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{
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{
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"structure_string": "Nb34 O68\n1.0\n11.303511 0.240323 -0.263659\n0.246509 11.238393 0.204749\n-0.259544 0.208329 11.589383\nNb O\n34 68\ndirect\n0.497841 0.700070 0.357365 Nb\n0.863598 0.080506 0.600472 Nb\n0.997121 0.659084 0.167593 Nb\n0.277534 0.727381 0.044059 Nb\n0.554176 0.651076 0.087023 Nb\n0.419155 0.166439 0.252915 Nb\n0.793366 0.606943 0.849678 Nb\n0.237292 0.417528 0.118816 Nb\n0.185929 0.969850 0.051146 Nb\n0.987209 0.193767 0.393131 Nb\n0.160597 0.130874 0.795004 Nb\n0.431221 0.883014 0.173337 Nb\n0.372264 0.463618 0.425387 Nb\n0.545817 0.398002 0.248914 Nb\n0.424623 0.034340 0.881474 Nb\n0.704236 0.326207 0.543756 Nb\n0.695212 0.858986 0.011440 Nb\n0.331690 0.924918 0.366770 Nb\n0.667921 0.148805 0.163408 Nb\n0.406630 0.243341 0.722261 Nb\n0.936423 0.299267 0.791063 Nb\n0.179922 0.678637 0.450871 Nb\n0.201315 0.844256 0.741492 Nb\n0.911819 0.984833 0.203646 Nb\n0.155574 0.425662 0.596037 Nb\n0.420100 0.787737 0.654846 Nb\n0.700786 0.370447 0.995400 Nb\n0.935317 0.876906 0.820872 Nb\n0.898149 0.380440 0.159170 Nb\n0.760346 0.754892 0.558568 Nb\n0.532604 0.053619 0.579156 Nb\n0.579605 0.488831 0.675927 Nb\n0.336071 0.548317 0.835660 Nb\n0.963590 0.503412 0.450588 Nb\n0.225115 0.269959 0.722740 O\n0.382742 0.140626 0.587689 O\n0.924293 0.610483 0.942435 O\n0.076949 0.590144 0.557514 O\n0.449897 0.053079 0.402833 O\n0.033532 0.810265 0.704898 O\n0.482576 0.544756 0.531745 O\n0.435907 0.207349 0.890449 O\n0.053617 0.618223 0.327021 O\n0.841477 0.211444 0.460169 O\n0.012699 0.405608 0.700206 O\n0.851468 0.393606 0.902022 O\n0.157567 0.622923 0.105424 O\n0.057707 0.232115 0.898106 O\n0.580433 0.585635 0.249907 O\n0.812267 0.923472 0.553015 O\n0.643525 0.752688 0.433013 O\n0.069759 0.407588 0.138064 O\n0.678209 0.205509 0.995998 O\n0.839114 0.002126 0.761251 O\n0.184775 0.845881 0.400259 O\n0.301793 0.263114 0.147944 O\n0.247242 0.835332 0.171795 O\n0.924420 0.814316 0.202901 O\n0.255571 0.089478 0.940487 O\n0.187646 0.007679 0.683617 O\n0.456755 0.650869 0.751193 O\n0.070909 0.325990 0.460991 O\n0.419374 0.634872 0.980924 O\n0.603276 0.815080 0.152586 O\n0.942508 0.224962 0.227189 O\n0.871998 0.672732 0.482514 O\n0.872092 0.555924 0.181010 O\n0.248647 0.744546 0.605619 O\n0.771916 0.075354 0.279849 O\n0.631379 0.376915 0.400992 O\n0.530489 0.098633 0.744909 O\n0.296870 0.034121 0.209758 O\n0.518705 0.055171 0.156045 O\n0.019560 0.031608 0.317460 O\n0.836371 0.437616 0.520750 O\n0.566704 0.890717 0.624409 O\n0.236631 0.716476 0.869658 O\n0.687399 0.676565 0.969793 O\n0.688367 0.622300 0.652410 O\n0.006777 0.069729 0.521983 O\n0.420714 0.814625 0.478311 O\n0.756807 0.997942 0.089215 O\n0.439919 0.421146 0.766038 O\n0.428301 0.303633 0.355736 O\n0.862682 0.840021 0.962451 O\n0.714446 0.323507 0.187783 O\n0.356874 0.899317 0.998847 O\n0.329229 0.640998 0.372836 O\n0.661396 0.480127 0.838781 O\n0.098564 0.936826 0.883835 O\n0.669687 0.137423 0.551806 O\n0.995430 0.142965 0.717928 O\n0.276024 0.451379 0.964051 O\n0.824434 0.749159 0.751971 O\n0.316811 0.367074 0.552925 O\n0.353956 0.473834 0.230660 O\n0.024879 0.011939 0.086905 O\n0.582738 0.934008 0.915095 O\n0.804050 0.245997 0.686028 O\n0.384736 0.908573 0.768502 O\n0.220623 0.519370 0.728480 O\n0.575416 0.467020 0.069110 O\n",
