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{
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{
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"structure_string": "Na9 Ni7 O16\n1.0\n6.899998 0.000000 0.000000\n2.444020 6.534205 0.000000\n1.777203 2.822551 7.188087\nNa Ni O\n9 7 16\ndirect\n0.422683 0.561176 0.812468 Na\n0.313931 0.685435 0.431547 Na\n0.686069 0.314565 0.568453 Na\n0.053943 0.929260 0.691442 Na\n0.186470 0.796764 0.067465 Na\n0.577317 0.438824 0.187532 Na\n0.000000 0.500000 0.000000 Na\n0.946057 0.070740 0.308558 Na\n0.813530 0.203236 0.932535 Na\n0.621126 0.882485 0.869742 Ni\n0.872943 0.633384 0.617524 Ni\n0.251825 0.243745 0.749348 Ni\n0.748175 0.756255 0.250652 Ni\n0.127057 0.366616 0.382476 Ni\n0.500000 0.000000 0.500000 Ni\n0.378874 0.117515 0.130258 Ni\n0.142477 0.553328 0.708573 O\n0.007158 0.296021 0.641127 O\n0.502776 0.190584 0.848092 O\n0.992842 0.703979 0.358873 O\n0.624481 0.691674 0.506143 O\n0.497224 0.809416 0.151908 O\n0.365381 0.939621 0.771394 O\n0.375519 0.308326 0.493857 O\n0.856352 0.844579 0.991682 O\n0.857523 0.446672 0.291427 O\n0.747942 0.962608 0.590338 O\n0.252058 0.037392 0.409662 O\n0.634619 0.060379 0.228606 O\n0.719115 0.586503 0.862824 O\n0.280885 0.413497 0.137176 O\n0.143648 0.155421 0.008318 O\n",
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{
"id": "mp-771643",
"created_at": "2022-09-04T14:45:29.761869Z",
"structure_string": "Sr8 Ca4 I24\n1.0\n9.521148 0.000000 0.000000\n0.000000 10.425427 0.000000\n0.000000 9.738232 14.814438\nSr Ca I\n8 4 24\ndirect\n0.701273 0.296425 0.093555 Sr\n0.906029 0.637552 0.712631 Sr\n0.406029 0.362448 0.787369 Sr\n0.201273 0.703575 0.406445 Sr\n0.798727 0.296425 0.593555 Sr\n0.593971 0.637552 0.212631 Sr\n0.093971 0.362448 0.287369 Sr\n0.298727 0.703575 0.906445 Sr\n0.645830 0.926647 0.430249 Ca\n0.145830 0.073353 0.069751 Ca\n0.854170 0.926647 0.930249 Ca\n0.354170 0.073353 0.569751 Ca\n0.331437 0.023371 0.411419 I\n0.264761 0.723918 0.705088 I\n0.612833 0.572148 0.865128 I\n0.948918 0.826889 0.485921 I\n0.061967 0.418057 0.923461 I\n0.052068 0.107858 0.223535 I\n0.552068 0.892142 0.276465 I\n0.448918 0.173111 0.014079 I\n0.561967 0.581943 0.576539 I\n0.112833 0.427852 0.634872 I\n0.764761 0.276082 0.794912 I\n0.831437 0.976629 0.088581 I\n0.168563 0.023371 0.911419 I\n0.235239 0.723918 0.205088 I\n0.887167 0.572148 0.365128 I\n0.438033 0.418057 0.423461 I\n0.551082 0.826889 0.985921 I\n0.447932 0.107858 0.723535 I\n0.947932 0.892142 0.776465 I\n0.938033 0.581943 0.076539 I\n0.051082 0.173111 0.514079 I\n0.387167 0.427852 0.134872 I\n0.735239 0.276082 0.294912 I\n0.668563 0.976629 0.588581 I\n",
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{
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"structure_string": "Mn16 H64 N32\n1.0\n-5.384721 5.384721 12.030419\n5.384721 -5.384721 12.030419\n5.384721 5.384721 -12.030419\nMn H N\n16 64 32\ndirect\n0.270037 0.868145 0.045262 Mn\n0.770037 0.724776 0.401893 Mn\n0.118145 0.020037 0.545262 Mn\n0.618145 0.072883 0.098107 Mn\n0.479963 0.381855 0.454738 Mn\n0.979963 0.525224 0.098107 Mn\n0.631855 0.229963 0.954738 Mn\n0.131855 0.177117 0.401893 Mn\n0.322883 0.368145 0.598107 Mn\n0.822883 0.224776 0.954738 Mn\n0.974776 0.520037 0.901893 Mn\n0.474776 0.572883 0.454738 Mn\n0.427117 0.881855 0.901893 Mn\n0.927117 0.025224 0.545262 Mn\n0.775224 0.729963 0.598107 Mn\n0.275224 0.677117 0.045262 Mn\n0.446854 0.339318 0.147993 H\n0.946854 0.798860 0.107536 H\n0.589318 0.196854 0.647993 H\n0.089318 0.441324 