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{
"id": "jvasp-57783",
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"structure_string": "K4 Co2 S4\n1.0\n5.892512 0.000457 -0.000283\n-0.000522 6.708022 -0.000387\n-2.945250 -3.353470 6.279591\nK Co S\n4 2 4\ndirect\n0.146759 0.483746 0.293561 K\n0.353228 0.190203 0.706412 K\n0.853241 0.516254 0.706439 K\n0.646772 0.809797 0.293588 K\n0.250006 0.000000 -0.000000 Co\n0.749994 0.000000 0.000001 Co\n0.600746 0.286245 0.201519 S\n0.100738 0.915231 0.201506 S\n0.899262 0.084769 0.798494 S\n0.399254 0.713756 0.798481 S\n",
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"structure_string": "Li4 Ni4 Bi2 O12\n1.0\n5.345840 0.038443 0.000000\n2.692600 4.679543 0.000000\n0.000000 0.000000 9.961409\nLi Ni Bi O\n4 4 2 12\ndirect\n0.500000 0.151127 0.750000 Li\n0.500000 0.348872 0.250000 Li\n0.500000 0.651127 0.750000 Li\n0.500000 0.848872 0.250000 Li\n0.328074 0.335963 0.000000 Ni\n0.328074 0.835963 0.500000 Ni\n0.671927 0.164036 0.500000 Ni\n0.671927 0.664036 0.000000 Ni\n0.000000 0.000000 0.000000 Bi\n0.000000 0.500000 0.500000 Bi\n0.623747 0.344230 0.888799 O\n0.623746 0.032024 0.111201 O\n0.376254 0.655769 0.111201 O\n0.376254 0.467975 0.611201 O\n0.376254 0.155769 0.388799 O\n0.000000 0.136038 0.599969 O\n0.376254 0.967975 0.888799 O\n0.000000 0.636038 0.900031 O\n0.000000 0.363961 0.099969 O\n0.623747 0.532023 0.388799 O\n0.000000 0.863961 0.400031 O\n0.623747 0.844230 0.611201 O\n",
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{
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"created_at": "2022-09-04T14:37:51.417610Z",
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"structure_string": "Li2 Mn2 C4 O12\n1.0\n5.354593 0.007006 -0.237159\n2.669880 6.001510 -0.120894\n2.054511 0.005120 7.635646\nLi Mn C O\n2 2 4 12\ndirect\n0.518278 -0.055352 0.683437 Li\n0.214417 0.552821 0.183408 Li\n0.613283 0.515159 0.500211 Mn\n0.879634 0.982291 0.000247 Mn\n0.350736 0.594939 0.790077 C\n0.918331 0.107775 0.700860 C\n0.696979 0.902496 0.290123 C\n0.777890 0.389519 0.200861 C\n0.923477 0.455865 0.276281 O\n0.526533 0.426979 0.299452 O\n0.955696 0.884224 0.241296 O\n0.591008 0.862976 0.441444 O\n0.905285 0.197049 0.555434 O\n0.704437 0.070471 0.799609 O\n0.591254 0.613105 0.741287 O\n0.274245 0.537978 0.660838 O\n0.563431 0.959593 0.160924 O\n0.205255 0.634439 0.941408 O\n0.130383 0.041446 0.776169 O\n0.854401 0.300099 0.055470 O\n",
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"structure_string": "Ba4 Mg1 P1\n1.0\n-0.000000 4.987623 4.987623\n4.987623 0.000000 4.987623\n4.987623 4.987623 0.000000\nBa Mg P\n4 1 1\ndirect\n0.119746 0.626751 0.626751 Ba\n0.626751 0.626751 0.626751 Ba\n0.626751 0.119746 0.626751 Ba\n0.626751 0.626751 0.119746 Ba\n0.250000 0.250000 0.250000 Mg\n0.000000 0.000000 0.000000 P\n",
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{
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"structure_string": "Sn2 H8 C4 Cl4\n1.0\n5.878644 0.000490 3.238969\n2.678568 6.062462 2.092291\n0.003532 -0.160203 6.948355\nSn H C Cl\n2 8 4 4\ndirect\n0.226090 0.749900 0.249938 Sn\n0.773892 0.249879 0.749924 Sn\n0.718534 0.649656 0.552031 H\n0.920215 0.850157 0.948014 H\n0.079781 0.149611 0.051828 H\n0.281461 0.350113 0.447813 H\n0.079251 0.552254 0.649787 H\n0.718467 0.052452 0.149832 H\n0.281527 0.947307 0.850021 H\n0.920745 0.447507 0.350067 H\n0.887934 0.496788 0.502939 C\n0.112058 0.502981 0.496910 C\n0.887800 0.003032 -0.003038 C\n0.112196 -0.003264 0.002886 C\n0.697385 0.057109 0.557209 Cl\n0.311882 0.442658 0.942636 Cl\n0.688104 0.557109 0.057214 Cl\n0.302616 0.942660 0.442640 Cl\n",
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{
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"created_at": "2022-09-04T14:38:16.794094Z",
