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{
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{
"id": "jvasp-55522",
"created_at": "2022-09-04T14:37:07.891497Z",
"updated_at": "2022-09-04T14:37:07.891532Z",
"structure_string": "P4 Pb4 S12\n1.0\n0.000000 6.720858 -0.005319\n7.481925 0.000000 0.000000\n0.000000 -6.419616 -9.417320\nP Pb S\n4 4 12\ndirect\n0.875590 0.139178 0.713012 P\n0.875591 0.860822 0.213012 P\n0.132886 0.360813 0.844749 P\n0.132887 0.639188 0.344749 P\n0.788231 0.634975 0.526391 Pb\n0.220258 0.134993 0.531367 Pb\n0.220258 0.865008 0.031367 Pb\n0.788231 0.365026 0.026391 Pb\n0.099385 0.053484 0.221162 S\n0.371226 0.255799 0.040461 S\n0.725046 0.946247 0.317003 S\n0.099384 0.946517 0.721162 S\n0.637256 0.755815 0.017295 S\n0.909093 0.553468 0.836600 S\n0.725045 0.053753 0.817003 S\n0.909093 0.446532 0.336599 S\n0.371226 0.744202 0.540461 S\n0.283428 0.553744 0.240760 S\n0.637256 0.244186 0.517295 S\n0.283428 0.446257 0.740760 S\n",
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{
"id": "jvasp-96851",
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"updated_at": "2022-09-04T14:36:02.193640Z",
"structure_string": "Rb4 P4 Pb4 S16\n1.0\n6.512040 0.000000 0.000000\n0.000000 6.749466 0.000000\n0.000000 0.000000 17.177215\nRb P Pb S\n4 4 4 16\ndirect\n0.006652 0.004970 0.042111 Rb\n0.506652 0.495030 0.957889 Rb\n0.993348 0.504970 0.457889 Rb\n0.493348 0.995031 0.542111 Rb\n0.221038 0.011281 0.347475 P\n0.278962 0.988720 0.847476 P\n0.721038 0.488719 0.652525 P\n0.778962 0.511281 0.152525 P\n0.213678 0.524132 0.728972 Pb\n0.713678 0.975869 0.271028 Pb\n0.786322 0.024132 0.771029 Pb\n0.286322 0.475868 0.228972 Pb\n0.461800 0.492624 0.584854 S\n0.389907 0.758228 0.367277 S\n0.849740 0.533074 0.270313 S\n0.594716 0.749267 0.126118 S\n0.094716 0.750734 0.873882 S\n0.650260 0.466927 0.770313 S\n0.110093 0.241773 0.867277 S\n0.150260 0.033073 0.229687 S\n0.961800 0.007376 0.415146 S\n0.889907 0.741773 0.632723 S\n0.905284 0.250734 0.626119 S\n0.405284 0.249266 0.373882 S\n0.538199 0.992625 0.915146 S\n0.349740 0.966927 0.729687 S\n0.038200 0.507376 0.084854 S\n0.610093 0.258228 0.132723 S\n",
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],
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"formula_full": "Rb4 P4 Pb4 S16",
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"formula_anonymous": "ABCD4",
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},
{
"id": "jvasp-104863",
"created_at": "2022-09-04T14:36:56.900433Z",
"updated_at": "2022-09-04T14:36:56.900467Z",
"structure_string": "P1 Pb3\n1.0\n4.228498 -0.131047 -4.407705\n-0.777516 4.158466 -4.407705\n0.112290 0.131047 6.107001\nP Pb\n1 3\ndirect\n0.000000 0.000000 0.000000 P\n0.750000 0.250000 0.499999 Pb\n0.250000 0.750001 0.499999 Pb\n0.500000 0.500000 -0.000001 Pb\n",
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"spacegroup": 139
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{
"id": "jvasp-30440",
"created_at": "2022-09-04T14:38:05.576755Z",
"updated_at": "2022-09-04T14:38:05.576774Z",
"structure_string": "Pa2 P6\n1.0\n5.600431 -0.000000 0.000000\n-2.800216 4.850116 -0.000000\n0.000000 0.000000 5.469420\nPa P\n2 6\ndirect\n0.333332 0.666666 0.750001 Pa\n0.666667 0.333332 0.250001 Pa\n0.188228 0.376457 0.250001 P\n0.623541 0.811770 0.250001 P\n0.188229 0.811770 0.250001 P\n0.811771 0.623543 0.750001 P\n0.376457 0.188230 0.750001 P\n0.811771 0.188230 0.750001 P\n",
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{
"id": "jvasp-35059",
"created_at": "2022-09-04T14:37:36.671191Z",
"updated_at": "2022-09-04T14:37:36.671226Z",
"structure_string": "Pa2 P4\n1.0\n3.877249 0.000000 0.000000\n0.000000 3.877249 -0.000000\n0.000000 -0.000000 7.906736\nPa P\n2 4\ndirect\n0.500000 0.000000 0.721986 Pa\n0.000000 0.500000 0.278015 Pa\n0.500000 0.000000 0.360858 P\n0.000000 0.500000 0.639142 P\n0.500000 0.500000 0.000000 P\n0.000000 0.000000 0.000000 P\n",
