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{
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"results": [
{
"id": "mp-17059",
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"structure_string": "K6 Nb6 Si4 O26\n1.0\n4.628905 -8.017498 0.000000\n4.628905 8.017498 0.000000\n0.000000 0.000000 7.926753\nK Nb Si O\n6 6 4 26\ndirect\n0.404125 0.404125 0.500000 K\n0.000000 0.595875 0.500000 K\n0.610742 0.000000 0.000000 K\n0.389258 0.389258 0.000000 K\n0.595875 0.000000 0.500000 K\n0.000000 0.610742 0.000000 K\n0.237862 0.000000 0.250423 Nb\n0.000000 0.237862 0.749577 Nb\n0.000000 0.237862 0.250423 Nb\n0.762138 0.762138 0.250423 Nb\n0.237862 0.000000 0.749577 Nb\n0.762138 0.762138 0.749577 Nb\n0.666667 0.333333 0.208906 Si\n0.666667 0.333333 0.791094 Si\n0.333333 0.666667 0.791094 Si\n0.333333 0.666667 0.208906 Si\n0.000000 0.231927 0.500000 O\n0.768073 0.768073 0.500000 O\n0.231927 0.000000 0.500000 O\n0.513377 0.696130 0.270869 O\n0.303870 0.817247 0.270869 O\n0.182753 0.486623 0.270869 O\n0.486623 0.182753 0.729131 O\n0.182753 0.486623 0.729131 O\n0.513377 0.696130 0.729131 O\n0.303870 0.817247 0.729131 O\n0.696130 0.513377 0.270869 O\n0.817247 0.303870 0.270869 O\n0.817247 0.303870 0.729131 O\n0.696130 0.513377 0.729131 O\n0.486623 0.182753 0.270869 O\n0.826083 0.000000 0.765408 O\n0.333333 0.666667 0.000000 O\n0.666667 0.333333 0.000000 O\n0.270101 0.000000 0.000000 O\n0.729899 0.729899 0.000000 O\n0.000000 0.270101 0.000000 O\n0.826083 0.000000 0.234592 O\n0.173917 0.173917 0.765408 O\n0.000000 0.826083 0.765408 O\n0.000000 0.826083 0.234592 O\n0.173917 0.173917 0.234592 O\n",
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"formula_full": "K6 Nb6 Si4 O26",
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{
"id": "mp-862618",
"created_at": "2022-09-04T14:48:07.227366Z",
"structure_string": "Li1 Er1 Hg2\n1.0\n0.000000 3.539720 3.539720\n3.539720 0.000000 3.539720\n3.539720 3.539720 0.000000\nLi Er Hg\n1 1 2\ndirect\n0.000000 0.000000 0.000000 Li\n0.500000 0.500000 0.500000 Er\n0.250000 0.250000 0.250000 Hg\n0.750000 0.750000 0.750000 Hg\n",
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"formula_full": "Li1 Er1 Hg2",
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{
"id": "mp-3051",
"created_at": "2022-09-04T14:48:07.230227Z",
"structure_string": "Mg8 Ge4 O16\n1.0\n4.969759 0.000000 0.000000\n0.000000 6.102763 0.000000\n0.000000 0.000000 10.442349\nMg Ge O\n8 4 16\ndirect\n0.000000 0.000000 0.000000 Mg\n0.500000 0.000000 0.500000 Mg\n0.000000 0.500000 0.000000 Mg\n0.500000 0.500000 0.500000 Mg\n0.493437 0.750000 0.776094 Mg\n0.993437 0.250000 0.723906 Mg\n0.506563 0.250000 0.223906 Mg\n0.006563 0.750000 0.276094 Mg\n0.563842 0.750000 0.094324 Ge\n0.063842 0.250000 0.405676 Ge\n0.436158 0.250000 0.905676 Ge\n0.936158 0.750000 0.594324 Ge\n0.233166 0.478642 0.335621 O\n0.733166 0.521358 0.164379 O\n0.766834 0.978642 0.664379 O\n0.266834 0.021358 0.835621 O\n0.766834 0.521358 0.664379 O\n0.266834 0.478642 0.835621 O\n0.233166 0.021358 0.335621 O\n0.733166 0.978642 0.164379 O\n0.729847 0.750000 0.940124 O\n0.229847 0.250000 0.559876 O\n0.270153 0.250000 0.059876 O\n0.770153 0.750000 0.440124 O\n0.211076 0.750000 0.092096 O\n0.711076 0.250000 0.407904 O\n0.788924 0.250000 0.907904 O\n0.288924 0.750000 0.592096 O\n",
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],
