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{
"id": "jvasp-112584",
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"structure_string": "K2 Tm2 Mo4 O16\n1.0\n6.455589 -0.012250 3.492655\n-1.558011 6.264773 3.492655\n-0.022736 -0.029026 7.663853\nK Tm Mo O\n2 2 4 16\ndirect\n0.196194 0.803805 0.750000 K\n0.803806 0.196194 0.250000 K\n0.770053 0.229946 0.750000 Tm\n0.229947 0.770053 0.250000 Tm\n0.694651 0.700515 0.758042 Mo\n0.305348 0.299483 0.241958 Mo\n0.299483 0.305348 0.741958 Mo\n0.700516 0.694651 0.258042 Mo\n0.200565 0.044828 0.309146 O\n0.799434 0.955171 0.690854 O\n0.365179 0.583991 0.469872 O\n0.634820 0.416008 0.530127 O\n0.416008 0.634820 0.030127 O\n0.583991 0.365179 0.969872 O\n0.069474 0.387101 0.378534 O\n0.776098 0.608418 0.059813 O\n0.612899 0.930525 0.121465 O\n0.387100 0.069474 0.878534 O\n0.044828 0.200565 0.809146 O\n0.223902 0.391580 0.940186 O\n0.391581 0.223902 0.440186 O\n0.608418 0.776097 0.559814 O\n0.930525 0.612898 0.621465 O\n0.955171 0.799434 0.190853 O\n",
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{
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"created_at": "2022-09-04T14:35:41.817668Z",
"updated_at": "2022-09-04T14:35:41.817694Z",
"structure_string": "Na4 Cr4 O14\n1.0\n6.909867 0.128626 -2.570461\n-1.940409 4.803607 4.676295\n2.002915 -4.798810 4.609378\nNa Cr O\n4 4 14\ndirect\n0.676975 0.940049 0.622931 Na\n0.323025 0.059951 0.377068 Na\n0.250618 0.365075 0.841270 Na\n0.749382 0.634925 0.158729 Na\n0.199966 0.825188 0.869609 Cr\n0.800035 0.174813 0.130390 Cr\n0.760855 0.507748 0.656134 Cr\n0.239145 0.492253 0.343865 Cr\n0.208898 0.323806 0.503013 O\n0.791102 0.676195 0.496986 O\n0.374909 0.456240 0.169057 O\n0.625092 0.543760 0.830942 O\n0.353422 0.746678 0.441905 O\n0.646578 0.253323 0.558094 O\n0.236798 0.021472 0.741211 O\n0.122826 0.865572 0.086339 O\n0.763203 0.978528 0.258788 O\n0.003591 0.568699 0.753843 O\n0.596887 0.208229 0.122750 O\n0.403113 0.791771 0.877249 O\n0.877174 0.134429 0.913660 O\n-0.003592 0.431301 0.246156 O\n",
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{
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"structure_string": "Li1 Mo6 Se8\n1.0\n6.776998 -0.009519 -0.169815\n-0.173885 6.774774 -0.169815\n-0.009291 -0.009519 6.779119\nLi Mo Se\n1 6 8\ndirect\n0.000000 0.000000 0.000000 Li\n0.767279 0.581391 0.449787 Mo\n0.449789 0.767278 0.581391 Mo\n0.581392 0.449788 0.767278 Mo\n0.232722 0.418608 0.550211 Mo\n0.550212 0.232721 0.418608 Mo\n0.418609 0.550211 0.232721 Mo\n0.777521 0.777520 0.777520 Se\n0.222480 0.222479 0.222479 Se\n0.255540 0.623796 0.874861 Se\n0.874861 0.255539 0.623796 Se\n0.623797 0.874860 0.255538 Se\n0.744461 0.376203 0.125138 Se\n0.125140 0.744460 0.376203 Se\n0.376204 0.125139 0.744460 Se\n",
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"structure_string": "Sr6\n1.0\n6.951379 -0.000000 -0.000000\n-3.475689 6.020071 0.000000\n-0.000000 -0.000000 7.437139\nSr\n6\ndirect\n0.333324 0.000000 0.000000 Sr\n-0.000000 0.333324 0.000000 Sr\n0.666676 0.666676 0.000000 Sr\n-0.000000 0.333324 0.500000 Sr\n0.333324 0.000000 0.500000 Sr\n0.666676 0.666676 0.500000 Sr\n",
