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{
"id": "jvasp-32943",
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"structure_string": "As1 N1 O2 F6\n1.0\n5.184418 0.456674 -0.060770\n-0.224646 5.199640 -0.060770\n0.174648 0.199176 4.732649\nAs N O F\n1 1 2 6\ndirect\n0.000000 0.000000 0.000000 As\n0.500000 0.500000 0.500000 N\n0.586714 0.586714 0.690715 O\n0.413286 0.413286 0.309285 O\n0.199463 0.199464 0.787826 F\n0.084202 0.735404 0.783187 F\n0.735404 0.084202 0.783187 F\n0.264596 0.915798 0.216813 F\n0.915798 0.264596 0.216813 F\n0.800537 0.800536 0.212174 F\n",
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{
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{
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"structure_string": "Na2 Li2 Y4 F16\n1.0\n0.000000 6.708444 0.013017\n7.051249 0.000000 0.000000\n0.000000 -1.546138 -6.527668\nNa Li Y F\n2 2 4 16\ndirect\n0.338569 0.250000 0.338593 Na\n0.661430 0.750000 0.661407 Na\n0.000000 0.000000 0.000000 Li\n0.000000 0.500000 0.000000 Li\n0.450163 0.750000 0.077402 Y\n0.077403 0.750000 0.450157 Y\n0.549836 0.250000 0.922597 Y\n0.922596 0.250000 0.549843 Y\n0.607038 0.250000 0.607035 F\n0.062334 0.448764 0.336530 F\n0.085421 0.750000 0.085421 F\n0.937665 0.948764 0.663469 F\n0.392961 0.750000 0.392965 F\n0.914578 0.250000 0.914579 F\n0.745837 0.750000 0.310784 F\n0.336548 0.448761 0.062360 F\n0.937665 0.551237 0.663469 F\n0.689228 0.250000 0.254163 F\n0.663451 0.948761 0.937640 F\n0.663451 0.551239 0.937640 F\n0.254163 0.250000 0.689216 F\n0.310771 0.750000 0.745837 F\n0.336548 0.051239 0.062360 F\n0.062334 0.051237 0.336530 F\n",
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{
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"created_at": "2022-09-04T14:37:15.507391Z",
"updated_at": "2022-09-04T14:37:15.507416Z",
"structure_string": "Ca2 Ti2 Si2 O10\n1.0\n5.324764 0.003569 -1.330239\n-1.900160 4.974185 -1.330239\n-0.000728 -0.001058 7.082264\nCa Ti Si O\n2 2 2 10\ndirect\n0.170308 0.829690 0.749999 Ca\n0.829690 0.170309 0.249999 Ca\n0.499999 0.499999 0.499999 Ti\n0.500000 0.500000 -0.000000 Ti\n0.181120 0.818879 0.249999 Si\n0.818879 0.181120 0.749999 Si\n0.184971 0.609541 0.382913 O\n0.390458 0.815028 0.117086 O\n0.815027 0.390458 0.617086 O\n0.609541 0.184971 0.882913 O\n0.879585 0.750559 0.087968 O\n0.249440 0.120414 0.412030 O\n0.429227 0.570772 0.749999 O\n0.570772 0.429227 0.249999 O\n0.750559 0.879585 0.587968 O\n0.120414 0.249440 0.912030 O\n",
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{
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"created_at": "2022-09-04T14:37:15.451213Z",
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"structure_string": "Rb2 Dy1 Ag1 Cl6\n1.0\n6.493011 -0.000000 3.748742\n2.164337 6.121669 3.748742\n-0.000000 -0.000000 7.497483\nRb Dy Ag Cl\n2 1 1 6\ndirect\n0.750000 0.750000 0.749999 Rb\n0.250000 0.250000 0.250000 Rb\n0.000000 0.000000 0.000000 Dy\n0.500000 0.500000 0.499999 Ag\n0.753493 0.246507 0.246507 Cl\n0.246507 0.246507 0.753492 Cl\n0.246507 0.753493 0.753492 Cl\n0.246507 0.753493 0.246507 Cl\n0.753493 0.246507 0.753492 Cl\n0.753493 0.753493 0.246506 Cl\n",
