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{
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"structure_string": "Li2 Al2 B28\n1.0\n5.349581 0.000000 2.374575\n2.044597 6.395942 2.607025\n0.004477 0.002044 7.203124\nLi Al B\n2 2 28\ndirect\n0.750001 0.601236 0.898762 Li\n0.250000 0.398764 0.101236 Li\n0.000000 -0.000000 0.500000 Al\n0.500000 -0.000000 0.499999 Al\n0.830869 0.963525 0.876893 B\n0.350799 0.029429 0.268972 B\n0.149202 0.231027 0.470570 B\n0.666632 0.365587 0.301149 B\n0.333369 0.634412 0.698849 B\n0.833368 0.198850 0.134412 B\n0.166633 0.801149 0.865586 B\n0.585198 0.245301 0.584303 B\n0.414804 0.754698 0.415695 B\n0.914804 0.915695 0.254697 B\n0.085198 0.084304 0.745301 B\n0.278432 0.398219 0.726934 B\n0.403587 0.601780 0.273064 B\n0.850800 0.768972 0.529428 B\n0.221569 0.773064 0.101779 B\n0.596414 0.398219 0.726934 B\n0.096414 0.226935 0.898219 B\n0.778432 0.226935 0.898219 B\n0.903587 0.773064 0.101779 B\n0.171290 0.623104 0.536474 B\n0.330868 0.376895 0.463525 B\n0.328712 0.963525 0.876894 B\n0.169132 0.036474 0.123105 B\n0.828711 0.376895 0.463524 B\n0.669133 0.623104 0.536473 B\n0.671289 0.036474 0.123105 B\n0.649203 0.970570 0.731026 B\n0.721569 0.601780 0.273064 B\n",
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{
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"updated_at": "2022-09-04T14:35:53.364317Z",
"structure_string": "Ti8 Ni4 P20\n1.0\n3.354623 0.000000 0.000000\n-0.000000 11.202583 0.000000\n0.000000 0.000000 12.487996\nTi Ni P\n8 4 20\ndirect\n0.749999 0.902788 0.765879 Ti\n0.250000 0.097211 0.234121 Ti\n0.749999 0.402788 0.734121 Ti\n0.250000 0.597211 0.265879 Ti\n0.749999 0.655899 0.598370 Ti\n0.250000 0.344101 0.401630 Ti\n0.749999 0.155899 0.901630 Ti\n0.250000 0.844101 0.098370 Ti\n0.250000 0.846068 0.327323 Ni\n0.749999 0.153932 0.672677 Ni\n0.749999 0.653931 0.827324 Ni\n0.250000 0.346068 0.172677 Ni\n0.749999 0.218068 0.113692 P\n0.250000 0.437542 0.018339 P\n0.749999 0.562458 0.981661 P\n0.250000 0.823586 0.626010 P\n0.749999 0.176414 0.373991 P\n0.250000 0.323586 0.873991 P\n0.749999 0.676413 0.126010 P\n0.250000 0.781931 0.886308 P\n0.250000 0.281932 0.613692 P\n0.250000 0.567366 0.464408 P\n0.250000 0.571810 0.729160 P\n0.749999 0.428190 0.270840 P\n0.250000 0.071810 0.770840 P\n0.749999 0.928190 0.229160 P\n0.749999 0.062458 0.518339 P\n0.749999 0.432634 0.535592 P\n0.250000 0.067366 0.035592 P\n0.749999 0.932634 0.964408 P\n0.749999 0.718068 0.386308 P\n0.250000 0.937542 0.481661 P\n",
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{
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"updated_at": "2022-09-04T14:36:08.188983Z",
