.209198 0.957247 0.416622 Te\n0.621536 0.871535 0.250000 Te\n0.128465 0.378464 0.250000 Te\n",
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{
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"created_at": "2022-09-04T14:37:10.799724Z",
"updated_at": "2022-09-04T14:37:10.799750Z",
"structure_string": "Ag4 Cl4 O12\n1.0\n0.000000 6.908685 -0.106996\n5.277555 0.000000 0.000000\n0.000000 -3.182579 -7.903582\nAg Cl O\n4 4 12\ndirect\n0.303947 0.246662 0.828136 Ag\n0.696054 0.746662 0.671864 Ag\n0.303947 0.253337 0.328137 Ag\n0.696054 0.753337 0.171864 Ag\n0.826924 0.237710 0.963085 Cl\n0.173076 0.737709 0.536915 Cl\n0.826924 0.262290 0.463086 Cl\n0.173077 0.762290 0.036915 Cl\n0.359675 0.928193 0.128919 O\n0.640326 0.428193 0.371081 O\n0.744893 0.993971 0.455202 O\n0.098436 0.654549 0.355572 O\n0.901564 0.345450 0.644428 O\n0.744893 0.506027 0.955202 O\n0.359675 0.571806 0.628919 O\n0.640325 0.071807 0.871081 O\n0.255107 0.493972 0.044798 O\n0.098436 0.845450 0.855572 O\n0.255107 0.006028 0.544798 O\n0.901565 0.154549 0.144428 O\n",
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{
"id": "jvasp-21351",
"created_at": "2022-09-04T14:37:09.946127Z",
"updated_at": "2022-09-04T14:37:09.946149Z",
"structure_string": "Mn2 Zn2 Si4 O12\n1.0\n5.239972 0.149838 1.241348\n1.512562 6.649679 0.467137\n0.200862 -0.191731 6.829875\nMn Zn Si O\n2 2 4 12\ndirect\n0.250000 0.106587 0.893408 Mn\n0.749999 0.893410 0.106586 Mn\n0.749995 0.235550 0.764449 Zn\n0.249996 0.764449 0.235551 Zn\n0.223683 0.221428 0.387519 Si\n0.276317 0.612481 0.778575 Si\n0.723683 0.387519 0.221428 Si\n0.776318 0.778575 0.612481 Si\n0.657360 0.959895 0.787653 O\n0.842639 0.212350 0.040102 O\n0.618750 0.617215 0.146303 O\n0.881242 0.853706 0.382788 O\n0.381242 0.382787 0.853704 O\n0.033403 0.617588 0.670567 O\n0.966602 0.382418 0.329428 O\n0.533404 0.670567 0.617589 O\n0.342638 0.040102 0.212350 O\n0.466603 0.329428 0.382417 O\n0.118751 0.146302 0.617214 O\n0.157361 0.787654 0.959894 O\n",
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{
"id": "jvasp-21735",
"created_at": "2022-09-04T14:37:31.392093Z",
"updated_at": "2022-09-04T14:37:31.392120Z",
"structure_string": "Li2 Pr4 Ir2 O12\n1.0\n0.000000 5.475844 0.001827\n5.790105 0.000000 0.000000\n0.000000 -5.406891 -7.801317\nLi Pr Ir O\n2 4 2 12\ndirect\n0.000000 0.000000 0.000000 Li\n0.000000 0.500000 0.500000 Li\n0.767020 0.067101 0.251343 Pr\n0.232980 0.567101 0.248657 Pr\n0.767020 0.432898 0.751343 Pr\n0.232980 0.932898 0.748657 Pr\n0.499999 0.500000 -0.000000 Ir\n0.500000 0.000000 0.500000 Ir\n0.841469 0.193111 0.545177 O\n0.158531 0.693110 0.954823 O\n0.158531 0.806889 0.454823 O\n0.841468 0.306889 0.045177 O\n0.340906 0.522347 0.752712 O\n0.734716 0.788238 0.047550 O\n0.265283 0.211762 0.952450 O\n0.734716 0.711761 0.547550 O\n0.659094 0.477652 0.247288 O\n0.265283 0.288238 0.452450 O\n0.659094 0.022347 0.747288 O\n0.340905 0.977652 0.252712 O\n",
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{
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"created_at": "2022-09-04T14:37:31.915667Z",
"updated_at": "2022-09-04T14:37:31.915676Z",
