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{
"id": "jvasp-86554",
"created_at": "2022-09-04T14:36:05.409346Z",
"updated_at": "2022-09-04T14:36:05.409376Z",
"structure_string": "Hg2 C2 S2 O6 F6\n1.0\n5.064907 -0.026199 -0.647031\n-0.398761 5.217588 -0.397606\n-0.082654 0.334347 9.885966\nHg C S O F\n2 2 2 6 6\ndirect\n0.168093 0.133114 0.587221 Hg\n0.831909 0.866887 0.412779 Hg\n0.335437 0.238775 0.126898 C\n0.664565 0.761226 0.873102 C\n0.355334 0.434288 0.290232 S\n0.644668 0.565712 0.709768 S\n0.083196 0.476414 0.304748 O\n0.916805 0.523587 0.695252 O\n0.507758 0.719841 0.607670 O\n0.515613 0.669031 0.262307 O\n0.484389 0.330969 0.737693 O\n0.492243 0.280160 0.392331 O\n0.169277 0.028676 0.132815 F\n0.579289 0.167214 0.112272 F\n0.243435 0.370958 0.019435 F\n0.830725 -0.028676 0.867186 F\n0.756567 0.629043 0.980565 F\n0.420713 0.832787 0.887728 F\n",
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{
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"structure_string": "K1 Au1 O2\n1.0\n3.058133 -0.000000 0.000000\n-0.000000 3.590329 0.000000\n0.000000 0.000000 5.837206\nK Au O\n1 1 2\ndirect\n0.000000 0.500000 0.500000 K\n0.000000 0.000000 0.000000 Au\n0.499999 0.000000 0.770265 O\n0.499999 0.000000 0.229736 O\n",
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{
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"updated_at": "2022-09-04T14:35:57.466131Z",
"structure_string": "Li4 Te2 O6\n1.0\n5.185134 -0.000000 0.304272\n2.592567 4.728146 0.152136\n0.177790 -0.000000 7.457398\nLi Te O\n4 2 6\ndirect\n0.644022 0.315528 0.122544 Li\n0.959550 0.684472 0.122544 Li\n0.040449 0.315528 0.877456 Li\n0.355977 0.684472 0.877456 Li\n0.272007 0.000000 0.293655 Te\n0.727993 0.000000 0.706345 Te\n0.366948 0.000000 0.757536 O\n0.633052 0.000000 0.242464 O\n0.025131 0.302206 0.147524 O\n0.672663 0.302206 0.852477 O\n0.327336 0.697795 0.147524 O\n0.974869 0.697795 0.852477 O\n",
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{
"id": "jvasp-86547",
"created_at": "2022-09-04T14:35:50.907612Z",
"updated_at": "2022-09-04T14:35:50.907637Z",
"structure_string": "C6 F12\n1.0\n5.603261 -0.050305 -1.813350\n-0.635479 6.130816 -0.282103\n0.096338 -0.028546 6.390947\nC F\n6 12\ndirect\n0.551637 0.826847 0.771337 C\n0.448363 0.173154 0.228664 C\n0.343645 0.740824 0.629061 C\n0.656355 0.259177 0.370940 C\n0.248968 0.290003 0.099987 C\n0.751032 0.709998 0.900014 C\n0.275258 0.529416 0.578156 F\n0.181844 0.862891 0.522426 F\n0.598086 0.047425 0.807078 F\n0.049142 0.247051 0.165178 F\n0.184928 0.223308 0.882571 F\n0.815072 0.776693 0.117430 F\n0.950858 0.752950 0.834824 F\n0.818156 0.137110 0.477575 F\n0.724742 0.470585 0.421845 F\n0.692214 0.490480 0.876784 F\n0.307786 0.509521 0.123217 F\n0.401914 0.952575 0.192924 F\n",
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{
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"created_at": "2022-09-04T14:35:43.676899Z",
