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{
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"structure_string": "Dy20 Si16\n1.0\n7.416217 -0.000000 0.000000\n-0.000000 7.703509 0.000000\n0.000000 0.000000 14.565951\nDy Si\n20 16\ndirect\n0.650748 0.988242 0.750000 Dy\n0.680301 0.820814 0.376971 Dy\n0.180301 0.679186 0.123029 Dy\n0.319700 0.179186 0.876971 Dy\n0.319700 0.179186 0.623029 Dy\n0.819700 0.320814 0.876971 Dy\n0.180301 0.679186 0.376971 Dy\n0.680301 0.820814 0.123029 Dy\n0.974398 0.817240 0.597774 Dy\n0.474398 0.682760 0.902226 Dy\n0.819700 0.320814 0.623029 Dy\n0.025602 0.182760 0.097774 Dy\n0.025602 0.182760 0.402226 Dy\n0.525602 0.317240 0.097774 Dy\n0.474398 0.682760 0.597774 Dy\n0.974398 0.817240 0.902226 Dy\n0.349253 0.011758 0.250000 Dy\n0.849253 0.488242 0.250000 Dy\n0.150747 0.511758 0.750000 Dy\n0.525602 0.317240 0.402226 Dy\n0.650243 0.029017 0.539772 Si\n0.150243 0.470983 0.960228 Si\n0.150243 0.470983 0.539772 Si\n0.650243 0.029017 0.960228 Si\n0.349757 0.970983 0.460228 Si\n0.849758 0.529018 0.039772 Si\n0.976766 0.896191 0.250000 Si\n0.230826 0.371325 0.250000 Si\n0.523234 0.396191 0.750000 Si\n0.023234 0.103809 0.750000 Si\n0.730826 0.128675 0.250000 Si\n0.269174 0.871325 0.750000 Si\n0.769174 0.628675 0.750000 Si\n0.349757 0.970983 0.039772 Si\n0.476766 0.603809 0.250000 Si\n0.849758 0.529018 0.460228 Si\n",
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{
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"structure_string": "Li2 Nd2 P8 O24\n1.0\n6.424406 0.000000 2.750081\n2.292592 8.011532 3.523326\n-0.043437 -0.137216 8.980475\nLi Nd P O\n2 2 8 24\ndirect\n0.000000 0.000000 0.000000 Li\n-0.000000 0.500000 0.500000 Li\n0.218405 0.250000 0.750000 Nd\n0.781595 0.750000 0.250000 Nd\n0.436294 0.161687 0.102349 P\n0.700330 0.338313 0.397651 P\n0.563706 0.838312 0.897651 P\n0.299670 0.661687 0.602349 P\n0.325515 0.410730 0.286681 P\n0.022926 0.089270 0.213319 P\n0.674485 0.589269 0.713319 P\n0.977074 0.910730 0.786681 P\n0.999922 0.203966 0.043477 O\n0.240480 0.085461 0.238047 O\n0.563988 0.414539 0.261953 O\n0.156793 0.551266 0.655678 O\n0.363737 0.948733 0.844323 O\n0.843207 0.448733 0.344322 O\n0.636263 0.051266 0.155678 O\n0.156607 0.841413 0.634521 O\n0.632541 0.658586 0.865479 O\n0.000078 0.796033 0.956523 O\n0.367459 0.341413 0.134521 O\n0.436280 0.196781 0.926701 O\n0.559762 0.303218 0.573299 O\n0.563720 0.803218 0.073300 O\n0.440238 0.696781 0.426701 O\n0.436012 0.585461 0.738047 O\n0.759520 0.914538 0.761953 O\n0.171512 0.582078 0.262520 O\n0.016111 0.917921 0.237480 O\n0.828488 0.417921 0.737480 O\n-0.016111 0.082078 0.762520 O\n0.247365 0.296034 0.456523 O\n0.752635 0.703965 0.543477 O\n0.843393 0.158586 0.365479 O\n",
