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{
"id": "jvasp-57362",
"created_at": "2022-09-04T14:37:44.293704Z",
"updated_at": "2022-09-04T14:37:44.293728Z",
"structure_string": "Li2 Ga2 Mo4 O16\n1.0\n6.765386 -0.037497 0.035397\n-1.851125 6.912893 0.005432\n-2.572342 -0.813642 6.763288\nLi Ga Mo O\n2 2 4 16\ndirect\n0.227977 0.552478 0.748058 Li\n0.772025 0.447522 0.251943 Li\n0.401528 0.099438 0.318931 Ga\n0.598474 0.900561 0.681069 Ga\n0.822239 0.963956 0.220413 Mo\n0.177763 0.036043 0.779587 Mo\n0.668798 0.425140 0.711419 Mo\n0.331204 0.574859 0.288581 Mo\n0.314645 0.869079 0.728730 O\n0.908946 0.519146 0.667928 O\n0.091055 0.480854 0.332072 O\n0.885956 0.950489 0.645900 O\n0.519155 0.617204 0.651401 O\n0.114047 0.049511 0.354101 O\n0.480847 0.382796 0.348599 O\n0.685356 0.130921 0.271270 O\n0.284380 0.276083 0.738946 O\n0.582579 0.159164 0.613919 O\n0.417423 0.840836 0.386081 O\n0.251849 0.572150 0.036915 O\n0.765448 0.957231 0.963152 O\n0.234553 0.042769 0.036848 O\n0.715621 0.723915 0.261055 O\n0.748153 0.427850 0.963085 O\n",
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{
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{
"id": "jvasp-57865",
"created_at": "2022-09-04T14:38:35.974455Z",
"updated_at": "2022-09-04T14:38:35.974482Z",
"structure_string": "Sr3 Ru2 O7\n1.0\n3.828211 -0.000000 -0.706436\n-0.130362 3.825991 -0.706436\n0.013798 0.014276 10.800619\nSr Ru O\n3 2 7\ndirect\n0.500000 0.500000 -0.000000 Sr\n0.686061 0.686061 0.372121 Sr\n0.313940 0.313940 0.627879 Sr\n0.098618 0.098618 0.197234 Ru\n0.901383 0.901383 0.802765 Ru\n0.402383 0.902383 0.804764 O\n0.902383 0.402383 0.804764 O\n0.597617 0.097618 0.195235 O\n0.097618 0.597617 0.195235 O\n0.803212 0.803212 0.606423 O\n0.000000 0.000000 0.000000 O\n0.196789 0.196789 0.393577 O\n",
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"elements": [
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"formula_full": "Sr3 Ru2 O7",
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{
"id": "jvasp-71329",
"created_at": "2022-09-04T14:35:53.997924Z",
"updated_at": "2022-09-04T14:35:53.997948Z",
"structure_string": "Be2 Nb1 Tc1\n1.0\n3.167209 0.000000 0.000000\n0.000000 3.167209 0.000000\n-0.000000 0.000000 5.259129\nBe Nb Tc\n2 1 1\ndirect\n0.000000 0.000000 0.997755 Be\n0.500000 0.500000 0.234261 Be\n0.000000 0.000000 0.502420 Nb\n0.500000 0.500000 0.765565 Tc\n",
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{
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"created_at": "2022-09-04T14:38:32.218021Z",
"updated_at": "2022-09-04T14:38:32.218056Z",
