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{
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"structure_string": "Li6 P1 S5 Cl1\n1.0\n5.082268 5.082268 -0.000000\n5.082268 0.000000 -5.082268\n-0.000000 5.082268 -5.082268\nLi P S Cl\n6 1 5 1\ndirect\n0.023173 0.476827 0.023173 Li\n0.476827 0.023173 0.476827 Li\n0.023173 0.476827 0.476827 Li\n0.476827 0.023173 0.023173 Li\n0.023173 0.023173 0.476827 Li\n0.476827 0.476827 0.023173 Li\n0.500000 0.500000 0.500000 P\n0.616944 0.616944 0.149168 S\n0.616944 0.149168 0.616944 S\n0.149168 0.616944 0.616944 S\n0.616944 0.616944 0.616944 S\n0.250000 0.250000 0.250000 S\n0.000000 0.000000 0.000000 Cl\n",
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{
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"structure_string": "Sr2 Ca1 Tl1 Cu2 O7\n1.0\n3.773558 0.000000 0.000000\n0.000000 3.773558 0.000000\n0.000000 -0.000000 12.204720\nSr Ca Tl Cu O\n2 1 1 2 7\ndirect\n0.500000 0.500000 0.210049 Sr\n0.500000 0.500000 0.789951 Sr\n0.500000 0.500000 0.500000 Ca\n0.000000 0.000000 0.000000 Tl\n0.000000 0.000000 0.359453 Cu\n0.000000 0.000000 0.640547 Cu\n0.500000 0.000000 0.627646 O\n0.000000 0.500000 0.627646 O\n0.500000 0.000000 0.372354 O\n0.000000 0.500000 0.372354 O\n0.000000 0.000000 0.826991 O\n0.000000 0.000000 0.173009 O\n0.500000 0.500000 0.000000 O\n",
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"formula_full": "Sr2 Ca1 Tl1 Cu2 O7",
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{
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"updated_at": "2022-09-04T14:37:49.734537Z",
"structure_string": "Np1 Al8 Fe4\n1.0\n4.664443 0.000000 1.903493\n2.332221 6.070216 0.951747\n0.038677 0.000000 6.571994\nNp Al Fe\n1 8 4\ndirect\n0.000000 0.000000 0.000000 Np\n0.718518 0.781482 0.781481 Al\n0.500000 0.218519 0.781481 Al\n0.499999 0.781482 0.218519 Al\n0.281481 0.218519 0.218518 Al\n0.660260 0.339739 0.339739 Al\n0.339739 0.660261 0.660261 Al\n0.000000 0.339739 0.660261 Al\n-0.000000 0.660261 0.339739 Al\n0.000000 0.000000 0.500000 Fe\n0.499999 0.500000 0.000000 Fe\n-0.000000 0.500000 0.000000 Fe\n0.500000 0.000000 0.499999 Fe\n",
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{
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"updated_at": "2022-09-04T14:38:02.311347Z",
"structure_string": "Li6 P1 S5 I1\n1.0\n5.115172 5.115172 0.000000\n5.115172 -0.000000 -5.115172\n-0.000000 5.115172 -5.115172\nLi P S I\n6 1 5 1\ndirect\n0.023528 0.476472 0.023528 Li\n0.476472 0.023528 0.476472 Li\n0.023528 0.476472 0.476472 Li\n0.476472 0.023528 0.023528 Li\n0.023528 0.023528 0.476472 Li\n0.476472 0.476472 0.023528 Li\n0.500000 0.500000 0.500000 P\n0.616329 0.616329 0.151010 S\n0.616329 0.151010 0.616329 S\n0.151010 0.616329 0.616329 S\n0.616329 0.616329 0.616329 S\n0.250000 0.250000 0.250000 S\n0.000000 0.000000 0.000000 I\n",
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{
