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{
"id": "jvasp-29573",
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"structure_string": "Tl4 Cu4 P4 Se12\n1.0\n7.661949 -0.013176 0.000000\n-0.045342 8.651862 0.000000\n0.000000 0.000000 9.247349\nTl Cu P Se\n4 4 4 12\ndirect\n0.457105 0.745574 0.026223 Tl\n0.542895 0.254425 0.973777 Tl\n0.957105 0.245574 0.473777 Tl\n0.042895 0.754425 0.526223 Tl\n0.819004 0.731383 0.834432 Cu\n0.319004 0.231383 0.665569 Cu\n0.680996 0.768616 0.334432 Cu\n0.180996 0.268617 0.165568 Cu\n0.497981 0.569693 0.604077 P\n0.502019 0.430306 0.395923 P\n0.997981 0.069693 0.895923 P\n0.002019 0.930306 0.104077 P\n0.262174 0.492084 0.730118 Se\n0.762174 0.992084 0.769882 Se\n0.983115 0.311622 0.971283 Se\n0.516885 0.188378 0.471283 Se\n0.258329 0.502253 0.278399 Se\n0.241673 0.997746 0.778399 Se\n0.016885 0.688378 0.028717 Se\n0.237826 0.007916 0.230118 Se\n0.737826 0.507915 0.269882 Se\n0.741672 0.497746 0.721601 Se\n0.758329 0.002253 0.221601 Se\n0.483115 0.811622 0.528717 Se\n",
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{
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{
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"created_at": "2022-09-04T14:37:14.274951Z",
"updated_at": "2022-09-04T14:37:14.274985Z",
"structure_string": "Y1 Zn1 Cu1 P2\n1.0\n3.977615 -0.000000 0.000000\n-1.988807 3.444716 0.000000\n-0.000000 -0.000000 6.546022\nY Zn Cu P\n1 1 1 2\ndirect\n0.333333 0.666667 0.984473 Y\n0.000000 0.000000 0.374932 Zn\n0.666666 0.333334 0.643887 Cu\n0.666666 0.333334 0.252078 P\n0.000000 0.000000 0.744629 P\n",
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{
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"created_at": "2022-09-04T14:37:31.396672Z",
"updated_at": "2022-09-04T14:37:31.396693Z",
"structure_string": "Ba2 Dy1 Re1 O6\n1.0\n5.164606 0.000000 2.981786\n1.721535 4.869237 2.981786\n0.000000 0.000000 5.963573\nBa Dy Re O\n2 1 1 6\ndirect\n0.250000 0.250000 0.250000 Ba\n0.750001 0.750001 0.750000 Ba\n0.500001 0.500000 0.500000 Dy\n0.000000 0.000000 0.000000 Re\n0.234787 0.765215 0.765214 O\n0.234787 0.765215 0.234786 O\n0.765215 0.234786 0.765214 O\n0.234786 0.234786 0.765214 O\n0.765215 0.234786 0.234786 O\n0.765215 0.765215 0.234786 O\n",
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{
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"structure_string": "Ti1 Zn1 Bi2 O6\n1.0\n5.287035 0.000000 0.000000\n0.000000 5.287035 -0.000000\n0.000000 0.000000 4.923510\nTi Zn Bi O\n1 1 2 6\ndirect\n0.500000 0.500000 0.415002 Ti\n0.000000 0.000000 0.444644 Zn\n0.000000 0.500000 0.993291 Bi\n0.500000 0.000000 0.993291 Bi\n0.257081 0.257081 0.273959 O\n0.257081 0.742918 0.273959 O\n0.000000 0.000000 0.831191 O\n0.500000 0.500000 0.779749 O\n0.742918 0.742918 0.273959 O\n0.742918 0.257081 0.273959 O\n",
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{
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"created_at": "2022-09-04T14:37:31.237037Z",