"structure_string": "Tl8 B8 O16\n1.0\n7.409393 -0.000000 0.000000\n0.000000 7.409393 0.000000\n-0.000000 -0.000000 9.440188\nTl B O\n8 8 16\ndirect\n0.264992 0.263674 0.995989 Tl\n0.263674 0.735008 0.745989 Tl\n0.735008 0.736325 0.495988 Tl\n0.256906 0.022724 0.408589 Tl\n0.977276 0.256906 0.658589 Tl\n0.022724 0.743093 0.158589 Tl\n0.743093 0.977276 0.908589 Tl\n0.736325 0.264992 0.245988 Tl\n0.546252 0.594625 0.020040 B\n0.405375 0.546252 0.270040 B\n0.594625 0.453747 0.770040 B\n0.453747 0.405375 0.520040 B\n0.865199 0.542196 0.919511 B\n0.457803 0.865199 0.169511 B\n0.134801 0.457803 0.419511 B\n0.542196 0.134801 0.669511 B\n0.499964 0.209745 0.538431 O\n0.044977 0.557447 0.940521 O\n0.442552 0.044977 0.190521 O\n0.557447 0.955023 0.690521 O\n0.955023 0.442552 0.440521 O\n0.746937 0.574989 0.032564 O\n0.425010 0.746937 0.282564 O\n0.574989 0.253062 0.782564 O\n0.253062 0.425010 0.532564 O\n0.461112 0.485295 0.129857 O\n0.538887 0.514704 0.629857 O\n0.514704 0.461112 0.379857 O\n0.790255 0.499964 0.788431 O\n0.500035 0.790255 0.038431 O\n0.209745 0.500035 0.288431 O\n0.485295 0.538887 0.879857 O\n",
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{
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"created_at": "2022-09-04T14:35:58.043073Z",
"updated_at": "2022-09-04T14:35:58.043092Z",
"structure_string": "Na4 Cr4 F24\n1.0\n5.892071 -0.000000 0.000000\n0.000000 7.600092 0.000000\n0.000000 0.000000 9.442375\nNa Cr F\n4 4 24\ndirect\n0.250000 0.169241 0.502685 Na\n0.750000 0.669241 0.997314 Na\n0.750000 0.830759 0.497314 Na\n0.250000 0.330759 0.002686 Na\n0.750000 0.115514 0.769840 Cr\n0.750000 0.384486 0.269840 Cr\n0.250000 0.615514 0.730159 Cr\n0.250000 0.884486 0.230159 Cr\n0.532533 0.169531 0.893536 F\n0.538058 0.448564 0.139360 F\n0.538058 0.051436 0.639360 F\n0.250000 0.670948 0.299788 F\n0.967467 0.169531 0.893536 F\n0.461942 0.948564 0.360640 F\n0.032533 0.669531 0.606463 F\n0.961942 0.448564 0.139360 F\n0.750000 0.329052 0.700212 F\n0.467467 0.669531 0.606463 F\n0.250000 0.392010 0.669227 F\n0.750000 0.892010 0.830773 F\n0.532533 0.330469 0.393536 F\n0.750000 0.607990 0.330773 F\n0.250000 0.107990 0.169227 F\n0.032533 0.830469 0.106463 F\n0.961942 0.051436 0.639360 F\n0.250000 0.829052 0.799787 F\n0.467467 0.830469 0.106463 F\n0.038058 0.551436 0.860640 F\n0.750000 0.170948 0.200212 F\n0.038058 0.948564 0.360640 F\n0.461942 0.551436 0.860640 F\n0.967467 0.330469 0.393536 F\n",
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{
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"structure_string": "K12 Fe4 O16\n1.0\n7.621910 0.000000 0.000000\n-0.000000 7.841314 0.000000\n0.000000 0.000000 8.987101\nK Fe O\n12 4 16\ndirect\n0.334829 0.560731 0.250000 K\n0.462320 0.781700 0.963678 K\n0.537680 0.218300 0.463678 K\n0.962320 0.718300 0.536322 K\n0.037680 0.281700 0.463678 K\n0.537680 0.218300 0.036322 K\n0.462320 0.781700 0.536322 K\n0.962320 0.718300 0.963678 K\n0.665171 0.439268 0.750000 K\n0.165171 0.060732 0.750000 K\n0.834829 0.939268 0.250000 K\n0.037680 0.281700 0.036322 K\n0.723838 0.990287 0.750000 Fe\n0.776162 0.490287 0.250000 Fe\n0.276162 0.009712 0.250000 Fe\n0.223838 0.509712 0.750000 Fe\n0.284875 