"updated_at": "2022-09-04T14:38:16.794116Z",
"structure_string": "V2 Ag4 P2 O12\n1.0\n5.643827 0.000000 -2.828046\n-0.025991 6.343741 -0.051869\n-0.045918 -0.044641 6.953976\nV Ag P O\n2 4 2 12\ndirect\n0.616344 0.087519 0.232688 V\n0.383656 0.912481 0.767312 V\n0.362609 0.615118 0.231724 Ag\n0.869116 0.615118 0.231724 Ag\n0.637391 0.384882 0.768276 Ag\n0.130885 0.384882 0.768276 Ag\n0.847445 0.850529 0.694889 P\n0.152555 0.149471 0.305111 P\n0.492248 0.207515 0.984497 O\n0.704126 0.286878 0.408252 O\n0.903276 0.635368 0.806553 O\n0.919966 0.020539 0.235587 O\n0.277611 0.177561 0.555222 O\n0.096725 0.364632 0.193447 O\n0.295874 0.713122 0.591748 O\n0.315623 0.020539 0.235587 O\n0.080035 0.979461 0.764413 O\n0.507752 0.792485 0.015503 O\n0.684378 0.979461 0.764413 O\n0.722389 0.822440 0.444778 O\n",
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"structure_string": "Ca2 Ni2 P4 O14\n1.0\n6.415412 0.001241 0.250216\n0.701924 5.949435 2.606828\n-0.030286 0.016003 6.506179\nCa Ni P O\n2 2 4 14\ndirect\n0.127343 0.738717 0.801606 Ca\n0.872656 0.261282 0.198396 Ca\n0.354331 0.898974 0.220189 Ni\n0.645668 0.101025 0.779813 Ni\n0.375469 0.362435 0.324215 P\n0.624530 0.637563 0.675787 P\n0.859757 0.766230 0.254791 P\n0.140242 0.233769 0.745211 P\n0.730494 0.796708 0.745224 O\n0.269504 0.203290 0.254778 O\n0.326419 0.049695 0.864525 O\n0.774220 0.598535 0.484677 O\n0.938843 0.618303 0.134772 O\n0.621247 0.397253 0.853530 O\n0.378751 0.602746 0.146471 O\n0.409098 0.744424 0.562006 O\n0.590901 0.255575 0.437995 O\n0.031162 0.886612 0.304539 O\n0.968836 0.113387 0.695463 O\n0.225779 0.401464 0.515324 O\n0.061156 0.381696 0.865230 O\n0.673580 0.950304 0.135477 O\n",
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"structure_string": "Pr2 Tm6\n1.0\n0.000000 7.146294 0.001354\n5.609513 0.000000 0.000000\n0.000000 -3.571945 -6.189637\nPr Tm\n2 6\ndirect\n0.666667 0.250000 0.333336 Pr\n0.333334 0.750000 0.666665 Pr\n0.671614 0.250000 0.835808 Tm\n0.835806 0.750000 0.164190 Tm\n0.835800 0.750000 0.671602 Tm\n0.164201 0.250000 0.328400 Tm\n0.164195 0.250000 0.835811 Tm\n0.328387 0.750000 0.164194 Tm\n",
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"structure_string": "Ba4 Ca1 Mo1\n1.0\n0.000000 4.987160 4.987160\n4.987160 -0.000000 4.987160\n4.987160 4.987160 -0.000000\nBa Ca Mo\n4 1 1\ndirect\n0.119594 0.626802 0.626802 Ba\n0.626802 0.626802 0.626802 Ba\n0.626802 0.119594 0.626802 Ba\n0.626802 0.626802 0.119594 Ba\n0.250000 0.250000 0.250000 Ca\n0.000000 0.000000 0.000000 Mo\n",
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{
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"structure_string": "Li4 Fe5 Co3 O16\n1.0\n5.622854 0.005379 0.033894\n-2.800426 4.857887 0.000283\n-0.039746 -0.023645 9.076609\nLi Fe Co O\n4 5 3 16\ndirect\n0.663554 0.331783 0.105568 Li\n0.997469 0.998741 0.001622 Li\n0.999459 0.999748 0.503673 Li\n0.333363 0.666696 0.607571 Li\n0.668219 0.334125 0.513416 Fe\n0.343579 0.171799 0.788849 Fe\n0.332487 0.666252 0.008291 Fe\n0.170126 0.825241 0.286558 Fe\n0.170127 0.344912 0.286557 Fe\n0.659146 0.829586 0.287926 Co\n0.827697 0.657784 0.788253 Co\n0.827697 0.169934 0.788253 Co\n0.664068 0.832045 0.901750 O\n0.169949 0.834787 0.898402 O\n0.333693 0.666860 0.397866 O\n0.476815 0.519797 0.158580 O\n0.476811 0.957038 0.158578 O\n0.334731 0.167380 0.398357 O\n0.520834 0.042098 0.657459 O\n0.958772 0.479393 0.659101 O\n0.836543 0.172231 0.400179 O\n0.002123 0.001076 0.193334 O\n0.002209 0.001110 0.694543 O\n0.665431 0.332731 0.897166 O\n0.037765 0.518897 0.154244 O\n0.836544 0.664344 0.400183 O\n0.520829 0.478757 0.657463 O\n0.169946 0.335178 0.898406 O\n",
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}