"structure_string": "Ti12 Al8 Ni4 N4\n1.0\n6.974068 -0.000000 4.026480\n2.324689 6.575215 4.026480\n0.000000 0.000000 8.052959\nTi Al Ni N\n12 8 4 4\ndirect\n0.809096 0.440904 0.440905 Ti\n0.559096 0.559095 0.190905 Ti\n0.190905 0.190905 0.559095 Ti\n0.559096 0.190905 0.190905 Ti\n0.559096 0.190905 0.559095 Ti\n0.190905 0.559095 0.190905 Ti\n0.440905 0.809095 0.440905 Ti\n0.440905 0.440904 0.809095 Ti\n0.809096 0.809095 0.440905 Ti\n0.809096 0.440904 0.809095 Ti\n0.190905 0.559095 0.559096 Ti\n0.440905 0.809095 0.809096 Ti\n0.791946 0.791945 0.791946 Al\n0.208054 0.208054 0.875839 Al\n0.208054 0.875838 0.208054 Al\n0.875839 0.208054 0.208054 Al\n0.791946 0.791945 0.124161 Al\n0.124162 0.791945 0.791946 Al\n0.208054 0.208054 0.208054 Al\n0.791946 0.124161 0.791946 Al\n0.500000 0.000000 -0.000000 Ni\n0.000000 0.000000 0.000000 Ni\n0.000000 0.000000 0.500000 Ni\n0.000000 0.500000 0.000000 Ni\n0.500000 0.500000 0.500000 N\n0.500000 0.500000 0.000000 N\n0.000000 0.500000 0.500000 N\n0.500000 0.000000 0.500000 N\n",
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{
"id": "jvasp-74435",
"created_at": "2022-09-04T14:36:20.942704Z",
"updated_at": "2022-09-04T14:36:20.942731Z",
"structure_string": "Hf1 Be2 Pd1\n1.0\n2.889836 0.000000 0.000000\n0.000000 2.889836 0.000000\n0.000000 0.000000 6.316919\nHf Be Pd\n1 2 1\ndirect\n0.000000 0.000000 0.479967 Hf\n0.000000 0.000000 0.019567 Be\n0.500001 0.500001 0.192676 Be\n0.500001 0.500001 0.807790 Pd\n",
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},
{
"id": "jvasp-36821",
"created_at": "2022-09-04T14:37:59.627233Z",
"updated_at": "2022-09-04T14:37:59.627267Z",
"structure_string": "Na2 Cu2 O4\n1.0\n1.151437 3.388420 -0.000000\n-0.000000 -0.000000 5.409967\n5.735281 -0.059089 0.000000\nNa Cu O\n2 2 4\ndirect\n0.288254 0.250000 0.423492 Na\n0.711746 0.750000 0.576509 Na\n0.003547 0.250000 0.992905 Cu\n0.996453 0.750000 0.007095 Cu\n0.885423 0.493354 0.229156 O\n0.114577 0.506647 0.770844 O\n0.885423 0.006647 0.229156 O\n0.114577 0.993354 0.770844 O\n",
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},
{
"id": "jvasp-75014",
"created_at": "2022-09-04T14:36:11.160134Z",
"updated_at": "2022-09-04T14:36:11.160162Z",
"structure_string": "Be1 Zn1 Pd1\n1.0\n1.397331 -2.420248 0.000000\n1.397331 2.420248 -0.000000\n0.000000 -0.000000 5.849222\nBe Zn Pd\n1 1 1\ndirect\n0.000000 0.000000 0.984811 Be\n0.666667 0.333333 0.319056 Zn\n0.333333 0.666667 0.696132 Pd\n",
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{
"id": "jvasp-29506",
"created_at": "2022-09-04T14:36:30.744816Z",
"updated_at": "2022-09-04T14:36:30.744840Z",
"structure_string": "V2 Mo1 O8\n1.0\n3.644564 -0.015729 -0.695867\n-0.017248 4.059216 0.003174\n-0.015690 0.008148 9.808627\nV Mo O\n2 1 8\ndirect\n0.205005 0.038683 0.375682 V\n0.829291 0.038683 0.624315 V\n0.943967 0.017482 -0.000001 Mo\n0.959905 0.439886 0.000002 O\n0.306755 0.959815 0.582298 O\n0.105019 0.943912 0.194239 O\n0.832599 0.438094 0.626285 O\n0.724471 0.959812 0.417700 O\n0.206348 0.438094 0.373717 O\n0.910785 0.943918 0.805759 O\n0.475847 0.928628 -0.000000 O\n",