"structure_string": "Hf4 I16\n1.0\n7.943328 -0.001393 -2.627623\n-0.875246 7.894961 -2.627623\n-0.011670 -0.013033 12.929741\nHf I\n4 16\ndirect\n0.217614 0.938334 0.624785 Hf\n0.938334 0.217615 0.124785 Hf\n0.782386 0.061666 0.375215 Hf\n0.061666 0.782386 0.875215 Hf\n0.420396 0.687210 0.615427 I\n0.820559 0.052694 0.879651 I\n0.687210 0.420396 0.115427 I\n0.312790 0.579604 0.884574 I\n0.435048 0.186098 0.635204 I\n0.813902 0.564953 0.864796 I\n0.052693 0.820559 0.379651 I\n0.291887 0.056826 0.870279 I\n0.947307 0.179442 0.620350 I\n0.564952 0.813902 0.364796 I\n0.186098 0.435048 0.135204 I\n0.056825 0.291887 0.370279 I\n0.708113 0.943175 0.129721 I\n0.179441 0.947307 0.120349 I\n0.579604 0.312790 0.384574 I\n0.943175 0.708114 0.629721 I\n",
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{
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"created_at": "2022-09-04T14:37:18.725239Z",
"updated_at": "2022-09-04T14:37:18.725259Z",
"structure_string": "Y4 Co4 O12\n1.0\n0.000000 5.501756 -0.000539\n5.140430 0.000000 0.000000\n0.000000 -0.000697 -7.380588\nY Co O\n4 4 12\ndirect\n0.075106 0.021122 0.750001 Y\n0.424894 0.521122 0.249999 Y\n0.575106 0.478878 0.750001 Y\n0.924895 0.978878 0.250000 Y\n0.500000 0.000000 0.500000 Co\n-0.000000 0.500000 0.500000 Co\n0.000000 0.500000 0.000000 Co\n0.500000 0.000000 0.000000 Co\n0.971152 0.601677 0.750003 O\n0.528848 0.101677 0.249997 O\n0.697976 0.690313 0.050336 O\n0.802024 0.190313 0.949665 O\n0.197978 0.809690 0.449664 O\n0.802022 0.190310 0.550337 O\n0.302024 0.309687 0.949664 O\n0.197976 0.809687 0.050336 O\n0.028848 0.398323 0.249997 O\n0.697978 0.690310 0.449664 O\n0.302022 0.309690 0.550337 O\n0.471152 0.898323 0.750003 O\n",
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"formula_full": "Y4 Co4 O12",
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{
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"created_at": "2022-09-04T14:37:32.164441Z",
"updated_at": "2022-09-04T14:37:32.164473Z",
"structure_string": "Zr2 Tl2 Cd2 F14\n1.0\n6.561040 0.028554 -0.000000\n-2.966624 5.852111 -0.000000\n0.000000 -0.000000 8.578411\nZr Tl Cd F\n2 2 2 14\ndirect\n0.192455 0.807545 0.250000 Zr\n0.807545 0.192454 0.750000 Zr\n0.500000 0.500000 0.000000 Tl\n0.500000 0.500000 0.500000 Tl\n0.807647 0.192352 0.250000 Cd\n0.192353 0.807647 0.750000 Cd\n0.172241 0.474241 0.250000 F\n0.202807 0.797193 0.486461 F\n0.525759 0.827759 0.250000 F\n0.564193 0.845014 0.750000 F\n0.474241 0.172240 0.750000 F\n0.827759 0.525758 0.750000 F\n0.154986 0.435807 0.750000 F\n0.797193 0.202807 0.513539 F\n0.009223 0.990778 0.250000 F\n0.435807 0.154986 0.250000 F\n0.845014 0.564192 0.250000 F\n0.797193 0.202807 0.986461 F\n0.202807 0.797193 0.013539 F\n0.990777 0.009222 0.750000 F\n",
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{
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"created_at": "2022-09-04T14:37:30.684504Z",
"updated_at": "2022-09-04T14:37:30.684521Z",
"structure_string": "Li2 Sm4 Ir2 O12\n1.0\n0.000000 5.360174 -0.001275\n5.809115 0.000000 0.000000\n0.000000 -5.263893 -7.647929\nLi Sm Ir O\n2 4 2 12\ndirect\n0.000000 0.000000 0.000000 Li\n0.000000 0.500000 0.500000 Li\n0.772216 0.078454 0.251608 Sm\n0.227784 0.578454 0.248392 Sm\n0.772216 0.421547 0.751608 Sm\n0.227785 0.921547 0.748392 Sm\n0.500000 0.500000 0.000000 Ir\n0.500000 0.000000 0.500000 Ir\n0.856790 0.186499 0.550813 O\n0.143210 0.686500 0.949188 O\n0.143210 0.813502 0.449188 O\n0.856790 0.313501 0.050813 O\n0.355568 0.531555 0.751244 O\n0.730861 0.793213 0.054330 O\n0.269139 0.206788 0.945671 O\n0.730862 0.706788 0.554330 O\n0.644433 0.468446 0.248756 O\n0.269139 0.293213 0.445671 O\n0.644433 0.031555 0.748757 O\n0.355568 0.968446 0.251244 O\n",
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]
}