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{
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"structure_string": "Sr6\n1.0\n6.951379 -0.000000 -0.000000\n-3.475689 6.020071 0.000000\n-0.000000 -0.000000 7.437139\nSr\n6\ndirect\n0.333324 0.000000 0.000000 Sr\n-0.000000 0.333324 0.000000 Sr\n0.666676 0.666676 0.000000 Sr\n-0.000000 0.333324 0.500000 Sr\n0.333324 0.000000 0.500000 Sr\n0.666676 0.666676 0.500000 Sr\n",
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{
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"created_at": "2022-09-04T14:38:30.538405Z",
"updated_at": "2022-09-04T14:38:30.538434Z",
"structure_string": "Mn6 F18\n1.0\n5.172652 0.000000 0.000000\n-2.586326 4.479155 0.001138\n0.000000 -0.001441 13.433134\nMn F\n6 18\ndirect\n0.000000 0.000000 0.000000 Mn\n0.000000 0.000000 0.500000 Mn\n0.666652 0.333330 0.333329 Mn\n0.333322 0.666671 0.166671 Mn\n0.333348 0.666671 0.666671 Mn\n0.666677 0.333330 0.833329 Mn\n0.333376 0.263072 0.416681 F\n0.070304 0.736929 0.083319 F\n0.666624 0.736929 0.583319 F\n0.929696 0.263072 0.916680 F\n0.666732 0.929778 0.083357 F\n0.736956 0.070224 0.416643 F\n0.333268 0.070224 0.916643 F\n0.263044 0.929778 0.583357 F\n-0.000101 0.403535 0.249976 F\n0.403635 0.403535 0.749976 F\n0.403465 0.000000 0.250000 F\n0.596364 0.596466 0.250024 F\n0.263161 0.333377 0.083330 F\n0.929785 0.666624 0.416670 F\n0.736838 0.666624 0.916670 F\n0.070215 0.333377 0.583329 F\n0.000100 0.596466 0.750024 F\n0.596535 0.000000 0.750000 F\n",
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"created_at": "2022-09-04T14:37:07.610127Z",
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"structure_string": "Sm4 Cu4 S8\n1.0\n0.000000 6.440344 0.007069\n7.131200 0.000000 0.000000\n0.000000 -0.891927 -6.778079\nSm Cu S\n4 4 8\ndirect\n0.808178 0.951038 0.199117 Sm\n0.191821 0.451038 0.300883 Sm\n0.191821 0.048962 0.800883 Sm\n0.808178 0.548962 0.699117 Sm\n0.422864 0.661757 0.949755 Cu\n0.577135 0.338243 0.050245 Cu\n0.577134 0.161757 0.550245 Cu\n0.422865 0.838243 0.449755 Cu\n0.079521 0.726042 0.999393 S\n0.920478 0.226042 0.500607 S\n0.920478 0.273958 0.000607 S\n0.079521 0.773958 0.499393 S\n0.406800 0.113151 0.218815 S\n0.406799 0.386849 0.718815 S\n0.593199 0.886849 0.781185 S\n0.593200 0.613151 0.281185 S\n",
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{
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"structure_string": "Li4 Ti3 V3 Te2 O16\n1.0\n5.898339 -0.001237 0.002342\n-2.948152 5.164796 0.016094\n-0.004259 0.020967 10.218654\nLi Ti V Te O\n4 3 3 2 16\ndirect\n0.334506 0.669027 0.098114 Li\n0.999443 0.998885 0.011720 Li\n-0.000401 -0.000767 0.507093 Li\n0.663396 0.326827 0.602181 Li\n0.162821 0.816685 0.779360 Ti\n0.653851 0.816691 0.779361 Ti\n0.824896 0.649817 0.273698 Ti\n0.352902 0.173150 0.283272 V\n0.820218 0.173150 0.283275 V\n0.174564 0.349141 0.787949 V\n0.330104 0.660239 0.492207 Te\n0.660263 0.320529 -0.000629 Te\n0.846971 0.693959 0.896959 O\n0.316970 0.154830 0.901457 O\n0.672078 0.344184 0.396058 O\n0.981852 0.497806 0.170346 O\n0.515931 0.497794 0.170335 O\n0.158476 0.316980 0.396387 O\n0.498142 0.512550 0.675251 O\n0.486210 0.972435 0.675136 O\n0.675663 0.839006 0.397770 O\n0.000452 0.000941 0.193813 O\n0.000706 0.001423 0.689833 O\n0.339304 0.678625 0.895261 O\n0.514846 0.029724 0.161453 O\n0.163308 0.839013 0.397774 O\n0.014381 0.512544 0.675254 O\n0.837854 0.154826 0.901458 O\n",
