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{
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{
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"structure_string": "Pr2 P2 Pd2\n1.0\n2.128971 -3.687487 0.000000\n2.128971 3.687487 0.000000\n0.000000 0.000000 7.937791\nPr P Pd\n2 2 2\ndirect\n0.000000 0.000000 0.500000 Pr\n0.000000 0.000000 0.000000 Pr\n0.666667 0.333333 0.250000 P\n0.333333 0.666667 0.750000 P\n0.333333 0.666667 0.250000 Pd\n0.666667 0.333333 0.750000 Pd\n",
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{
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"structure_string": "Al2 Pb6 S2 O22\n1.0\n9.637244 -3.705384 0.000000\n9.637244 3.705384 0.000000\n8.212576 0.000000 6.257789\nAl Pb S O\n2 6 2 22\ndirect\n0.432559 0.432559 0.432559 Al\n0.932559 0.932559 0.932559 Al\n0.649697 0.239839 0.147093 Pb\n0.147093 0.649697 0.239839 Pb\n0.239839 0.147093 0.649696 Pb\n0.647093 0.739839 0.149696 Pb\n0.149696 0.647093 0.739839 Pb\n0.739839 0.149697 0.647093 Pb\n0.117800 0.117800 0.117800 S\n0.617800 0.617800 0.617800 S\n0.493330 0.540651 0.148591 O\n0.148591 0.493330 0.540651 O\n0.540651 0.148591 0.493330 O\n0.648591 0.040651 0.993330 O\n0.993330 0.648591 0.040651 O\n0.040651 0.993330 0.648591 O\n0.403111 0.332667 0.700151 O\n0.700151 0.403111 0.332667 O\n0.332667 0.700151 0.403111 O\n0.200151 0.832667 0.903111 O\n0.903111 0.200151 0.832667 O\n0.832667 0.903111 0.200151 O\n0.307830 0.307830 0.307830 O\n0.807830 0.807830 0.807830 O\n0.063681 0.063681 0.063681 O\n0.563681 0.563681 0.563681 O\n0.011085 0.036251 0.352622 O\n0.352622 0.011085 0.036251 O\n0.036251 0.352622 0.011085 O\n0.852622 0.536251 0.511085 O\n0.511085 0.852622 0.536251 O\n0.536251 0.511085 0.852622 O\n",
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"formula_full": "Al2 Pb6 S2 O22",
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{
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"created_at": "2022-09-04T14:39:28.693411Z",
"structure_string": "La4 Mn2 Ga2 O12\n1.0\n-5.549924 0.000026 -0.000024\n-0.000023 -0.060203 -5.521048\n0.000038 -8.149978 -0.084737\nLa Mn Ga O\n4 2 2 12\ndirect\n0.965535 0.490472 0.748044 La\n0.465548 0.009553 0.751950 La\n0.034463 0.509508 0.251977 La\n0.534450 0.990496 0.248046 La\n0.499997 0.500000 0.500002 Mn\n0.999999 0.000002 0.999995 Mn\n0.499998 0.499995 0.999999 Ga\n0.000003 0.000001 0.499999 Ga\n0.515477 0.582554 0.765852 O\n0.015474 0.917452 0.734123 O\n0.484531 0.417440 0.234147 O\n0.984528 0.082546 0.265871 O\n0.280198 0.788586 0.044320 O\n0.780206 0.711415 0.455686 O\n0.711752 0.221998 0.546784 O\n0.211753 0.278003 0.953208 O\n0.719796 0.211406 0.955680 O\n0.219793 0.288586 0.544308 O\n0.288249 0.777999 0.453215 O\n0.788248 0.721989 0.046794 O\n",
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"elements": [
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"formula_full": "La4 Mn2 Ga2 O12",
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"spacegroup": 14
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{
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"created_at": "2022-09-04T14:39:28.703027Z",
"structure_string": "Mg1 Zr1 Hg2\n1.0\n-5.863318 5.945759 8.436935\n5.863318 -5.945759 8.436935\n5.863318 5.945759 -8.436935\nMg Zr Hg\n1 1 2\ndirect\n0.000000 0.000000 0.000000 Mg\n0.000000 0.500000 0.500000 Zr\n0.000000 0.247886 0.247886 Hg\n0.000000 0.752114 0.752114 Hg\n",
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{
