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{
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"structure_string": "Li20 Ge2 P4 Se24\n1.0\n9.287435 0.000000 0.000000\n0.000000 9.287435 0.000000\n0.000000 0.000000 13.368956\nLi Ge P Se\n20 2 4 24\ndirect\n0.230281 0.273591 0.294890 Li\n0.769719 0.726409 0.294890 Li\n0.273591 0.769719 0.794890 Li\n0.726409 0.230281 0.794890 Li\n0.230281 0.726409 0.294890 Li\n0.769719 0.273591 0.294890 Li\n0.273591 0.230281 0.794890 Li\n0.726409 0.769719 0.794890 Li\n0.000000 0.000000 0.941117 Li\n0.000000 0.000000 0.441117 Li\n0.500000 0.500000 0.546868 Li\n0.500000 0.500000 0.046868 Li\n0.258940 0.726181 0.035718 Li\n0.741060 0.273819 0.035718 Li\n0.273819 0.258940 0.535718 Li\n0.726181 0.741060 0.535718 Li\n0.273819 0.741060 0.535718 Li\n0.726181 0.258940 0.535718 Li\n0.258940 0.273819 0.035718 Li\n0.741060 0.726181 0.035718 Li\n0.500000 0.500000 0.801220 Ge\n0.500000 0.500000 0.301220 Ge\n0.000000 0.000000 0.685374 P\n0.000000 0.000000 0.185374 P\n0.000000 0.500000 0.503824 P\n0.500000 0.000000 0.003824 P\n0.000000 0.699485 0.409448 Se\n0.000000 0.300515 0.409448 Se\n0.300515 0.000000 0.909448 Se\n0.699485 0.000000 0.909448 Se\n0.500000 0.193948 0.101292 Se\n0.500000 0.806052 0.101292 Se\n0.193948 0.500000 0.601292 Se\n0.806052 0.500000 0.601292 Se\n0.000000 0.798289 0.092834 Se\n0.000000 0.201711 0.092834 Se\n0.201711 0.000000 0.592834 Se\n0.798289 0.000000 0.592834 Se\n0.500000 0.285498 0.402976 Se\n0.500000 0.714502 0.402976 Se\n0.285498 0.500000 0.902976 Se\n0.714502 0.500000 0.902976 Se\n0.000000 0.197320 0.779199 Se\n0.000000 0.802680 0.779199 Se\n0.802680 0.000000 0.279199 Se\n0.197320 0.000000 0.279199 Se\n0.500000 0.709756 0.697435 Se\n0.500000 0.290244 0.697435 Se\n0.709756 0.500000 0.197435 Se\n0.290244 0.500000 0.197435 Se\n",
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{
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"spacegroup": 225
},
{
"id": "mp-1078724",
"created_at": "2022-09-04T14:48:15.351358Z",
"structure_string": "Li2 As2 Se4\n1.0\n2.773286 6.256998 0.000000\n-2.773286 6.256998 0.000000\n0.000000 2.193633 5.192219\nLi As Se\n2 2 4\ndirect\n0.738598 0.261282 0.497474 Li\n0.261282 0.738598 0.997474 Li\n0.563094 0.008741 0.163760 As\n0.008741 0.563094 0.663760 As\n0.516426 0.970064 0.762609 Se\n0.970064 0.516426 0.262609 Se\n0.749674 0.229280 0.010866 Se\n0.229280 0.749674 0.510866 Se\n",
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"volume": 180.19538878805483,
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{
"id": "mp-758488",
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"structure_string": "Li2 P6 W4 O26\n1.0\n7.101596 5.420887 0.000000\n-7.101596 5.420887 0.000000\n0.000000 5.218788 7.218190\nLi P W O\n2 6 4 26\ndirect\n0.000000 0.500000 0.500000 Li\n0.500000 0.000000 0.000000 Li\n0.488282 0.511718 0.250000 P\n0.848388 0.260055 0.060325 P\n0.260055 0.848388 0.560325 P\n0.739945 0.151612 0.439675 P\n0.151612 0.739945 0.939675 P\n0.511718 0.488282 0.750000 P\n0.172060 0.338982 0.170921 W\n0.661018 0.827940 0.329079 W\n0.338982 0.172060 0.670921 W\n0.827940 0.661018 0.829079 W\n0.151579 0.599939 0.096890 O\n0.603228 0.501376 0.082290 O\n0.036976 0.299262 0.032902 O\n0.555683 0.709546 0.206559 