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{
"id": "mp-25264",
"created_at": "2022-09-04T14:42:57.816065Z",
"structure_string": "Sb2 Mo4 O16\n1.0\n2.478757 11.670239 0.000000\n-2.478757 11.670239 0.000000\n0.000000 1.192710 5.371816\nSb Mo O\n2 4 16\ndirect\n0.674077 0.325923 0.750000 Sb\n0.325923 0.674077 0.250000 Sb\n0.369730 0.909698 0.454196 Mo\n0.630270 0.090302 0.545804 Mo\n0.090302 0.630270 0.045804 Mo\n0.909698 0.369730 0.954196 Mo\n0.647455 0.446184 0.023552 O\n0.146296 0.055802 0.187198 O\n0.055802 0.146296 0.687198 O\n0.118468 0.296272 0.858578 O\n0.853704 0.944198 0.812802 O\n0.944198 0.853704 0.312802 O\n0.881532 0.703728 0.141422 O\n0.703728 0.881532 0.641422 O\n0.621315 0.680599 0.694559 O\n0.680599 0.621315 0.194559 O\n0.446184 0.647455 0.523552 O\n0.378685 0.319401 0.305441 O\n0.352545 0.553816 0.976448 O\n0.553816 0.352545 0.476448 O\n0.319401 0.378685 0.805441 O\n0.296272 0.118468 0.358578 O\n",
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{
"id": "mp-1221183",
"created_at": "2022-09-04T14:44:30.016525Z",
"structure_string": "Na8 Nb4 Si16 O53\n1.0\n10.440753 0.000000 0.000000\n-3.823355 11.111192 0.000000\n-3.838603 -4.263976 10.277871\nNa Nb Si O\n8 4 16 53\ndirect\n0.189579 0.490676 0.930279 Na\n0.190933 0.991171 0.430003 Na\n0.810446 0.819572 0.758334 Na\n0.810782 0.320223 0.259114 Na\n0.809067 0.008829 0.569997 Na\n0.810421 0.509324 0.069721 Na\n0.189218 0.679777 0.740886 Na\n0.189554 0.180428 0.241666 Na\n0.073387 0.188694 0.939077 Nb\n0.072874 0.687927 0.440403 Nb\n0.927126 0.312073 0.559597 Nb\n0.926613 0.811306 0.060923 Nb\n0.607521 0.657789 0.407674 Si\n0.606279 0.157621 0.907947 Si\n0.393721 0.842379 0.092053 Si\n0.392479 0.342211 0.592326 Si\n0.815114 0.793344 0.294401 Si\n0.814519 0.293586 0.794813 Si\n0.185069 0.455987 0.456420 Si\n0.185065 0.955463 0.955978 Si\n0.185481 0.706414 0.205187 Si\n0.184886 0.206656 0.705599 Si\n0.814935 0.044537 0.044022 Si\n0.814931 0.544013 0.543580 Si\n0.255234 0.474940 0.225281 Si\n0.254345 0.975061 0.724721 Si\n0.745655 0.024939 0.275279 Si\n0.744766 0.525060 0.774719 Si\n0.826962 0.941712 0.339327 O\n0.826594 0.442024 0.839293 O\n0.173140 0.410592 0.308086 O\n0.172947 0.910182 0.807620 O\n0.173406 0.557976 0.160707 O\n0.173038 0.058288 0.660673 O\n0.827053 0.089818 0.192380 O\n0.826860 0.589408 0.691914 O\n0.241975 0.360534 0.110667 O\n0.242404 0.860994 0.610279 O\n0.757596 0.139006 0.389721 O\n0.758025 0.639466 0.889333 O\n0.790793 0.735874 0.144394 O\n0.790631 0.234394 0.644994 O\n0.206869 0.604666 0.513293 O\n0.209859 0.105595 0.013897 O\n0.209369 0.765606 0.355006 O\n0.209207 0.264126 0.855606 O\n0.790141 0.894405 0.986103 O\n0.793131 0.395334 0.486707 O\n0.663742 0.787153 0.536574 O\n0.658794 0.286635 0.036552 O\n0.341206 0.713365 0.963448 O\n0.336258 0.212847 0.463426 O\n0.426014 