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"spacegroup": 62
},
{
"id": "mp-532405",
"created_at": "2022-09-04T14:48:07.241979Z",
"structure_string": "Mg4 Al24 O40\n1.0\n2.865165 4.936382 0.000000\n-2.865165 4.936382 0.000000\n0.000000 3.339240 23.150107\nMg Al O\n4 24 40\ndirect\n0.532635 0.532635 0.416121 Mg\n0.126180 0.126180 0.624062 Mg\n0.722518 0.722518 0.833820 Mg\n0.475719 0.475719 0.572515 Mg\n0.322769 0.322769 0.031572 Al\n0.803658 0.803658 0.096475 Al\n0.804706 0.292546 0.096026 Al\n0.931256 0.931256 0.223357 Al\n0.292546 0.804706 0.096026 Al\n0.403011 0.900050 0.297243 Al\n0.587976 0.587976 0.202373 Al\n0.900050 0.403011 0.297243 Al\n0.268025 0.268025 0.175681 Al\n0.210779 0.210779 0.395634 Al\n0.498375 0.003392 0.497229 Al\n0.602741 0.602741 0.701380 Al\n0.870890 0.870890 0.371110 Al\n0.801011 0.801011 0.598074 Al\n0.003392 0.498375 0.497229 Al\n0.003840 0.003840 0.497117 Al\n0.093438 0.602965 0.701377 Al\n0.196673 0.196673 0.906952 Al\n0.196885 0.698403 0.906788 Al\n0.397684 0.397684 0.806674 Al\n0.602965 0.093438 0.701377 Al\n0.698403 0.196885 0.906788 Al\n0.073466 0.073466 0.778769 Al\n0.674873 0.674873 0.972792 Al\n0.651691 0.145296 0.056052 O\n0.951234 0.951234 0.142710 O\n0.145296 0.651691 0.056052 O\n0.145396 0.145396 0.056007 O\n0.265469 0.770618 0.243285 O\n0.458611 0.458611 0.147096 O\n0.647534 0.647534 0.051716 O\n0.464571 0.923496 0.145253 O\n0.567413 0.567413 0.334823 O\n0.770618 0.265469 0.243285 O\n0.747336 0.747336 0.245293 O\n0.923496 0.464571 0.145253 O\n0.882097 0.332500 0.453359 O\n0.057967 0.057967 0.348099 O\n0.238859 0.238859 0.251637 O\n0.332500 0.882097 0.453359 O\n0.035767 0.532224 0.352216 O\n0.154729 0.154729 0.542186 O\n0.336493 0.336493 0.452482 O\n0.532224 0.035767 0.352216 O\n0.483406 0.930900 0.654969 O\n0.670487 0.670487 0.547381 O\n0.850587 0.850587 0.452838 O\n0.671065 0.112657 0.547493 O\n0.751398 0.751398 0.746169 O\n0.930900 0.483406 0.654969 O\n0.112657 0.671065 0.547493 O\n0.931518 0.931518 0.654967 O\n0.090794 0.526229 0.855493 O\n0.258181 0.258181 0.751489 O\n0.445923 0.445923 0.662376 O\n0.349276 0.349276 0.951313 O\n0.258261 0.731893 0.751517 O\n0.526229 0.090794 0.855493 O\n0.526974 0.526974 0.855465 O\n0.731893 0.258261 0.751517 O\n0.851493 0.851493 0.942962 O\n0.047713 0.047713 0.855753 O\n0.851666 0.352390 0.943083 O\n0.352390 0.851666 0.943083 O\n",
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"volume": 654.8493423187607,
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"formula_full": "Mg4 Al24 O40",
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"updated_at": "2021-11-28T01:38:25.504000Z",
"spacegroup": 8
},
{
"id": "mp-1256989",
"created_at": "2022-09-04T14:48:07.220370Z",
"structure_string": "Li2 V2 Si8 H4 O24\n1.0\n7.349995 0.044761 -0.279650\n0.156678 8.147588 0.178302\n0.466014 4.115526 8.329941\nLi V Si H O\n2 2 8 4 24\ndirect\n0.372047 0.394227 0.818271 Li\n0.627953 0.605773 0.181729 Li\n0.000000 0.500000 0.000000 V\n0.500000 0.000000 0.000000 V\n0.124572 0.054105 0.176793 Si\n0.250036 0.292807 0.312640 Si\n0.247243 0.109908 0.684560 Si\n0.389450 0.724999 0.842362 Si\n0.610550 0.275001 0.157638 Si\n0.752757 0.890092 0.315440 Si\n0.749964 0.707193 0.687360 Si\n0.875428 0.945895 0.823207 Si\n0.105705 0.559042 0.656234 H\n0.218526 0.511661 0.532866 H\n0.781474 0.488339 0.467134 