"updated_at": "2022-09-04T14:35:43.676926Z",
"structure_string": "La2 B4 Cl2 O8\n1.0\n4.257664 0.001656 0.055199\n2.035360 6.257138 0.908575\n-0.001792 0.001461 8.154298\nLa B Cl O\n2 4 2 8\ndirect\n0.213967 0.030638 0.222506 La\n0.786033 0.969363 0.777494 La\n0.166131 0.350616 0.853124 B\n0.437431 0.436238 0.193654 B\n0.833868 0.649385 0.146875 B\n0.562568 0.563763 0.806346 B\n0.145245 0.205318 0.541713 Cl\n0.854754 0.794683 0.458286 Cl\n0.900185 0.536031 0.823893 O\n0.477249 0.375686 0.818774 O\n0.635213 0.235332 0.209418 O\n0.522750 0.624315 0.181226 O\n0.364786 0.764668 0.790581 O\n0.099814 0.463969 0.176106 O\n0.838081 0.845402 0.079647 O\n0.161918 0.154598 0.920353 O\n",
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{
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"created_at": "2022-09-04T14:36:16.443940Z",
"updated_at": "2022-09-04T14:36:16.443960Z",
"structure_string": "Na2 Si4 Cu2 O11\n1.0\n5.183654 -0.010741 -0.685371\n-1.266495 6.179721 -0.752270\n-0.024380 -0.055703 8.354892\nNa Si Cu O\n2 4 2 11\ndirect\n0.872841 0.352955 0.193250 Na\n0.127158 0.647046 0.806749 Na\n0.408477 0.654653 0.187043 Si\n0.009663 0.134143 0.679848 Si\n0.591522 0.345348 0.812957 Si\n0.299727 0.110590 0.070608 Si\n0.990335 0.865857 0.320152 Cu\n0.700272 0.889411 0.929391 Cu\n0.768562 0.269311 0.672556 O\n0.726989 0.588697 0.896945 O\n0.231437 0.730689 0.327443 O\n0.001178 0.024870 0.183786 O\n0.715511 0.674847 0.279836 O\n0.402324 0.824879 0.053044 O\n0.597674 0.175121 0.946956 O\n0.000000 0.000000 0.500000 O\n0.284487 0.325153 0.720163 O\n-0.001179 0.975130 0.816214 O\n0.273009 0.411303 0.103055 O\n",
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{
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"created_at": "2022-09-04T14:36:11.533041Z",
"updated_at": "2022-09-04T14:36:11.533058Z",
"structure_string": "Bi4 Pd2 O8\n1.0\n5.011678 -0.000019 2.428398\n2.505837 6.402596 1.214152\n-0.286086 -0.000051 6.976015\nBi Pd O\n4 2 8\ndirect\n0.653572 0.500000 0.160106 Bi\n0.813676 0.839893 0.500001 Bi\n0.153571 0.160107 0.500000 Bi\n0.313676 0.500002 0.839892 Bi\n0.671671 -0.000001 -0.000002 Pd\n0.171671 -0.000002 -0.000001 Pd\n0.553025 0.907278 0.302163 O\n0.960304 0.092724 0.302163 O\n0.053024 0.302164 0.907277 O\n0.762465 0.092724 0.697836 O\n0.355188 0.907277 0.697838 O\n0.855188 0.697839 0.907276 O\n0.460304 0.302163 0.092724 O\n0.262465 0.697837 0.092724 O\n",
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"created_at": "2022-09-04T14:37:00.306002Z",
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"structure_string": "Sn4 P3\n1.0\n3.993402 0.010877 11.631144\n1.950079 3.484906 11.631144\n0.018492 0.010877 12.297578\nSn P\n4 3\ndirect\n0.709967 0.709971 0.709968 Sn\n0.290030 0.290032 0.290031 Sn\n0.866893 0.866897 0.866894 Sn\n0.133105 0.133106 0.133105 Sn\n0.000000 0.000000 0.000000 P\n0.570947 0.570950 0.570948 P\n0.429051 0.429053 0.429051 P\n",