O\n0.197727 0.143624 0.232239 O\n0.745646 0.070393 0.094199 O\n0.400061 0.848421 0.403110 O\n0.856376 0.802273 0.267761 O\n0.070393 0.745646 0.594199 O\n0.290454 0.444317 0.293441 O\n0.738894 0.261106 0.250000 O\n0.501376 0.603228 0.582290 O\n0.299262 0.036976 0.532902 O\n0.700738 0.963024 0.467098 O\n0.498624 0.396772 0.417710 O\n0.261106 0.738894 0.750000 O\n0.709546 0.555683 0.706559 O\n0.929607 0.254354 0.405801 O\n0.143624 0.197727 0.732239 O\n0.599939 0.151579 0.596890 O\n0.254354 0.929607 0.905801 O\n0.802273 0.856376 0.767761 O\n0.444317 0.290454 0.793441 O\n0.963024 0.700738 0.967098 O\n0.396772 0.498624 0.917710 O\n0.848421 0.400061 0.903110 O\n",
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"formula_full": "Li2 P6 W4 O26",
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},
{
"id": "mp-1096470",
"created_at": "2022-09-04T14:48:15.565282Z",
"structure_string": "Zr2 Pd1 Pt1\n1.0\n-5.004725 5.595588 7.922515\n5.004725 -5.595588 7.922515\n5.004725 5.595588 -7.922515\nZr Pd Pt\n2 1 1\ndirect\n0.000000 0.253307 0.253307 Zr\n0.000000 0.746693 0.746693 Zr\n0.000000 0.000000 0.000000 Pd\n0.000000 0.500000 0.500000 Pt\n",
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{
"id": "mp-780435",
"created_at": "2022-09-04T14:48:16.471277Z",
"structure_string": "Li20 Co8 P12 O48\n1.0\n8.792960 0.000000 0.000000\n0.000000 8.699978 0.000000\n0.000000 0.151293 12.411619\nLi Co P O\n20 8 12 48\ndirect\n0.520744 0.182729 0.100408 Li\n0.093562 0.177998 0.445816 Li\n0.732513 0.107325 0.496962 Li\n0.657094 0.154960 0.724836 Li\n0.770047 0.047551 0.934238 Li\n0.270047 0.952449 0.065762 Li\n0.157094 0.845040 0.275164 Li\n0.232513 0.892675 0.503038 Li\n0.593562 0.822002 0.554184 Li\n0.020744 0.817271 0.899592 Li\n0.987009 0.696148 0.591834 Li\n0.405850 0.674203 0.943985 Li\n0.771636 0.624339 0.006660 Li\n0.681446 0.597046 0.243116 Li\n0.738361 0.550759 0.445975 Li\n0.238361 0.449241 0.554025 Li\n0.181446 0.402954 0.756884 Li\n0.271636 0.375661 0.993340 Li\n0.905850 0.325797 0.056015 Li\n0.487009 0.303852 0.408166 Li\n0.530615 0.991674 0.348780 Co\n0.030615 0.008326 0.651220 Co\n0.450224 0.000609 0.860275 Co\n0.950224 0.999391 0.139725 Co\n0.044693 0.500356 0.351742 Co\n0.544693 0.499644 0.648258 Co\n0.944060 0.505899 0.857843 Co\n0.444060 0.494101 0.142157 Co\n0.247363 0.200570 0.243428 P\n0.393534 0.142561 0.599703 P\n0.100345 0.142606 0.906150 P\n0.893534 0.857439 0.400297 P\n0.600345 0.857394 0.093850 P\n0.747363 0.799430 0.756572 P\n0.247881 0.702634 0.740869 P\n0.399407 0.647807 0.398451 P\n0.107874 0.645582 0.097880 P\n0.899407 0.352193 0.601549 P\n0.607874 0.354418 0.902120 P\n0.747881 0.297366 0.259131 P\n0.861652 0.208210 0.191734 O\n0.863569 0.177654 0.619727 O\n0.680465 0.205760 0.356561 O\n0.589313 0.184029 0.941075 O\n0.373567 0.159891 0.326320 O\n0.226890 0.099601 0.568489 O\n0.421088 0.125097 0.720663 O\n0.975591 0.122269 0.994430 O\n0.258545 0.087807 0.944385 O\n0.179103 0.047987 0.199015 O\n0.047520 0.046176 0.809810 O\n0.510448 0.041820 0.536641 O\n0.010448 0.958180 0.463359 O\n0.547520 0.953824 0.190190 O\n0.679103 0.952013 0.800985 O\n0.758545 0.912193 0.055615 O\n0.921088 0.874903 0.279337 O\n0.475591 0.877731 0.005570 O\n0.726890 0.900399 0.431511 O\n0.873567 0.840109 0.673680 