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"structure_string": "Na4 V2 B2 P2 O14\n1.0\n0.000000 5.388947 -0.025106\n6.372298 0.000000 0.000000\n0.000000 -0.400814 -9.062595\nNa V B P O\n4 2 2 2 14\ndirect\n0.766774 -0.001218 0.221207 Na\n0.766774 0.501218 0.221207 Na\n0.233227 0.498783 0.778793 Na\n0.233227 0.001218 0.778793 Na\n0.219954 0.250000 0.335332 V\n0.780047 0.750000 0.664667 V\n0.284735 0.250000 0.076459 B\n0.715266 0.750000 0.923541 B\n0.277226 0.750000 0.438733 P\n0.722775 0.250000 0.561267 P\n0.532872 0.750000 0.802094 O\n0.797514 0.054362 0.655112 O\n0.797514 0.445638 0.655112 O\n0.130448 0.750000 0.580686 O\n0.438602 0.250000 0.526820 O\n0.561399 0.750000 0.473180 O\n0.053597 0.250000 0.148386 O\n0.202488 0.554363 0.344888 O\n0.202488 0.945638 0.344888 O\n0.467129 0.250000 0.197906 O\n0.946404 0.750000 0.851614 O\n0.674346 0.750000 0.063840 O\n0.869553 0.250000 0.419314 O\n0.325655 0.250000 0.936160 O\n",
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"updated_at": "2022-09-04T14:36:30.761164Z",
"structure_string": "Na5 Mn7 O16\n1.0\n0.000000 6.097369 0.110245\n5.915929 0.000000 0.000000\n0.000000 -0.453490 -8.637609\nNa Mn O\n5 7 16\ndirect\n0.244106 0.000000 0.872439 Na\n0.222222 0.500000 0.620873 Na\n0.000000 0.000000 0.500000 Na\n0.777778 0.500000 0.379126 Na\n0.755894 0.000000 0.127561 Na\n0.000000 0.500000 0.000000 Mn\n0.500000 0.500000 -0.000000 Mn\n0.270981 0.752583 0.244605 Mn\n0.270981 0.247417 0.244605 Mn\n0.729020 0.752583 0.755394 Mn\n0.729020 0.247417 0.755394 Mn\n0.500000 0.000000 0.500000 Mn\n0.081440 0.000000 0.227778 O\n0.254188 0.293523 0.014231 O\n0.254188 0.706477 0.014231 O\n0.481862 0.500000 0.222719 O\n0.059525 0.500000 0.224425 O\n0.485888 0.000000 0.273511 O\n0.285720 0.768558 0.456529 O\n0.940475 0.500000 0.775575 O\n0.714280 0.231442 0.543471 O\n0.714280 0.768558 0.543471 O\n0.918560 0.000000 0.772221 O\n0.514112 0.000000 0.726488 O\n0.745812 0.293523 0.985768 O\n0.518138 0.500000 0.777281 O\n0.285720 0.231442 0.456529 O\n0.745812 0.706477 0.985768 O\n",
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"structure_string": "Rb2 Mo6 S6\n1.0\n8.990814 -0.000001 0.000000\n-4.495407 7.786274 -0.000000\n0.000000 0.000000 4.446608\nRb Mo S\n2 6 6\ndirect\n0.333332 0.666667 0.750000 Rb\n0.666667 0.333333 0.250000 Rb\n0.970732 0.816492 0.250000 Mo\n0.845760 0.029268 0.250000 Mo\n0.154239 0.970732 0.750000 Mo\n0.029267 0.183507 0.750000 Mo\n0.183507 0.154240 0.250000 Mo\n0.816492 0.845760 0.750000 Mo\n0.942376 0.652963 0.750000 S\n0.057623 0.347036 0.250000 S\n0.289413 0.942377 0.250000 S\n0.652963 0.710586 0.250000 S\n0.347036 0.289413 0.750000 S\n0.710586 0.057623 0.750000 S\n",
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]
}