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{
"id": "jvasp-16077",
"created_at": "2022-09-04T14:36:51.335736Z",
"updated_at": "2022-09-04T14:36:51.335758Z",
"structure_string": "Te4 Pt3\n1.0\n3.979124 0.001568 0.668810\n1.931860 3.478700 0.668810\n-0.041451 -0.024405 12.425441\nTe Pt\n4 3\ndirect\n0.945805 0.945807 0.162484 Te\n0.054193 0.054195 0.837516 Te\n0.794990 0.794993 0.614933 Te\n0.205008 0.205009 0.385067 Te\n0.646503 0.646505 0.060448 Pt\n0.499999 0.500001 0.500000 Pt\n0.353495 0.353497 0.939552 Pt\n",
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{
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"structure_string": "Te4 Pd6 Pb4\n1.0\n6.038574 -0.000000 0.000000\n-0.000000 6.530267 0.000000\n0.000000 0.000000 8.705158\nTe Pd Pb\n4 6 4\ndirect\n0.250000 0.672431 0.540631 Te\n0.750000 0.327570 0.040631 Te\n0.250000 0.672431 0.959369 Te\n0.750000 0.327570 0.459369 Te\n0.000000 0.000000 0.500000 Pd\n0.750000 0.203547 0.750000 Pd\n0.000000 0.000000 0.000000 Pd\n0.500000 0.000000 0.500000 Pd\n0.500000 0.000000 0.000000 Pd\n0.250000 0.796453 0.250000 Pd\n0.250000 0.250651 0.250000 Pb\n0.750000 0.749350 0.750000 Pb\n0.250000 0.201130 0.750000 Pb\n0.750000 0.798870 0.250000 Pb\n",
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{
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"created_at": "2022-09-04T14:38:35.344533Z",
"updated_at": "2022-09-04T14:38:35.344556Z",
"structure_string": "Te4 Pd6\n1.0\n3.941404 0.000000 0.000000\n-1.970703 6.417736 -0.000000\n0.000000 -0.000000 8.021106\nTe Pd\n4 6\ndirect\n0.000000 0.000000 0.000000 Te\n0.000000 0.000000 0.500000 Te\n0.257932 0.515864 0.750000 Te\n0.742067 0.484137 0.250000 Te\n0.466435 0.932870 0.750000 Pd\n0.533565 0.067130 0.250000 Pd\n0.338076 0.676152 0.067716 Pd\n0.661924 0.323849 0.932285 Pd\n0.661924 0.323849 0.567716 Pd\n0.338076 0.676152 0.432285 Pd\n",
"nsites": 10,
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"density": 9.403116793369973,
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"volume": 202.89299668629639,
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"spacegroup": 63
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{
"id": "jvasp-34436",
"created_at": "2022-09-04T14:38:12.308226Z",
"updated_at": "2022-09-04T14:38:12.308237Z",
"structure_string": "Te4 Pb4 O12\n1.0\n5.366830 0.000000 0.000000\n-0.000000 5.366830 -0.000000\n-0.000000 0.000000 12.018337\nTe Pb O\n4 4 12\ndirect\n0.252863 0.256932 0.487694 Te\n0.256932 0.747137 0.237694 Te\n0.747137 0.743068 0.987695 Te\n0.743068 0.252863 0.737695 Te\n0.751294 0.243570 0.252223 Pb\n0.243570 0.248706 0.002223 Pb\n0.248706 0.756430 0.752223 Pb\n0.756430 0.751294 0.502223 Pb\n0.605978 0.978746 0.088385 O\n0.978746 0.394022 0.838385 O\n0.877822 0.521757 0.096349 O\n0.122178 0.478243 0.596349 O\n0.021253 0.605978 0.338385 O\n0.521757 0.122178 0.846350 O\n0.119713 0.066478 0.200548 O\n0.478243 0.877822 0.346349 O\n0.880287 0.933522 0.700548 O\n0.394022 0.021253 0.588385 O\n0.066478 0.880287 0.950548 O\n0.933522 0.119713 0.450548 O\n",
"nsites": 20,
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{
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"created_at": "2022-09-04T14:35:43.533468Z",
"updated_at": "2022-09-04T14:35:43.533503Z",
"structure_string": "Te4 Pb4\n1.0\n0.000000 4.626790 0.000000\n0.000000 -0.000000 4.627536\n13.089301 0.000000 0.000000\nTe Pb\n4 4\ndirect\n0.250000 0.249808 0.875038 Te\n0.250000 0.250193 0.375038 Te\n0.750000 0.750193 0.124962 Te\n0.750000 0.749808 0.624962 Te\n0.250000 0.249672 0.625071 Pb\n0.250000 0.250328 0.125071 Pb\n0.750000 0.750329 0.374929 Pb\n0.750000 0.749673 0.874929 Pb\n",
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{
"id": "jvasp-52645",
"created_at": "2022-09-04T14:37:28.995621Z",
"updated_at": "2022-09-04T14:37:28.995646Z",
"structure_string": "Te4 Pb4\n1.0\n0.000000 4.536706 0.000145\n7.858290 0.000000 0.000000\n0.000000 0.000229 -7.970503\nTe Pb\n4 4\ndirect\n0.749989 0.666667 0.749854 Te\n0.749989 0.333333 0.249854 Te\n0.250012 0.166692 0.749461 Te\n0.250012 0.833308 0.249461 Te\n0.749993 0.000120 0.000223 Pb\n0.749993 -0.000120 0.500222 Pb\n0.249990 0.500162 0.500436 Pb\n0.249990 0.499838 0.000436 Pb\n",
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{