O\n0.180465 0.794240 0.643439 O\n0.363569 0.822346 0.380273 O\n0.089313 0.815971 0.058925 O\n0.361652 0.791790 0.808266 O\n0.628186 0.708424 0.694146 O\n0.918667 0.686665 0.437476 O\n0.613642 0.680649 0.113831 O\n0.815879 0.710359 0.855731 O\n0.119900 0.649940 0.820231 O\n0.266482 0.590058 0.056143 O\n0.519386 0.629301 0.490590 O\n0.108751 0.636343 0.221428 O\n0.248381 0.569057 0.428983 O\n0.317644 0.550582 0.693634 O\n0.473306 0.572575 0.299062 O\n0.980760 0.548262 0.045090 O\n0.480760 0.451738 0.954910 O\n0.973306 0.427425 0.700938 O\n0.817644 0.449418 0.306366 O\n0.748381 0.430943 0.571017 O\n0.019386 0.370699 0.509410 O\n0.608751 0.363657 0.778572 O\n0.766482 0.409942 0.943857 O\n0.619900 0.350060 0.179769 O\n0.418667 0.313335 0.562524 O\n0.315879 0.289641 0.144269 O\n0.113642 0.319351 0.886169 O\n0.128186 0.291576 0.305854 O\n",
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{
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"structure_string": "Cs12 Sn4 Te12\n1.0\n7.395355 8.962940 0.000000\n-7.395355 8.962940 0.000000\n0.000000 1.146431 10.489482\nCs Sn Te\n12 4 12\ndirect\n0.603950 0.396050 0.250000 Cs\n0.396050 0.603950 0.750000 Cs\n0.914245 0.085755 0.250000 Cs\n0.085755 0.914245 0.750000 Cs\n0.786189 0.403134 0.863805 Cs\n0.596866 0.213811 0.636195 Cs\n0.213811 0.596866 0.136195 Cs\n0.403134 0.786189 0.363805 Cs\n0.754883 0.807770 0.685575 Cs\n0.192230 0.245117 0.814425 Cs\n0.245117 0.192230 0.314425 Cs\n0.807770 0.754883 0.185575 Cs\n0.917233 0.434393 0.454790 Sn\n0.565607 0.082767 0.045210 Sn\n0.082767 0.565607 0.545210 Sn\n0.434393 0.917233 0.954790 Sn\n0.047332 0.581116 0.809148 Te\n0.418884 0.952668 0.690852 Te\n0.952668 0.418884 0.190852 Te\n0.581116 0.047332 0.309148 Te\n0.050231 0.789231 0.423191 Te\n0.210769 0.949769 0.076809 Te\n0.949769 0.210769 0.576809 Te\n0.789231 0.050231 0.923191 Te\n0.687955 0.549092 0.522751 Te\n0.450908 0.312045 0.977249 Te\n0.312045 0.450908 0.477249 Te\n0.549092 0.687955 0.022751 Te\n",
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{
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"structure_string": "Bi12 O18\n1.0\n-5.416791 5.416791 5.416791\n5.416791 -5.416791 5.416791\n5.416791 5.416791 -5.416791\nBi O\n12 18\ndirect\n0.085139 0.492249 0.281839 Bi\n0.592890 0.789590 0.507751 Bi\n0.196700 0.407110 0.914861 Bi\n0.803300 0.718161 0.210410 Bi\n0.492249 0.281839 0.085139 Bi\n0.914861 0.196700 0.407110 Bi\n0.407110 0.914861 0.196700 Bi\n0.507751 0.592890 0.789590 Bi\n0.210410 0.803300 0.718161 Bi\n0.281839 0.085139 0.492249 Bi\n0.789590 0.507751 0.592890 Bi\n0.718161 0.210410 0.803300 Bi\n0.231066 0.000000 0.231066 O\n0.401631 0.071648 0.831424 O\n0.071648 0.831424 0.401631 O\n0.768934 0.768934 0.000000 O\n0.768934 0.000000 0.768934 O\n0.928352 0.329983 0.759777 O\n0.000000 0.768934 0.768934 O\n0.670016 0.598369 0.429793 O\n0.570207 0.168576 0.240223 O\n0.429793 0.670016 0.598369 O\n0.598369 0.429793 0.670016 O\n0.240223 0.570207 0.168576 O\n0.231066 0.231066 0.000000 O\n0.000000 0.231066 0.231066 O\n0.329983 0.759777 0.928352 O\n0.831424 0.401631 0.071648 O\n0.759777 0.928352 0.329984 O\n0.168576 0.240223 0.570207 O\n",
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{
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