0.580644 0.330677 O\n0.425084 0.079939 0.830234 O\n0.574916 0.920061 0.169766 O\n0.573986 0.419356 0.669323 O\n0.972886 0.804848 0.395773 O\n0.972521 0.305166 0.896146 O\n0.027595 0.853880 0.945122 O\n0.028091 0.352108 0.444832 O\n0.027479 0.694834 0.103854 O\n0.027114 0.195152 0.604227 O\n0.971909 0.647892 0.555168 O\n0.972405 0.146120 0.054878 O\n0.935751 0.044785 0.795133 O\n0.936070 0.545309 0.294061 O\n0.063930 0.454691 0.705939 O\n0.064249 0.955215 0.204867 O\n0.669197 0.698143 0.305245 O\n0.669143 0.199623 0.806797 O\n0.330480 0.943452 0.050150 O\n0.330730 0.444523 0.551260 O\n0.330857 0.800377 0.193203 O\n0.330803 0.301857 0.694755 O\n0.669270 0.555477 0.448740 O\n0.669520 0.056548 0.949850 O\n0.476712 0.814982 0.544250 O\n0.463246 0.293162 0.042758 O\n0.536754 0.706838 0.957242 O\n0.523288 0.185018 0.455750 O\n0.500000 0.000000 0.500000 O\n",
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{
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"structure_string": "Ga2 Ni8 Ge6\n1.0\n3.817521 0.000000 0.000000\n0.000000 4.964229 0.000000\n0.000000 0.000000 11.502909\nGa Ni Ge\n2 8 6\ndirect\n0.500000 0.641844 0.814428 Ga\n0.500000 0.141844 0.185572 Ga\n0.500000 0.140911 0.795548 Ni\n0.500000 0.640911 0.204452 Ni\n0.000000 0.862464 0.701450 Ni\n0.000000 0.362464 0.298550 Ni\n0.500000 0.379127 0.995586 Ni\n0.500000 0.879127 0.004414 Ni\n0.000000 0.619534 0.505451 Ni\n0.000000 0.119534 0.494549 Ni\n0.000000 0.357444 0.687335 Ge\n0.000000 0.857444 0.312665 Ge\n0.500000 0.887226 0.573131 Ge\n0.500000 0.387226 0.426869 Ge\n0.000000 0.111450 0.928163 Ge\n0.000000 0.611450 0.071837 Ge\n",
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"formula_full": "Ga2 Ni8 Ge6",
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{
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{
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"structure_string": "Rb4 Te4 H4 O4 F16\n1.0\n2.491719 8.053878 0.000000\n-2.491719 8.053878 0.000000\n0.000000 1.056898 14.035873\nRb Te H O F\n4 4 4 4 16\ndirect\n0.168106 0.359555 0.486970 Rb\n0.359555 0.168106 0.986970 Rb\n0.475509 0.640195 0.250467 Rb\n0.640195 0.475509 0.750467 Rb\n0.980666 0.022677 0.503423 Te\n0.022677 0.980666 0.003423 Te\n0.802271 0.836239 0.245570 Te\n0.836239 0.802271 0.745570 Te\n0.105131 0.350039 0.245684 H\n0.350039 0.105131 0.745684 H\n0.721491 0.465407 0.993509 H\n0.465407 0.721491 0.493509 H\n0.911719 0.527407 0.272512 O\n0.527407 0.911719 0.772512 O\n0.284152 0.918436 0.469621 O\n0.918436 0.284152 0.969621 O\n0.424795 0.034618 0.215869 F\n0.034618 0.424795 0.715869 F\n0.691148 0.913492 0.386255 F\n0.913492 0.691148 0.886255 F\n0.939032 0.692001 0.109185 F\n0.692001 0.939032 0.609185 F\n0.200333 0.560455 0.277401 F\n0.560455 0.200333 0.777401 F\n0.919490 0.103391 0.142081 F\n0.103391 0.919490 0.642081 F\n0.272167 0.611719 0.488959 F\n0.611719 0.272167 0.988959 F\n0.911817 0.108338 0.360730 F\n0.108338 0.911817 0.860730 F\n0.405617 0.774587 0.032764 F\n0.774587 0.405617 0.532764 F\n",
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{
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