"id": "jvasp-98307",
"created_at": "2022-09-04T14:36:16.729850Z",
"updated_at": "2022-09-04T14:36:16.729872Z",
"structure_string": "Te4 P4 Cl36\n1.0\n10.528089 -0.072478 -5.688156\n-6.881076 9.784162 -0.349264\n-0.136025 0.072478 11.965670\nTe P Cl\n4 4 36\ndirect\n0.095415 0.248545 0.346870 Te\n0.543782 0.827443 0.216339 Te\n0.901675 0.748545 0.653130 Te\n0.611104 0.327443 0.783661 Te\n0.507146 0.794510 0.732167 P\n0.062343 0.294510 0.787364 P\n0.062343 0.774979 0.267833 P\n0.507146 0.274979 0.212636 P\n0.093799 0.949767 0.644032 Cl\n0.514853 0.259699 0.378530 Cl\n0.687077 0.955057 0.897694 Cl\n0.271166 0.644535 0.126632 Cl\n0.911539 0.901618 0.815132 Cl\n0.057364 0.455057 0.767980 Cl\n0.911539 0.596407 0.509920 Cl\n0.687077 0.289383 0.232020 Cl\n0.301737 0.225207 0.576530 Cl\n0.513629 0.438829 0.182248 Cl\n0.058668 0.612390 0.301512 Cl\n0.881170 0.136323 0.621470 Cl\n0.256581 0.938829 0.425200 Cl\n0.529350 0.976176 0.357038 Cl\n0.895032 0.248892 0.146140 Cl\n0.086486 0.401618 0.490080 Cl\n0.305735 0.449767 0.355968 Cl\n0.529350 0.672312 0.053174 Cl\n0.858312 0.016641 0.341671 Cl\n0.619139 0.172313 0.642962 Cl\n0.489848 0.939358 0.050490 Cl\n0.102752 0.748892 0.853860 Cl\n0.310879 0.112390 0.053722 Cl\n0.619139 0.476176 0.946826 Cl\n0.513629 0.831380 0.574800 Cl\n0.881170 0.759699 0.244847 Cl\n0.517904 0.144535 0.873369 Cl\n0.674970 0.516641 0.658329 Cl\n0.514853 0.636323 0.755153 Cl\n0.310879 0.757156 0.698489 Cl\n0.256581 0.331381 0.817752 Cl\n0.648677 0.725207 0.423470 Cl\n0.888868 0.439358 0.949509 Cl\n0.086486 0.096407 0.184868 Cl\n0.058669 0.257157 0.946278 Cl\n0.057363 0.789383 0.102307 Cl\n",
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{
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"created_at": "2022-09-04T14:38:20.285025Z",
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"structure_string": "Te4 O8\n1.0\n4.870765 0.000000 0.000000\n0.000000 4.863647 0.000000\n0.000000 0.000000 7.562176\nTe O\n4 8\ndirect\n0.729606 0.520350 0.374936 Te\n0.270393 0.020349 0.125064 Te\n0.229606 0.979651 0.625064 Te\n0.770393 0.479651 0.874936 Te\n0.500443 0.140955 0.933644 O\n0.000443 0.359046 0.066357 O\n0.390038 0.251687 0.316213 O\n0.499556 0.640955 0.566357 O\n0.999556 0.859046 0.433644 O\n0.109962 0.748313 0.816213 O\n0.609961 0.751687 0.183787 O\n0.890037 0.248313 0.683787 O\n",
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{
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"structure_string": "Te4 O8\n1.0\n4.867447 -0.000000 -0.000000\n-0.000000 4.867447 0.000000\n-0.000000 0.000000 7.562617\nTe O\n4 8\ndirect\n0.979584 0.979584 0.500000 Te\n0.520417 0.479584 0.750000 Te\n0.479584 0.520417 0.250000 Te\n0.020417 0.020417 0.000000 Te\n0.748892 0.859485 0.308729 O\n0.251109 0.140516 0.808729 O\n0.859485 0.748892 0.691272 O\n0.359484 0.751109 0.058729 O\n0.140516 0.251109 0.191271 O\n0.248892 0.640516 0.441272 O\n0.751109 0.359484 0.941272 O\n0.640516 0.248892 0.558729 O\n",
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{
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"structure_string": "Te4 O8\n1.0\n4.867168 0.000000 0.000000\n0.000000 4.867168 -0.000000\n0.000000 0.000000 7.561901\nTe O\n4 8\ndirect\n0.020386 0.020386 0.000000 Te\n0.479614 0.520386 0.750000 Te\n0.520386 0.479614 0.250000 Te\n0.979614 0.979614 0.500000 Te\n0.251096 0.140474 0.191296 O\n0.359526 0.751097 0.941296 O\n0.640474 0.248904 0.441296 O\n0.751097 0.359526 0.058704 O\n0.248904 0.640474 0.558704 O\n0.748904 0.859526 0.691296 O\n0.140474 0.251096 0.808704 O\n0.859526 0.748904 0.308704 O\n",
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{
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{
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"structure_string": "Te4 O8\n1.0\n3.897427 0.000000 0.000000\n0.000000 5.472855 0.000000\n0.000000 -0.000000 8.001768\nTe O\n4 8\ndirect\n0.250000 0.255334 0.429614 Te\n0.250000 0.755333 0.070386 Te\n0.750001 0.744665 0.570386 Te\n0.750001 0.244666 0.929614 Te\n0.250000 0.121332 -0.001992 O\n0.250000 0.621331 0.501992 O\n0.750001 0.878668 0.001992 O\n0.750001 0.378668 0.498008 O\n0.250000 0.076542 0.630782 O\n0.250000 0.576542 0.869218 O\n0.750001 0.923457 0.369218 O\n0.750001 0.423457 0.130782 O\n",
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}