0.229470 0.250000 O\n0.818838 0.042266 0.919145 O\n0.181162 0.957733 0.419145 O\n0.181162 0.957733 0.080855 O\n0.681162 0.542266 0.419145 O\n0.318838 0.457733 0.919145 O\n0.818838 0.042266 0.580855 O\n0.018434 0.416210 0.750000 O\n0.518434 0.083790 0.750000 O\n0.481566 0.916210 0.250000 O\n0.981567 0.583789 0.250000 O\n0.715125 0.770529 0.750000 O\n0.215125 0.729470 0.750000 O\n0.784875 0.270530 0.250000 O\n0.318838 0.457733 0.580855 O\n0.681162 0.542266 0.080855 O\n",
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"structure_string": "K4 Pd8 F20\n1.0\n6.104313 0.000000 0.000000\n0.000000 7.487439 0.000000\n0.000000 0.000000 10.727214\nK Pd F\n4 8 20\ndirect\n0.483793 0.750000 0.865531 K\n0.983793 0.750000 0.634468 K\n0.516206 0.250000 0.134468 K\n0.016207 0.250000 0.365532 K\n0.309556 0.750000 0.213755 Pd\n0.690444 0.250000 0.786245 Pd\n0.190444 0.250000 0.713755 Pd\n0.000000 0.000000 0.000000 Pd\n0.500000 0.500000 0.500000 Pd\n0.000000 0.500000 0.000000 Pd\n0.500000 0.000000 0.500000 Pd\n0.809555 0.750000 0.286245 Pd\n0.179273 0.066910 0.579674 F\n0.679272 0.433090 0.920326 F\n0.820727 0.566910 0.420326 F\n0.320727 0.933090 0.079674 F\n0.708648 0.053829 0.661120 F\n0.549554 0.250000 0.399543 F\n0.049555 0.250000 0.100456 F\n0.679272 0.066910 0.920326 F\n0.179273 0.433090 0.579674 F\n0.320727 0.566910 0.079674 F\n0.820727 0.933090 0.420326 F\n0.208648 0.053829 0.838880 F\n0.708648 0.446172 0.661120 F\n0.791352 0.553829 0.161120 F\n0.291352 0.946172 0.338880 F\n0.791352 0.946172 0.161120 F\n0.291352 0.553829 0.338880 F\n0.208648 0.446172 0.838880 F\n0.950445 0.750000 0.899543 F\n0.450445 0.750000 0.600456 F\n",
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"structure_string": "P4 C8 S8 N12\n1.0\n7.890883 -0.031217 -1.958312\n-1.141386 7.563352 -1.252845\n-0.131774 -0.008266 9.441139\nP C S N\n4 8 8 12\ndirect\n0.073566 0.257955 0.418186 P\n0.065641 0.464720 0.715268 P\n0.934359 0.535279 0.284731 P\n0.926433 0.742044 0.581814 P\n0.798646 -0.000669 0.269525 C\n0.201354 0.000668 0.730475 C\n0.578365 0.434527 0.185506 C\n0.069367 0.745303 0.122171 C\n0.417055 0.222675 0.470317 C\n0.930633 0.254696 0.877829 C\n0.421634 0.565471 0.814494 C\n0.582945 0.777324 0.529682 C\n0.620984 0.583889 0.844580 S\n0.615982 0.899273 0.178120 S\n0.379016 0.416109 0.155420 S\n0.384018 0.100726 0.821880 S\n0.617971 0.253239 0.518721 S\n0.382028 0.746760 0.481278 S\n0.179264 0.891799 0.075662 S\n0.820736 0.108199 0.924337 S\n0.732185 0.440147 0.205858 N\n0.052863 0.386976 0.303458 N\n0.951520 0.685117 0.422715 N\n0.261567 0.189992 0.431263 N\n0.978353 0.628274 0.150143 N\n0.048479 0.314882 0.577285 N\n0.943012 0.068048 0.340893 N\n0.056987 0.931950 0.659106 N\n0.738432 0.810006 0.568737 N\n0.947136 0.613023 0.696541 N\n0.267814 0.559852 0.794142 N\n0.021647 0.371725 0.849856 N\n",
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{
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