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"updated_at": "2022-09-04T14:36:07.026142Z",
"structure_string": "Na2 Pd1 Se2 O8\n1.0\n4.998614 0.005710 0.315147\n1.885811 5.449008 1.719536\n-0.031608 0.063921 7.216021\nNa Pd Se O\n2 1 2 8\ndirect\n0.798757 0.262149 0.808977 Na\n0.201242 0.737851 0.191024 Na\n0.499999 -0.000000 0.500000 Pd\n0.120796 0.678646 0.719060 Se\n0.879202 0.321354 0.280941 Se\n0.262346 0.785777 0.500980 O\n0.793588 0.683515 0.654577 O\n0.292096 0.385416 0.823486 O\n0.206411 0.316485 0.345424 O\n0.104086 0.858036 0.856820 O\n0.895912 0.141964 0.143181 O\n0.737652 0.214223 0.499021 O\n0.707902 0.614584 0.176515 O\n",
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"structure_string": "V2 S4 N6 Cl4\n1.0\n5.600664 0.021725 -0.902687\n-1.016558 6.781149 -0.656523\n0.069530 0.003646 7.713795\nV S N Cl\n2 4 6 4\ndirect\n0.763902 0.848347 0.021008 V\n0.236097 0.151653 0.978991 V\n0.742654 0.637187 0.357552 S\n0.812776 0.119170 0.664870 S\n0.257345 0.362813 0.642448 S\n0.187223 0.880830 0.335129 S\n0.986580 0.257089 0.571590 N\n0.068370 0.925623 0.145781 N\n0.013419 0.742911 0.428409 N\n0.658370 0.696709 0.167832 N\n0.341629 0.303291 0.832168 N\n0.931629 0.074377 0.854218 N\n0.377726 0.868794 0.827642 Cl\n0.183612 0.383790 0.190604 Cl\n0.622273 0.131206 0.172357 Cl\n0.816387 0.616210 0.809395 Cl\n",
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"structure_string": "Cr1 Fe1 Bi2 O6\n1.0\n4.740694 -0.013017 2.674547\n1.555588 4.478173 2.674644\n-0.018582 -0.013224 5.443148\nCr Fe Bi O\n1 1 2 6\ndirect\n0.228519 0.228520 0.228519 Cr\n0.726441 0.726440 0.726441 Fe\n0.495614 0.495616 0.495617 Bi\n-0.003742 -0.003739 -0.003741 Bi\n0.409666 0.545431 0.951361 O\n0.951366 0.409664 0.545433 O\n0.904163 0.455941 0.040601 O\n0.040599 0.904164 0.455944 O\n0.545434 0.951363 0.409662 O\n0.455940 0.040598 0.904166 O\n",
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"formula_full": "Cr1 Fe1 Bi2 O6",
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{
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"created_at": "2022-09-04T14:35:49.532125Z",
"updated_at": "2022-09-04T14:35:49.532150Z",
"structure_string": "Pr5 Ru2 O12\n1.0\n6.009271 0.000000 0.000000\n-3.004635 6.149259 -1.930739\n0.000000 -0.002249 7.718655\nPr Ru O\n5 2 12\ndirect\n0.306889 0.613780 0.643176 Pr\n0.693110 0.386220 0.356825 Pr\n0.690592 0.381185 0.832724 Pr\n0.309407 0.618816 0.167277 Pr\n-0.000000 -0.000000 0.500000 Pr\n0.764973 0.000000 0.000000 Ru\n0.235027 0.000000 0.000000 Ru\n0.587229 0.683338 0.922034 O\n0.500124 0.000249 0.169825 O\n0.594840 0.690880 0.422614 O\n0.000899 0.001800 0.184372 O\n0.903959 0.309120 0.577387 O\n0.405159 0.309120 0.577387 O\n0.499875 0.999751 0.830175 O\n0.412771 0.316662 0.077967 O\n0.999100 0.998200 0.815628 O\n0.096040 0.690880 0.422614 O\n0.096108 0.683338 0.922034 O\n0.903891 0.316662 0.077967 O\n",
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}