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{
"id": "jvasp-119933",
"created_at": "2022-09-04T14:38:53.225935Z",
"updated_at": "2022-09-04T14:38:53.225969Z",
"structure_string": "Ba1 Ca1 Br1\n1.0\n6.074302 0.000000 0.000000\n-3.037151 5.260500 -0.000000\n-0.000000 0.000000 3.729134\nBa Ca Br\n1 1 1\ndirect\n0.000000 0.000000 0.000000 Ba\n0.666667 0.333333 0.000000 Ca\n0.333333 0.666666 0.000000 Br\n",
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{
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"structure_string": "Rb3 Br1 O1\n1.0\n5.464146 -0.000000 -0.000000\n0.000000 5.464146 0.000000\n0.000000 0.000000 5.464146\nRb Br O\n3 1 1\ndirect\n0.500000 0.000000 0.500000 Rb\n0.500000 0.500000 0.000000 Rb\n0.000000 0.500000 0.500000 Rb\n0.000000 0.000000 0.000000 Br\n0.500000 0.500000 0.500000 O\n",
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{
"id": "jvasp-109001",
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"structure_string": "K2 Nb1 Hg1 F6\n1.0\n5.911305 -0.000000 3.412894\n1.970435 5.573232 3.412894\n-0.000000 -0.000000 6.825787\nK Nb Hg F\n2 1 1 6\ndirect\n0.250000 0.250000 0.250000 K\n0.750001 0.750000 0.749999 K\n0.000000 0.000000 0.000000 Nb\n0.500001 0.500000 0.499999 Hg\n0.207857 0.207856 0.792144 F\n0.207857 0.792143 0.792143 F\n0.792145 0.792143 0.207855 F\n0.207857 0.792143 0.207856 F\n0.792145 0.207856 0.792143 F\n0.792145 0.207856 0.207855 F\n",
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{
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"created_at": "2022-09-04T14:38:45.812920Z",
"updated_at": "2022-09-04T14:38:45.812944Z",
"structure_string": "Zn1 C1 N1\n1.0\n2.826436 1.631844 1.529555\n-2.826436 1.631844 1.529555\n0.000000 -3.263687 1.529555\nZn C N\n1 1 1\ndirect\n-0.001000 -0.001000 -0.001000 Zn\n0.365785 0.365785 0.365785 C\n0.635215 0.635215 0.635215 N\n",
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{
"id": "jvasp-63715",
"created_at": "2022-09-04T14:35:47.963522Z",
"updated_at": "2022-09-04T14:35:47.963550Z",
"structure_string": "Al4 Tl4 Cl16\n1.0\n7.005047 -0.000000 0.000000\n-0.000000 9.269492 0.000000\n0.000000 0.000000 10.643140\nAl Tl Cl\n4 4 16\ndirect\n0.750000 0.688160 0.434425 Al\n0.250000 0.188160 0.065575 Al\n0.250000 0.311840 0.565575 Al\n0.750000 0.811840 0.934424 Al\n0.250000 0.704845 0.189761 Tl\n0.750000 0.204845 0.310239 Tl\n0.750000 0.295155 0.810239 Tl\n0.250000 0.795155 0.689761 Tl\n0.250000 0.059228 0.897470 Cl\n0.750000 0.559227 0.602530 Cl\n0.750000 0.940258 0.765555 Cl\n0.250000 0.440258 0.734445 Cl\n0.250000 0.059742 0.234445 Cl\n0.750000 0.559742 0.265555 Cl\n0.498320 0.326370 0.069038 Cl\n0.501680 0.673630 0.930962 Cl\n0.998321 0.673630 0.930962 Cl\n0.001680 0.173630 0.569038 Cl\n0.250000 0.440772 0.397470 Cl\n0.498320 0.173630 0.569038 Cl\n0.001680 0.326370 0.069038 Cl\n0.998321 0.826370 0.430962 Cl\n0.501680 0.826370 0.430962 Cl\n0.750000 0.940772 0.102530 Cl\n",
"nsites": 24,
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],
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"formula_full": "Al4 Tl4 Cl16",
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{
"id": "jvasp-40673",
"created_at": "2022-09-04T14:38:00.251819Z",
"updated_at": "2022-09-04T14:38:00.251838Z",