0.392464 H\n0.303146 0.910682 0.352007 H\n0.803146 0.451140 0.392464 H\n0.160682 0.053146 0.852007 H\n0.660682 0.808676 0.107536 H\n0.691324 0.839318 0.892464 H\n0.191324 0.298860 0.852007 H\n0.048860 0.696854 0.607536 H\n0.548860 0.941324 0.352007 H\n0.058676 0.410682 0.607536 H\n0.558676 0.951140 0.647993 H\n0.701140 0.553146 0.892464 H\n0.201140 0.308676 0.147993 H\n0.463401 0.957502 0.144645 H\n0.963401 0.818755 0.505899 H\n0.207502 0.213401 0.644645 H\n0.707502 0.062856 0.994101 H\n0.286599 0.292498 0.355355 H\n0.786599 0.431245 0.994101 H\n0.542498 0.036599 0.855355 H\n0.042498 0.187144 0.505899 H\n0.312856 0.457502 0.494101 H\n0.812856 0.318755 0.855355 H\n0.068755 0.713401 0.005899 H\n0.568755 0.562856 0.355355 H\n0.437144 0.792498 0.005899 H\n0.937144 0.931245 0.644645 H\n0.681245 0.536599 0.494101 H\n0.181245 0.687144 0.144645 H\n0.452990 0.298324 0.079444 H\n0.952990 0.873545 0.154666 H\n0.548324 0.202990 0.579444 H\n0.048324 0.468880 0.345334 H\n0.297010 0.951676 0.420556 H\n0.797010 0.376455 0.345334 H\n0.201676 0.047010 0.920556 H\n0.701676 0.781120 0.154666 H\n0.718880 0.798324 0.845334 H\n0.218880 0.373545 0.920556 H\n0.123545 0.702990 0.654666 H\n0.623545 0.968880 0.420556 H\n0.031120 0.451676 0.654666 H\n0.531120 0.876455 0.579444 H\n0.626455 0.547010 0.845334 H\n0.126455 0.281120 0.079444 H\n0.540278 0.425941 0.418729 H\n0.040278 0.621549 0.114337 H\n0.675941 0.290278 0.918729 H\n0.175941 0.257212 0.385663 H\n0.209722 0.824059 0.081271 H\n0.709722 0.628451 0.385663 H\n0.074059 0.959722 0.581271 H\n0.574059 0.992788 0.114337 H\n0.507212 0.925941 0.885663 H\n0.007212 0.121549 0.581271 H\n0.871549 0.790278 0.614337 H\n0.371549 0.757212 0.081271 H\n0.242788 0.324059 0.614337 H\n0.742788 0.128451 0.918729 H\n0.878451 0.459722 0.885663 H\n0.378451 0.492788 0.418729 H\n0.061804 0.061804 0.000000 N\n0.561804 0.561804 0.000000 N\n0.311804 0.811804 0.500000 N\n0.811804 0.311804 0.500000 N\n0.688196 0.188196 0.500000 N\n0.188196 0.688196 0.500000 N\n0.438196 0.438196 0.000000 N\n0.938196 0.938196 0.000000 N\n0.391081 0.875000 0.016081 N\n0.891081 0.875000 0.516081 N\n0.125000 0.141081 0.516081 N\n0.625000 0.108919 0.983919 N\n0.358919 0.375000 0.483919 N\n0.858919 0.375000 0.983919 N\n0.125000 0.641081 0.016081 N\n0.625000 0.608919 0.483919 N\n0.851844 0.415192 0.641516 N\n0.351844 0.710328 0.436653 N\n0.665192 0.601844 0.141516 N\n0.165192 0.023675 0.063347 N\n0.898156 0.834808 0.858484 N\n0.398156 0.539672 0.063347 N\n0.084808 0.648156 0.358484 N\n0.584808 0.226325 0.436653 N\n0.273675 0.915192 0.563347 N\n0.773675 0.210328 0.358484 N\n0.960328 0.101844 0.936653 N\n0.460328 0.523675 0.858484 N\n0.476325 0.334808 0.936653 N\n0.976325 0.039672 0.141516 N\n0.789672 0.148156 0.563347 N\n0.289672 0.726325 0.641516 N\n",
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{
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{
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"structure_string": "Al2 Tl2 Fe4 F4\n1.0\n-3.271024 3.271024 6.108102\n3.271024 -3.271024 6.108102\n3.271024 3.271024 -6.108102\nAl Tl Fe F\n2 2 4 4\ndirect\n0.000000 0.000000 0.000000 Al\n0.500000 0.500000 0.000000 Al\n0.750000 0.250000 0.500000 Tl\n0.250000 0.750000 0.500000 Tl\n0.642818 0.142818 0.785636 Fe\n0.357182 0.857182 0.214364 Fe\n0.142818 0.357182 0.500000 Fe\n0.857182 0.642818 0.500000 Fe\n0.144376 0.144376 0.000000 F\n0.855624 0.855624 0.000000 F\n0.355624 0.355624 0.000000 F\n0.644376 0.644376 0.000000 F\n",
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}