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{
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"created_at": "2022-09-04T14:37:08.026935Z",
"updated_at": "2022-09-04T14:37:08.026962Z",
"structure_string": "Li2 Cu2 B2 O6\n1.0\n5.227227 -0.026754 -0.040890\n-2.589220 4.543112 0.027811\n-2.359231 -1.388093 4.772776\nLi Cu B O\n2 2 2 6\ndirect\n0.469038 0.394955 0.708686 Li\n0.530964 0.605046 0.291315 Li\n0.153884 0.774754 0.742994 Cu\n0.846118 0.225247 0.257007 Cu\n0.826121 0.083845 0.749012 B\n0.173881 0.916156 0.250989 B\n0.047991 0.315840 0.679457 O\n0.642670 0.140546 0.841094 O\n0.764727 0.795410 0.709265 O\n0.235275 0.204591 0.290736 O\n0.357332 0.859455 0.158907 O\n0.952011 0.684162 0.320544 O\n",
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{
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"created_at": "2022-09-04T14:37:08.033075Z",
"updated_at": "2022-09-04T14:37:08.033109Z",
"structure_string": "Ca2 Cr2 Si4 O12\n1.0\n5.157354 -0.005868 1.056897\n1.237638 6.640718 0.594138\n-0.037810 -0.011614 6.781027\nCa Cr Si O\n2 2 4 12\ndirect\n0.750000 0.300762 0.699239 Ca\n0.250001 0.699238 0.300764 Ca\n0.249999 0.095273 0.904729 Cr\n0.749999 0.904730 0.095272 Cr\n0.274101 0.193518 0.379647 Si\n0.225898 0.620354 0.806483 Si\n0.774101 0.379647 0.193518 Si\n0.725899 0.806483 0.620354 Si\n0.639996 0.975460 0.789334 O\n0.860004 0.210665 0.024541 O\n0.672308 0.606531 0.116576 O\n0.827690 0.883426 0.393469 O\n0.327690 0.393468 0.883426 O\n0.982687 0.628063 0.675175 O\n0.017312 0.371937 0.324826 O\n0.482688 0.675175 0.628065 O\n0.360003 0.024541 0.210667 O\n0.517312 0.324827 0.371936 O\n0.172309 0.116574 0.606532 O\n0.139997 0.789335 0.975460 O\n",
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{
"id": "jvasp-49638",
"created_at": "2022-09-04T14:37:07.367988Z",
"updated_at": "2022-09-04T14:37:07.368010Z",
"structure_string": "Mg4 Ni2 Sb2 O12\n1.0\n0.000000 5.077379 -0.135115\n7.601372 0.000000 0.000000\n0.000000 -0.182967 -5.305131\nMg Ni Sb O\n4 2 2 12\ndirect\n0.477772 0.750000 0.420642 Mg\n0.522228 0.250000 0.579359 Mg\n0.016458 0.750000 0.951730 Mg\n-0.016458 0.250000 0.048270 Mg\n0.500000 0.500000 0.000000 Ni\n0.500000 0.000000 0.000000 Ni\n-0.000000 0.500000 0.500000 Sb\n-0.000000 0.000000 0.500000 Sb\n0.317491 0.573441 0.690524 O\n0.634254 0.750000 0.066702 O\n0.682508 0.073441 0.309476 O\n0.141925 0.250000 0.430798 O\n0.188348 0.926177 0.191210 O\n0.811651 0.073823 0.808791 O\n0.188348 0.573823 0.191210 O\n0.317491 0.926559 0.690524 O\n0.858075 0.750000 0.569203 O\n0.682508 0.426559 0.309476 O\n0.811651 0.426177 0.808791 O\n0.365746 0.250000 0.933299 O\n",
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{
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"created_at": "2022-09-04T14:37:28.482411Z",
"updated_at": "2022-09-04T14:37:28.482433Z",