"structure_string": "Li8 V4 O8 F4\n1.0\n2.944536 4.148818 -0.000986\n-2.944536 4.148818 0.000986\n-2.941450 0.000000 8.779089\nLi V O F\n8 4 8 4\ndirect\n0.110537 0.639511 0.721115 Li\n0.360489 0.889464 0.221115 Li\n0.054025 0.196202 0.607847 Li\n0.205963 0.044052 0.911919 Li\n0.803799 0.945975 0.107847 Li\n0.955949 0.794038 0.411919 Li\n0.619285 0.130756 0.738457 Li\n0.869245 0.380716 0.238457 Li\n0.458001 0.292001 0.415984 V\n0.302346 0.447670 0.104688 V\n0.707999 0.542000 0.915984 V\n0.552331 0.697654 0.604689 V\n0.381682 0.859746 0.752233 O\n0.764395 0.958821 0.575757 O\n0.311342 0.465389 0.575766 O\n0.140255 0.618319 0.252233 O\n0.870553 0.388036 0.752241 O\n0.041180 0.235606 0.075757 O\n0.534611 0.688659 0.075766 O\n0.611965 0.129448 0.252241 O\n0.715068 0.535530 0.422007 F\n0.464470 0.284932 0.922007 F\n0.957566 0.793045 0.921985 F\n0.206955 0.042434 0.421985 F\n",
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"formula_full": "Li8 V4 O8 F4",
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{
"id": "jvasp-117589",
"created_at": "2022-09-04T14:38:46.265614Z",
"updated_at": "2022-09-04T14:38:46.265639Z",
"structure_string": "Ba1 O1 F1\n1.0\n4.519870 -0.000000 0.000000\n-2.259935 3.914322 -0.000000\n-0.000000 0.000000 4.508632\nBa O F\n1 1 1\ndirect\n0.000000 0.000000 0.000000 Ba\n0.666668 0.333334 0.000000 O\n0.333335 0.666667 0.000000 F\n",
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{
"id": "jvasp-87104",
"created_at": "2022-09-04T14:35:53.217605Z",
"updated_at": "2022-09-04T14:35:53.217633Z",
"structure_string": "Na4 Li4 Te4\n1.0\n4.572198 0.000000 0.000000\n0.000000 7.677893 0.000000\n0.000000 0.000000 8.308570\nNa Li Te\n4 4 4\ndirect\n0.750000 0.484718 0.684298 Na\n0.250000 0.015282 0.184298 Na\n0.750000 0.984717 0.815702 Na\n0.250000 0.515282 0.315702 Na\n0.250000 0.642526 0.928876 Li\n0.250000 0.142527 0.571124 Li\n0.750000 0.357473 0.071124 Li\n0.750000 0.857473 0.428876 Li\n0.250000 0.774558 0.608270 Te\n0.250000 0.274558 0.891730 Te\n0.750000 0.725442 0.108270 Te\n0.750000 0.225442 0.391730 Te\n",
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{
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"updated_at": "2022-09-04T14:37:06.591182Z",
"structure_string": "Sb2 S4\n1.0\n4.906272 -0.000000 -2.231425\n-1.014875 4.800158 -2.231425\n0.238424 0.294102 7.033689\nSb S\n2 4\ndirect\n0.250000 0.750000 0.500000 Sb\n0.000000 0.000000 0.000000 Sb\n0.837663 0.875000 0.250000 S\n0.624999 0.162337 0.750000 S\n0.412337 0.375000 0.250000 S\n0.125000 0.587663 0.750000 S\n",
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{
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"created_at": "2022-09-04T14:38:08.716787Z",
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"structure_string": "Au4 S4 Cl20\n1.0\n0.000000 8.023561 -0.072071\n8.070099 0.000000 0.000000\n0.000000 -5.711018 -11.565242\nAu S Cl\n4 4 20\ndirect\n0.910597 0.677447 0.341492 Au\n0.089402 0.177447 0.158508 Au\n0.089402 0.322553 0.658508 Au\n0.910597 0.822553 0.841491 Au\n0.762686 0.773645 0.963066 S\n0.762686 0.726355 0.463066 S\n0.237314 0.226355 0.036934 S\n0.237313 0.273645 0.536933 S\n0.076947 0.629241 0.235109 Cl\n0.643429 0.784737 0.675549 Cl\n0.356570 0.284737 0.824451 Cl\n0.248325 0.022022 0.544566 Cl\n0.643429 0.715263 0.175549 Cl\n0.751674 0.522022 0.955433 Cl\n0.923052 0.129241 0.264890 Cl\n0.356570 0.215263 0.324451 Cl\n0.923052 0.370759 0.764890 Cl\n0.820455 0.349871 0.485873 Cl\n0.179544 0.650129 0.514127 Cl\n0.820455 0.150129 0.985873 Cl\n0.248325 0.477978 0.044566 Cl\n0.179544 0.849871 0.014127 Cl\n0.508374 0.167132 0.123666 Cl\n0.508374 0.332868 0.623666 Cl\n0.491625 0.832868 0.876334 Cl\n0.491626 0.667132 0.376334 Cl\n0.076947 0.870759 0.735109 Cl\n0.751675 0.977978 0.455433 Cl\n",
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{
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{
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}
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}