"updated_at": "2022-09-04T14:37:31.237069Z",
"structure_string": "Sm6 Cu2 Ge2 Se14\n1.0\n5.242321 -9.079966 -0.000000\n5.242321 9.079966 0.000000\n0.000000 0.000000 6.106684\nSm Cu Ge Se\n6 2 2 14\ndirect\n0.356064 0.222890 0.754054 Sm\n0.222890 0.866826 0.254055 Sm\n0.133174 0.356064 0.254055 Sm\n0.866826 0.643936 0.754054 Sm\n0.643936 0.777110 0.254055 Sm\n0.777110 0.133174 0.754054 Sm\n0.000000 0.000000 0.715607 Cu\n0.000000 0.000000 0.215607 Cu\n0.333333 0.666667 0.837091 Ge\n0.666667 0.333333 0.337091 Ge\n0.666667 0.333333 0.951336 Se\n0.576333 0.482145 0.499719 Se\n0.260464 0.161524 0.229313 Se\n0.423666 0.517855 0.999719 Se\n0.739536 0.838476 0.729313 Se\n0.838476 0.098940 0.229313 Se\n0.161524 0.901060 0.729313 Se\n0.094188 0.576333 0.999719 Se\n0.482145 0.905812 0.999719 Se\n0.333333 0.666667 0.451337 Se\n0.098940 0.260464 0.729313 Se\n0.901060 0.739536 0.229313 Se\n0.905812 0.423666 0.499719 Se\n0.517855 0.094188 0.499719 Se\n",
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{
"id": "jvasp-35454",
"created_at": "2022-09-04T14:37:31.500607Z",
"updated_at": "2022-09-04T14:37:31.500632Z",
"structure_string": "Pr2 Al1 N1 O3\n1.0\n3.752320 0.000000 -0.000000\n0.000000 3.752320 -0.000000\n-1.876160 -1.876160 6.342210\nPr Al N O\n2 1 1 3\ndirect\n0.520227 0.520227 0.040455 Pr\n0.808495 0.808495 0.616988 Pr\n0.157833 0.157833 0.315665 Al\n0.997624 0.997624 0.995249 N\n0.169812 0.669812 0.339623 O\n0.669812 0.169812 0.339623 O\n0.328898 0.328898 0.657796 O\n",
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{
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"structure_string": "Sr4 Nd2 Bi2 O12\n1.0\n0.000000 6.003517 0.002078\n6.194033 0.000000 0.000000\n0.000000 -5.963455 -8.594225\nSr Nd Bi O\n4 2 2 12\ndirect\n0.763499 0.050120 0.249451 Sr\n0.236502 0.550120 0.250550 Sr\n0.236503 0.949879 0.750550 Sr\n0.763500 0.449880 0.749451 Sr\n0.500000 0.500000 -0.000000 Nd\n0.500001 0.000000 0.500000 Nd\n0.000001 0.500000 0.500000 Bi\n0.000000 0.000000 0.000000 Bi\n0.655058 0.044602 0.762466 O\n0.344944 0.544602 0.737534 O\n0.126815 0.786817 0.440060 O\n0.873186 0.286818 0.059940 O\n0.873187 0.213182 0.559940 O\n0.765661 0.692213 0.554193 O\n0.234341 0.307787 0.445807 O\n0.765660 0.807786 0.054193 O\n0.655058 0.455398 0.262466 O\n0.234342 0.192213 0.945807 O\n0.126816 0.713182 0.940060 O\n0.344943 0.955398 0.237534 O\n",
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{
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{
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"structure_string": "K2 Th1 Cu2 S4\n1.0\n4.019043 0.000000 0.000000\n-2.009522 6.829810 -2.478878\n0.000000 -0.000868 7.568253\nK Th Cu S\n2 1 2 4\ndirect\n0.137684 0.275367 0.564045 K\n0.862315 0.724632 0.435954 K\n0.000000 0.000000 0.000000 Th\n0.680881 0.361762 0.989377 Cu\n0.319119 0.638237 0.010622 Cu\n0.521804 0.043608 0.758469 S\n0.478196 0.956391 0.241530 S\n0.203018 0.406035 0.179348 S\n0.796982 0.593965 0.820651 S\n",
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}