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{
"id": "jvasp-97604",
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"updated_at": "2022-09-04T14:35:44.224850Z",
"structure_string": "Ca2 Cu2 H8 C8 O16\n1.0\n6.449989 0.052914 0.000000\n-0.901024 7.249171 0.000000\n0.000000 0.000000 8.337046\nCa Cu H C O\n2 2 8 8 16\ndirect\n0.750000 -0.000000 0.136462 Ca\n0.250000 -0.000000 0.863538 Ca\n0.750000 0.499999 0.405196 Cu\n0.250000 0.500000 0.594805 Cu\n0.722825 0.847186 0.552689 H\n0.777176 0.152813 0.552689 H\n0.907134 0.433103 0.846414 H\n0.222825 0.847186 0.447311 H\n0.277176 0.152813 0.447311 H\n0.092867 0.566896 0.153586 H\n0.407134 0.433103 0.153586 H\n0.592867 0.566896 0.846414 H\n0.504018 0.318125 0.142765 C\n0.629767 0.191055 0.602437 C\n0.870234 0.808944 0.602437 C\n0.370234 0.808944 0.397564 C\n0.495983 0.681874 0.857235 C\n0.004018 0.318125 0.857235 C\n0.129767 0.191055 0.397564 C\n0.995983 0.681874 0.142765 C\n0.037505 0.805906 0.038919 O\n0.913899 0.644711 0.571321 O\n0.158739 0.314812 0.761702 O\n0.086101 0.355288 0.428680 O\n0.413899 0.644712 0.428680 O\n0.537505 0.805906 0.961081 O\n0.586101 0.355288 0.571321 O\n0.658739 0.314812 0.238298 O\n0.841261 0.685187 0.238298 O\n0.341261 0.685188 0.761702 O\n0.462496 0.194093 0.038919 O\n0.016766 0.075845 0.316090 O\n0.983235 0.924154 0.683910 O\n0.516766 0.075845 0.683910 O\n0.962496 0.194093 0.961081 O\n0.483235 0.924154 0.316090 O\n",
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{
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"structure_string": "K4 V4 S4 O24\n1.0\n5.416145 0.000000 0.000000\n0.000000 8.219476 0.000000\n0.000000 0.000000 11.126794\nK V S O\n4 4 4 24\ndirect\n0.276901 0.439174 0.887472 K\n0.776902 0.560826 0.612527 K\n0.723099 0.060826 0.387473 K\n0.223099 0.939175 0.112527 K\n0.293447 0.904182 0.687710 V\n0.793447 0.095819 0.812290 V\n0.206554 0.404181 0.312290 V\n0.706554 0.595819 0.187710 V\n0.211839 0.800645 0.459644 S\n0.288161 0.300645 0.540356 S\n0.788162 0.699356 0.959644 S\n0.711840 0.199356 0.040356 S\n0.256912 0.234596 0.242295 O\n0.539280 0.119842 0.946843 O\n0.878282 0.864184 0.938164 O\n0.743088 0.265404 0.742295 O\n0.378281 0.135816 0.561836 O\n0.765344 0.598958 0.852991 O\n0.121719 0.635816 0.438164 O\n0.104430 0.046365 0.762871 O\n0.604431 0.953635 0.737128 O\n0.243088 0.734596 0.757705 O\n0.048408 0.301726 0.467551 O\n0.451592 0.801726 0.532448 O\n0.265343 0.401043 0.647008 O\n0.951593 0.198274 0.967551 O\n0.548409 0.698274 0.032449 O\n0.756913 0.765404 0.257705 O\n0.621720 0.364184 0.061836 O\n0.395570 0.546366 0.237128 O\n0.734658 0.098958 0.147008 O\n0.039280 0.880158 0.553157 O\n0.895571 0.453635 0.262872 O\n0.960721 0.619842 0.053157 O\n0.234657 0.901043 0.352991 O\n0.460721 0.380158 0.446843 O\n",