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"structure_string": "Li8 Fe3 Co5 O16\n1.0\n2.895977 0.000000 0.000000\n0.000000 5.087324 0.000000\n0.000000 1.524279 18.888773\nLi Fe Co O\n8 3 5 16\ndirect\n0.500000 0.374984 0.872210 Li\n0.000000 0.500000 0.000000 Li\n0.500000 0.625016 0.127790 Li\n0.000000 0.750691 0.252990 Li\n0.500000 0.875331 0.377870 Li\n0.000000 0.000000 0.500000 Li\n0.000000 0.249309 0.747010 Li\n0.500000 0.124669 0.622130 Li\n0.000000 0.870559 0.869402 Fe\n0.000000 0.129441 0.130598 Fe\n0.500000 0.000000 0.000000 Fe\n0.500000 0.254081 0.255527 Co\n0.000000 0.375944 0.377792 Co\n0.000000 0.624056 0.622208 Co\n0.500000 0.745919 0.744473 Co\n0.500000 0.500000 0.500000 Co\n0.500000 0.300166 0.066582 O\n0.000000 0.419353 0.197795 O\n0.000000 0.343380 0.558425 O\n0.000000 0.580647 0.802205 O\n0.500000 0.530861 0.319645 O\n0.500000 0.469139 0.680355 O\n0.500000 0.699834 0.933418 O\n0.000000 0.656620 0.441575 O\n0.000000 0.827354 0.063539 O\n0.500000 0.780683 0.563802 O\n0.500000 0.040020 0.806578 O\n0.500000 0.959980 0.193422 O\n0.000000 0.902194 0.686321 O\n0.000000 0.172646 0.936461 O\n0.000000 0.097806 0.313679 O\n0.500000 0.219317 0.436198 O\n",
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{
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"structure_string": "Sr1 Eu1 Mn4 O12\n1.0\n5.838960 -0.000000 0.000000\n-0.000000 5.838960 -0.000000\n0.000000 -0.000000 8.301047\nSr Eu Mn O\n1 1 4 12\ndirect\n0.000000 0.000000 0.500000 Sr\n0.500000 0.500000 0.000000 Eu\n0.000000 0.500000 0.747713 Mn\n0.000000 0.500000 0.252287 Mn\n0.500000 0.000000 0.747713 Mn\n0.500000 -0.000000 0.252287 Mn\n0.253290 0.253290 0.753736 O\n0.253290 0.253290 0.246264 O\n0.746710 0.746710 0.753736 O\n0.746710 0.746710 0.246264 O\n0.746710 0.253290 0.753736 O\n0.746710 0.253290 0.246264 O\n0.253290 0.746710 0.753736 O\n0.253290 0.746710 0.246264 O\n0.000000 0.500000 0.500000 O\n0.000000 0.500000 0.000000 O\n0.500000 -0.000000 0.500000 O\n0.500000 -0.000000 0.000000 O\n",
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{
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"structure_string": "Mo2 P10 O30\n1.0\n14.017658 0.000000 0.000000\n0.000000 5.334551 0.000000\n0.000000 2.144375 8.763890\nMo P O\n2 10 30\ndirect\n0.000000 0.500000 0.500000 Mo\n0.500000 0.500000 0.500000 Mo\n0.642545 0.007455 0.475567 P\n0.421715 0.650138 0.820243 P\n0.078285 0.650138 0.820243 P\n0.142545 0.992545 0.524433 P\n0.250000 0.485101 0.008357 P\n0.578285 0.349862 0.179757 P\n0.921715 0.349862 0.179757 P\n0.357455 0.992545 0.524433 P\n0.857455 0.007455 0.475567 P\n0.750000 0.514899 0.991643 P\n0.750000 0.266621 0.938675 O\n0.163313 0.459671 0.896937 O\n0.029332 0.493307 0.718098 O\n0.470668 0.493307 0.718098 O\n0.250000 0.733379 0.061325 O\n0.663313 0.540329 0.103063 O\n0.529332 0.506693 0.281902 O\n0.970668 0.506693 0.281902 O\n0.836687 0.540329 0.103063 O\n0.120655 0.279840 0.493524 O\n0.379345 0.279840 0.493524 O\n0.581337 0.158600 0.560899 O\n0.918663 0.158600 0.560899 O\n0.250000 0.265781 0.149533 O\n0.521968 0.229850 0.079433 O\n0.643140 0.127392 0.298099 O\n0.978032 0.229850 0.079433 O\n0.856860 0.127392 0.298099 O\n0.750000 0.035401 0.526142 O\n0.250000 0.964599 0.473858 O\n0.143140 0.872608 0.701901 O\n0.021968 0.770150 0.920567 O\n0.356860 0.872608 0.701901 O\n0.478032 0.770150 0.920567 O\n0.750000 0.734219 0.850467 O\n0.081337 0.841400 0.439101 O\n0.418663 0.841400 0.439101 O\n0.620655 0.720160 0.506476 O\n0.879345 0.720160 0.506476 O\n0.336687 0.459671 0.896937 O\n",
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{
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{
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{
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}