"structure_string": "Li2 Nb1 Cr3 O8\n1.0\n5.956602 0.005907 0.004177\n2.983416 5.155616 0.004177\n2.983416 1.722476 4.859369\nLi Nb Cr O\n2 1 3 8\ndirect\n0.126765 0.126766 0.126766 Li\n0.873234 0.873236 0.873236 Li\n0.500000 0.500001 0.500001 Nb\n0.000000 0.500001 0.500000 Cr\n0.500000 0.000001 0.500000 Cr\n0.500000 0.500000 0.000001 Cr\n0.264928 0.264928 0.264928 O\n0.259251 0.259251 0.719503 O\n0.259250 0.719503 0.259251 O\n0.719502 0.259251 0.259251 O\n0.280497 0.740750 0.740750 O\n0.740749 0.280498 0.740750 O\n0.740749 0.740750 0.280499 O\n0.735071 0.735073 0.735073 O\n",
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{
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"structure_string": "Sr4 Fe2 S2 O6\n1.0\n3.971774 0.000000 0.000000\n0.000000 3.971774 0.000000\n0.000000 -0.000000 13.475236\nSr Fe S O\n4 2 2 6\ndirect\n0.000000 0.500000 0.860608 Sr\n0.500000 0.000000 0.139393 Sr\n0.000000 0.500000 0.600394 Sr\n0.500000 0.000000 0.399606 Sr\n0.500000 0.000000 0.724800 Fe\n0.000000 0.500000 0.275200 Fe\n0.500000 0.000000 0.905177 S\n0.000000 0.500000 0.094823 S\n0.500000 0.500000 0.727263 O\n0.000000 0.000000 0.727263 O\n0.000000 0.000000 0.272737 O\n0.500000 0.500000 0.272737 O\n0.500000 0.000000 0.583545 O\n0.000000 0.500000 0.416455 O\n",
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{
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"created_at": "2022-09-04T14:37:08.657856Z",
"updated_at": "2022-09-04T14:37:08.657875Z",
"structure_string": "Na1 Zr2 Mn1 F11\n1.0\n5.384131 0.011233 2.043074\n1.021118 5.286427 2.043074\n-0.002537 -0.002099 7.875680\nNa Zr Mn F\n1 2 1 11\ndirect\n0.000000 0.000000 0.000000 Na\n0.502607 0.502607 0.766985 Zr\n0.497393 0.497393 0.233014 Zr\n-0.000000 -0.000000 0.500000 Mn\n0.806431 0.222149 0.692669 F\n0.777851 0.193569 0.307330 F\n0.193569 0.777851 0.307330 F\n0.222149 0.806431 0.692669 F\n0.500000 0.500000 0.499999 F\n0.329784 0.670216 -0.000001 F\n0.670216 0.329784 -0.000001 F\n0.252687 0.252687 0.347720 F\n0.747313 0.747313 0.652279 F\n0.265117 0.265117 0.892815 F\n0.734883 0.734883 0.107184 F\n",
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{
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"created_at": "2022-09-04T14:37:28.960522Z",
"updated_at": "2022-09-04T14:37:28.960547Z",
"structure_string": "Rb4 Li4 Si2 O8\n1.0\n5.487821 -0.008386 0.024820\n0.416728 5.638290 0.008015\n2.259027 0.799898 8.348583\nRb Li Si O\n4 4 2 8\ndirect\n0.471503 0.847312 0.734767 Rb\n0.528498 0.152688 0.265232 Rb\n0.789136 0.724576 0.020865 Rb\n0.210865 0.275423 0.979134 Rb\n0.929790 0.184335 0.437997 Li\n0.070211 0.815664 0.562002 Li\n0.696042 0.592548 0.420126 Li\n0.303959 0.407451 0.579873 Li\n0.853517 0.313948 0.721273 Si\n0.146484 0.686051 0.278726 Si\n0.001018 0.561584 0.719236 O\n-0.001016 0.438417 0.280763 O\n0.917672 0.866057 0.381937 O\n0.082329 0.133943 0.618062 O\n0.268886 0.794309 0.094015 O\n0.731115 0.205691 0.905984 O\n0.362416 0.641657 0.385668 O\n0.637585 0.358342 0.614331 O\n",
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],
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]
}