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{
"id": "jvasp-62191",
"created_at": "2022-09-04T14:35:42.956064Z",
"updated_at": "2022-09-04T14:35:42.956099Z",
"structure_string": "Cu4 As16 S12 Cl4\n1.0\n7.240151 -0.000000 0.000000\n0.000000 10.915253 0.000000\n0.000000 0.000000 11.090309\nCu As S Cl\n4 16 12 4\ndirect\n0.500000 0.301246 0.750000 Cu\n0.000000 0.698754 0.250000 Cu\n0.500000 0.698754 0.250000 Cu\n0.000000 0.301246 0.750000 Cu\n0.750000 0.250569 0.220523 As\n0.250000 0.749431 0.779477 As\n0.250000 0.250569 0.279477 As\n0.424646 0.637453 0.943177 As\n0.924646 0.362547 0.056823 As\n0.075354 0.362547 0.443177 As\n0.575354 0.637453 0.556823 As\n0.750000 0.749431 0.720523 As\n0.075354 0.637453 0.943177 As\n0.924646 0.637453 0.556823 As\n0.424646 0.362547 0.443177 As\n0.750000 0.064716 0.944760 As\n0.250000 0.935283 0.055240 As\n0.750000 0.935283 0.444760 As\n0.250000 0.064716 0.555240 As\n0.575354 0.362547 0.056823 As\n0.492098 0.796649 0.070539 S\n0.992098 0.203351 0.929461 S\n0.007902 0.203351 0.570539 S\n0.507902 0.796649 0.429461 S\n0.507902 0.203351 0.929461 S\n0.007902 0.796649 0.070539 S\n0.750000 0.055293 0.149739 S\n0.492098 0.203351 0.570539 S\n0.250000 0.944707 0.850262 S\n0.750000 0.944707 0.649739 S\n0.250000 0.055293 0.350261 S\n0.992098 0.796649 0.429461 S\n0.750000 0.554668 0.236733 Cl\n0.750000 0.445332 0.736733 Cl\n0.250000 0.554668 0.263267 Cl\n0.250000 0.445332 0.763267 Cl\n",
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{
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"structure_string": "Ca4 Si4 B4 H4 O20\n1.0\n0.000000 4.842603 0.002245\n7.642604 0.000000 0.000000\n0.000000 -0.033624 -9.706613\nCa Si B H O\n4 4 4 4 20\ndirect\n0.991983 0.393728 0.836445 Ca\n0.008018 0.893728 0.663556 Ca\n0.008018 0.606271 0.163556 Ca\n0.991982 0.106272 0.336445 Ca\n0.529259 0.732419 0.915938 Si\n0.470742 0.232420 0.584062 Si\n0.470741 0.267580 0.084062 Si\n0.529258 0.767580 0.415938 Si\n0.428421 0.911368 0.159027 B\n0.571579 0.411368 0.340973 B\n0.571579 0.088632 0.840973 B\n0.428421 0.588631 0.659027 B\n0.810016 0.535134 0.577367 H\n0.189984 0.035134 0.922633 H\n0.810016 0.964865 0.077367 H\n0.189984 0.464865 0.422633 H\n0.678306 0.335265 0.211203 O\n0.261005 0.413739 0.336686 O\n0.738995 0.913739 0.163314 O\n0.687372 0.588990 0.354290 O\n0.312628 0.088990 0.145711 O\n0.312629 0.411009 0.645711 O\n0.687372 0.911009 0.854289 O\n0.321693 0.835265 0.288798 O\n0.678307 0.164734 0.711203 O\n0.241715 0.095461 0.535979 O\n0.325916 0.697576 0.542363 O\n0.674084 0.197576 0.957637 O\n0.674084 0.302423 0.457637 O\n0.325916 0.802423 0.042364 O\n0.758286 0.904538 0.464022 O\n0.241714 0.404538 0.035979 O\n0.261005 0.086261 0.836686 O\n0.758286 0.595461 0.964022 O\n0.321694 0.664734 0.788797 O\n0.738995 0.586260 0.663314 O\n",