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"formula_full": "V2 Mo1 O8",
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"spacegroup": 8
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{
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"created_at": "2022-09-04T14:36:15.608794Z",
"updated_at": "2022-09-04T14:36:15.608815Z",
"structure_string": "Cu4 N12\n1.0\n5.332220 0.000000 2.437523\n2.666114 5.998961 1.218753\n0.172036 0.000010 6.674688\nCu N\n4 12\ndirect\n0.500000 0.500000 0.500000 Cu\n0.000000 0.000000 0.500000 Cu\n0.500000 0.500000 -0.000000 Cu\n0.500000 -0.000000 -0.000000 Cu\n0.811012 0.451127 0.548896 N\n0.359908 0.951103 0.451126 N\n0.762138 0.548896 0.048873 N\n0.811036 0.048873 0.951103 N\n0.000000 0.000000 0.000000 N\n-0.000000 0.500000 -0.000000 N\n0.500000 0.000000 0.500000 N\n0.000000 0.500000 0.500000 N\n0.188965 0.951127 0.048896 N\n0.237862 0.451104 0.951127 N\n0.640092 0.048896 0.548873 N\n0.188988 0.548873 0.451103 N\n",
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{
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"created_at": "2022-09-04T14:35:43.275248Z",
"updated_at": "2022-09-04T14:35:43.275274Z",
"structure_string": "Au1 O2 F6\n1.0\n5.061819 -0.217211 0.119832\n0.203072 5.162006 -0.158917\n1.280934 0.785156 4.538254\nAu O F\n1 2 6\ndirect\n0.000000 0.000000 0.000000 Au\n0.441359 0.524566 0.617318 O\n0.558641 0.475436 0.382680 O\n0.314822 0.193452 0.033880 F\n0.685177 0.806550 0.966118 F\n0.102335 0.674824 0.189424 F\n0.897665 0.325178 0.810574 F\n0.225421 0.931205 0.620311 F\n0.774578 0.068797 0.379687 F\n",
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{
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"structure_string": "Ag4 Te4 N4 O20\n1.0\n5.373362 -0.000000 0.000000\n0.000000 5.569491 0.000000\n0.000000 0.000000 14.100129\nAg Te N O\n4 4 4 20\ndirect\n0.250000 0.500000 0.613787 Ag\n0.750000 0.500000 0.386213 Ag\n0.250000 0.000000 0.113787 Ag\n0.750000 0.000000 0.886213 Ag\n0.750000 0.000000 0.564055 Te\n0.250000 0.000000 0.435945 Te\n0.250000 0.500000 0.935945 Te\n0.750000 0.500000 0.064055 Te\n0.250000 0.500000 0.255472 N\n0.250000 0.000000 0.755472 N\n0.750000 0.500000 0.744528 N\n0.750000 0.000000 0.244528 N\n0.609168 0.355735 0.788473 O\n0.437225 0.207390 0.523015 O\n0.437225 0.292610 0.023015 O\n0.062774 0.792610 0.523015 O\n0.250000 0.000000 0.846330 O\n0.890831 0.644264 0.788473 O\n0.750000 0.000000 0.153670 O\n0.062774 0.707389 0.023015 O\n0.250000 0.500000 0.346330 O\n0.390831 0.644264 0.211527 O\n0.609168 0.144264 0.288473 O\n0.390831 0.855735 0.711527 O\n0.109169 0.355735 0.211527 O\n0.562774 0.707389 0.976985 O\n0.562774 0.792610 0.476985 O\n0.890831 0.855735 0.288473 O\n0.109169 0.144264 0.711527 O\n0.937225 0.292610 0.976985 O\n0.750000 0.500000 0.653670 O\n0.937225 0.207390 0.476985 O\n",
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}
]
}