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{
"id": "jvasp-35028",
"created_at": "2022-09-04T14:37:41.825139Z",
"updated_at": "2022-09-04T14:37:41.825157Z",
"structure_string": "Pa2 P4\n1.0\n5.126575 0.000000 0.000000\n0.000000 5.126575 0.000000\n0.000000 0.000000 4.950720\nPa P\n2 4\ndirect\n0.500000 0.500000 0.000000 Pa\n0.000000 0.000000 0.000000 Pa\n0.000000 0.500000 0.271177 P\n0.500000 0.000000 0.728823 P\n0.000000 0.500000 0.728813 P\n0.500000 0.000000 0.271187 P\n",
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"spacegroup": 123
},
{
"id": "jvasp-56961",
"created_at": "2022-09-04T14:37:33.499839Z",
"updated_at": "2022-09-04T14:37:33.499864Z",
"structure_string": "Pa6 P8\n1.0\n6.788897 -0.000000 -2.400238\n-3.394449 5.879358 -2.400238\n-0.000000 -0.000000 7.200714\nPa P\n6 8\ndirect\n0.125000 0.750000 0.874999 Pa\n0.625000 0.375000 0.250000 Pa\n0.375000 0.250000 0.625000 Pa\n0.750000 0.875000 0.125000 Pa\n0.250000 0.625000 0.375000 Pa\n0.875000 0.125000 0.750000 Pa\n0.658038 0.658037 0.658037 P\n0.000000 0.841963 0.500000 P\n0.841963 0.500000 -0.000000 P\n0.000000 0.341963 0.500000 P\n0.500000 0.000000 0.841962 P\n0.500000 0.000000 0.341963 P\n0.341963 0.500000 -0.000000 P\n0.158037 0.158037 0.158037 P\n",
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"density": 9.440562926431046,
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"formula_full": "Pa6 P8",
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{
"id": "jvasp-37708",
"created_at": "2022-09-04T14:38:01.113016Z",
"updated_at": "2022-09-04T14:38:01.113031Z",
"structure_string": "Pm3 Zr1\n1.0\n-2.473174 2.473174 4.907132\n2.473174 -2.473174 4.907132\n2.473174 2.473174 -4.907132\nPm Zr\n3 1\ndirect\n0.750000 0.250000 0.500000 Pm\n0.250000 0.750000 0.500000 Pm\n0.500001 0.500001 0.000000 Pm\n0.000000 0.000000 0.000000 Zr\n",
"nsites": 4,
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},
{
"id": "jvasp-100750",
"created_at": "2022-09-04T14:36:53.894281Z",
"updated_at": "2022-09-04T14:36:53.894302Z",
"structure_string": "Pm1 Zr1\n1.0\n3.378397 -0.000000 0.000000\n-1.689199 2.925778 0.000000\n-0.000000 -0.000000 5.552002\nPm Zr\n1 1\ndirect\n0.333334 0.666667 0.500000 Pm\n0.000000 0.000000 0.000000 Zr\n",
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},
{
"id": "jvasp-110022",
"created_at": "2022-09-04T14:38:17.256387Z",
"updated_at": "2022-09-04T14:38:17.256413Z",
"structure_string": "Pm6 Zr2\n1.0\n7.053160 -0.000000 0.000000\n-3.526579 6.108216 0.000000\n-0.000000 -0.000000 5.663177\nPm Zr\n6 2\ndirect\n0.171344 0.342687 0.250000 Pm\n0.657313 0.828657 0.250000 Pm\n0.171344 0.828657 0.250000 Pm\n0.828657 0.657313 0.750000 Pm\n0.342687 0.171344 0.750000 Pm\n0.828656 0.171344 0.750000 Pm\n0.333333 0.666667 0.750000 Zr\n0.666667 0.333334 0.250000 Zr\n",
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{
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"created_at": "2022-09-04T14:37:40.531494Z",
"updated_at": "2022-09-04T14:37:40.531514Z",
"structure_string": "Pm2 Zn6\n1.0\n3.219207 -5.575830 -0.000000\n3.219207 5.575830 0.000000\n0.000000 -0.000000 4.418223\nPm Zn\n2 6\ndirect\n0.333333 0.666667 0.250000 Pm\n0.666667 0.333333 0.749999 Pm\n0.707579 0.853790 0.749999 Zn\n0.146211 0.292421 0.749999 Zn\n0.146211 0.853790 0.749999 Zn\n0.292421 0.146211 0.250000 Zn\n0.853790 0.707579 0.250000 Zn\n0.853790 0.146211 0.250000 Zn\n",
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{
"id": "jvasp-79118",
"created_at": "2022-09-04T14:36:34.455084Z",
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"structure_string": "Pm3 Zn1\n1.0\n-2.363934 2.363934 4.938470\n2.363934 -2.363934 4.938470\n2.363934 2.363934 -4.938470\nPm Zn\n3 1\ndirect\n0.749999 0.250000 0.499999 Pm\n0.250000 0.749999 0.499999 Pm\n0.500000 0.500000 0.000000 Pm\n0.000000 0.000000 0.000000 Zn\n",
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}