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"structure_string": "Nb8 Fe4 O24\n1.0\n5.066962 -0.000000 0.000000\n-0.000000 5.627102 0.000000\n0.000000 0.000000 13.751896\nNb Fe O\n8 4 24\ndirect\n0.721965 0.183988 0.844457 Nb\n0.278034 0.816012 0.155543 Nb\n0.778034 0.683988 0.344457 Nb\n0.221965 0.816012 0.844457 Nb\n0.221965 0.316012 0.655543 Nb\n0.278034 0.316012 0.344457 Nb\n0.778034 0.183988 0.155543 Nb\n0.721965 0.683988 0.655543 Nb\n0.750000 0.136921 0.500000 Fe\n0.250000 0.863078 0.500000 Fe\n0.750000 0.636921 0.000000 Fe\n0.250000 0.363079 0.000000 Fe\n0.391566 0.118011 0.913037 O\n0.075993 0.615514 0.072103 O\n0.575993 0.884485 0.427897 O\n0.424006 0.615514 0.927897 O\n0.924006 0.884485 0.572103 O\n0.891565 0.381988 0.586963 O\n0.946014 0.387502 0.256956 O\n0.108434 0.618011 0.413037 O\n0.446015 0.112498 0.243044 O\n0.553985 0.387502 0.743045 O\n0.053985 0.112498 0.756956 O\n0.053985 0.612498 0.743045 O\n0.553985 0.887502 0.756956 O\n0.446015 0.612498 0.256956 O\n0.108434 0.118011 0.086963 O\n0.946014 0.887502 0.243044 O\n0.424006 0.115514 0.572103 O\n0.575993 0.384486 0.072103 O\n0.075993 0.115514 0.427897 O\n0.891565 0.881988 0.913037 O\n0.391566 0.618011 0.586963 O\n0.608434 0.881988 0.086963 O\n0.924006 0.384486 0.927897 O\n0.608434 0.381988 0.413037 O\n",
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"structure_string": "B4 Pb12 O16 F4\n1.0\n6.501188 0.000000 0.000000\n-0.000000 7.683158 0.000000\n0.000000 0.000000 12.110200\nB Pb O F\n4 12 16 4\ndirect\n0.250000 0.978322 0.500000 B\n0.750000 0.021678 0.000000 B\n0.750000 0.021678 0.500000 B\n0.250000 0.978322 0.000000 B\n0.450762 0.891647 0.750000 Pb\n0.549238 0.108353 0.250000 Pb\n0.950763 0.108353 0.750000 Pb\n0.049238 0.891647 0.250000 Pb\n0.470564 0.333071 0.895031 Pb\n0.529436 0.666929 0.395031 Pb\n0.970565 0.666929 0.604969 Pb\n0.470564 0.333071 0.604969 Pb\n0.529436 0.666929 0.104969 Pb\n0.970565 0.666929 0.895031 Pb\n0.029436 0.333071 0.395031 Pb\n0.029436 0.333071 0.104969 Pb\n0.203405 0.067813 0.096361 O\n0.750000 0.202666 0.000000 O\n0.250000 0.797334 0.500000 O\n0.250000 0.797334 0.000000 O\n0.750000 0.202666 0.500000 O\n0.703405 0.932187 0.403639 O\n0.296595 0.067813 0.903639 O\n0.796595 0.932187 0.596361 O\n0.090068 0.806360 0.750000 O\n0.703405 0.932187 0.096361 O\n0.796595 0.932187 0.903639 O\n0.203405 0.067813 0.403639 O\n0.590068 0.193640 0.750000 O\n0.409932 0.806360 0.250000 O\n0.909932 0.193640 0.250000 O\n0.296595 0.067813 0.596361 O\n0.804906 0.578113 0.250000 F\n0.304906 0.421887 0.250000 F\n0.695094 0.578113 0.750000 F\n0.195094 0.421887 0.750000 F\n",
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{
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