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"updated_at": "2022-09-04T14:38:03.576818Z",
"structure_string": "K1 Cr4 O8\n1.0\n2.889336 -0.000000 0.614154\n1.444669 6.916398 0.307076\n0.006655 0.000000 7.072332\nK Cr O\n1 4 8\ndirect\n0.500003 0.000000 -0.000000 K\n0.835571 0.512656 0.816211 Cr\n0.164436 0.487344 0.183789 Cr\n0.348225 0.816211 0.487343 Cr\n0.651779 0.183789 0.512655 Cr\n0.459203 0.378205 0.703390 O\n0.162595 0.296610 0.378205 O\n0.837409 0.703390 0.621796 O\n0.540800 0.621795 0.296609 O\n0.846589 0.952402 0.354426 O\n0.153413 0.047598 0.645574 O\n0.201013 0.645575 0.952401 O\n0.798989 0.354425 0.047597 O\n",
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{
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"created_at": "2022-09-04T14:37:57.419953Z",
"updated_at": "2022-09-04T14:37:57.419986Z",
"structure_string": "Ca3 P2 O8\n1.0\n4.869789 -0.006378 4.932160\n2.020479 4.430864 4.932160\n-0.009932 -0.006378 6.931158\nCa P O\n3 2 8\ndirect\n0.000000 0.000000 0.000000 Ca\n0.202655 0.202655 0.202655 Ca\n0.797346 0.797343 0.797345 Ca\n0.404979 0.404978 0.404979 P\n0.595022 0.595021 0.595022 P\n0.727440 0.727438 0.246175 O\n0.727440 0.246174 0.727439 O\n0.246175 0.727438 0.727439 O\n0.753826 0.272561 0.272561 O\n0.272562 0.272561 0.753826 O\n0.322900 0.322899 0.322899 O\n0.677102 0.677100 0.677101 O\n0.272562 0.753825 0.272561 O\n",
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{
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"created_at": "2022-09-04T14:38:01.953772Z",
"updated_at": "2022-09-04T14:38:01.953792Z",
"structure_string": "Zn1 Sb4 O8\n1.0\n3.235247 -0.296195 -0.466619\n0.695115 7.036696 0.324141\n-0.069515 3.604140 8.721214\nZn Sb O\n1 4 8\ndirect\n0.483883 0.910386 0.816251 Zn\n0.326057 0.741472 0.500114 Sb\n0.007719 0.318138 0.865000 Sb\n0.133468 0.615032 0.116015 Sb\n0.798229 0.197422 0.445737 Sb\n0.211105 0.311684 0.271051 O\n0.691115 0.659569 0.231900 O\n0.454839 0.250613 0.758463 O\n0.917624 0.608666 0.684359 O\n0.765556 -0.039620 0.379453 O\n0.045610 0.903547 0.940320 O\n0.372046 0.966182 0.593413 O\n0.570325 0.566280 -0.010874 O\n",
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{
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"created_at": "2022-09-04T14:37:46.167383Z",
"updated_at": "2022-09-04T14:37:46.167417Z",
"structure_string": "Tl2 Hg2 Pd1 Cl8\n1.0\n6.330982 0.012627 1.868810\n2.763475 5.696026 1.868810\n-0.023695 -0.014873 9.771913\nTl Hg Pd Cl\n2 2 1 8\ndirect\n0.397409 0.397409 0.836112 Tl\n0.602592 0.602593 0.163887 Tl\n0.134236 0.134236 0.596767 Hg\n0.865765 0.865766 0.403232 Hg\n0.000000 0.000000 0.000000 Pd\n0.895306 0.380469 0.870562 Cl\n0.380468 0.895307 0.870561 Cl\n0.352878 0.352878 0.494579 Cl\n0.104695 0.619533 0.129438 Cl\n0.914694 0.914695 0.695936 Cl\n0.647123 0.647124 0.505420 Cl\n0.619532 0.104695 0.129438 Cl\n0.085307 0.085307 0.304063 Cl\n",
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}