H\n0.894295 0.440958 0.343766 H\n0.087758 0.439552 0.212962 O\n0.036919 0.096551 0.746939 O\n0.213111 0.091179 0.320547 O\n0.048918 0.257225 0.038592 O\n0.229587 0.542488 0.621649 O\n0.256093 0.273164 0.495943 O\n0.276701 0.963490 0.104454 O\n0.240994 0.560502 0.915141 O\n0.309544 0.912796 0.690832 O\n0.449864 0.366419 0.226712 O\n0.382902 0.156094 0.797529 O\n0.529586 0.218729 0.023543 O\n0.470414 0.781271 0.976457 O\n0.617098 0.843906 0.202471 O\n0.550136 0.633581 0.773288 O\n0.690456 0.087204 0.309168 O\n0.759006 0.439498 0.084859 O\n0.723299 0.036510 0.895546 O\n0.743907 0.726836 0.504057 O\n0.770413 0.457512 0.378351 O\n0.951082 0.742775 0.961408 O\n0.786890 0.908821 0.679453 O\n0.963081 0.903449 0.253061 O\n0.912242 0.560448 0.787038 O\n",
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{
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"structure_string": "Ce2 Fe1 Se2 O2\n1.0\n1.959992 5.720224 0.000000\n-1.959992 5.720224 0.000000\n0.000000 3.759038 6.092109\nCe Fe Se O\n2 1 2 2\ndirect\n0.308859 0.308859 0.241813 Ce\n0.691141 0.691141 0.758187 Ce\n0.500000 0.500000 0.500000 Fe\n0.060201 0.060201 0.176197 Se\n0.939799 0.939799 0.823803 Se\n0.302409 0.302409 0.580821 O\n0.697591 0.697591 0.419179 O\n",
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"formula_full": "Ce2 Fe1 Se2 O2",
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{
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"structure_string": "Ti2 Co1 Ni1\n1.0\n2.989423 0.000000 0.000000\n0.000000 2.989423 0.000000\n0.000000 0.000000 5.980982\nTi Co Ni\n2 1 1\ndirect\n0.500000 0.500000 0.248179 Ti\n0.500000 0.500000 0.751821 Ti\n0.000000 0.000000 0.000000 Co\n0.000000 0.000000 0.500000 Ni\n",
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{
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"structure_string": "Sr3 Ni1\n1.0\n5.248074 0.000000 0.000000\n0.000000 5.248074 0.000000\n0.000000 0.000000 5.248074\nSr Ni\n3 1\ndirect\n0.000000 0.500000 0.500000 Sr\n0.500000 0.000000 0.500000 Sr\n0.500000 0.500000 0.000000 Sr\n0.000000 0.000000 0.000000 Ni\n",
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{
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"structure_string": "Sb8 C16 O4\n1.0\n6.317765 0.000000 0.000000\n0.000000 7.821553 0.000000\n0.000000 0.000000 16.135683\nSb C O\n8 16 4\ndirect\n0.590718 0.321539 0.553100 Sb\n0.909282 0.678461 0.053100 Sb\n0.090718 0.178461 0.446900 Sb\n0.409282 0.821539 0.946900 Sb\n0.701634 0.136712 0.835880 Sb\n0.798366 0.863288 0.335880 Sb\n0.201634 0.363288 0.164120 Sb\n0.298366 0.636712 0.664120 Sb\n0.836091 0.500830 0.580811 C\n0.663909 0.499170 0.080811 C\n0.336091 0.999170 0.419189 C\n0.163909 0.000830 0.919189 C\n0.985660 0.574297 0.614858 C\n0.514340 0.425703 0.114858 C\n0.485660 0.925703 0.385142 C\n0.014340 0.074297 0.885142 C\n0.726061 0.142741 0.637461 C\n0.773939 0.857259 0.137461 C\n0.226061 0.357259 0.362539 C\n0.273939 0.642741 0.862539 C\n0.759735 0.092687 0.708944 C\n0.740265 0.907313 0.208944 C\n0.259735 0.407313 0.291056 C\n0.240265 0.592687 0.791056 C\n0.395490 0.400413 0.641806 O\n0.104510 0.599587 0.141806 O\n0.895490 0.099587 0.358194 O\n0.604510 0.900413 0.858194 O\n",
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},
{
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{
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