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{
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{
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"structure_string": "Li8 Mn4 Ni10 O24\n1.0\n2.485590 -4.341973 -0.029877\n7.661239 4.385726 0.000000\n-0.839813 1.467033 9.588702\nLi Mn Ni O\n8 4 10 24\ndirect\n0.246739 0.086359 0.994016 Li\n0.751617 0.075883 0.506683 Li\n0.493820 0.416039 0.751204 Li\n0.751518 0.415872 0.506873 Li\n0.253261 0.586359 0.505984 Li\n0.748383 0.575883 0.993317 Li\n0.006180 0.916039 0.748796 Li\n0.748482 0.915872 0.993127 Li\n0.998966 0.254563 0.747540 Mn\n0.501309 0.250534 0.247265 Mn\n0.998691 0.750534 0.252735 Mn\n0.501034 0.754563 0.752460 Mn\n0.001133 0.079962 0.253518 Ni\n0.497925 0.082834 0.747365 Ni\n0.261022 0.249150 0.504897 Ni\n0.004748 0.418332 0.248697 Ni\n0.743543 0.259333 0.993741 Ni\n0.002075 0.582834 0.752635 Ni\n0.498867 0.579962 0.246482 Ni\n0.238978 0.749150 0.995103 Ni\n0.756457 0.759333 0.506259 Ni\n0.495252 0.918332 0.251303 Ni\n0.140273 0.099766 0.637739 O\n0.388437 0.099362 0.364748 O\n0.368894 0.232284 0.859099 O\n0.130155 0.240077 0.138335 O\n0.617718 0.097184 0.130893 O\n0.857403 0.101036 0.865286 O\n0.121166 0.403791 0.628946 O\n0.646951 0.245807 0.627748 O\n0.386658 0.405842 0.367007 O\n0.868027 0.249119 0.364035 O\n0.624677 0.408709 0.134295 O\n0.878071 0.412469 0.858014 O\n0.111563 0.599362 0.135252 O\n0.359727 0.599766 0.862261 O\n0.131106 0.732284 0.640901 O\n0.642597 0.601036 0.634714 O\n0.369845 0.740077 0.361665 O\n0.882282 0.597184 0.369107 O\n0.113342 0.905842 0.132993 O\n0.853049 0.745807 0.872252 O\n0.631973 0.749119 0.135965 O\n0.378834 0.903791 0.871054 O\n0.621929 0.912469 0.641986 O\n0.875323 0.908709 0.365705 O\n",
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{
"id": "mp-1222620",
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"structure_string": "Li4 Mn1 Co2 Ni1 O8\n1.0\n1.476992 4.947411 0.000000\n-1.476992 4.947411 0.000000\n0.000000 1.851838 9.956909\nLi Mn Co Ni O\n4 1 2 1 8\ndirect\n0.997198 0.997198 0.003683 Li\n0.500180 0.500180 0.246840 Li\n0.996972 0.996972 0.487242 Li\n0.503807 0.503807 0.757908 Li\n0.250253 0.250253 0.624107 Mn\n0.745907 0.745907 0.885756 Co\n0.251858 0.251858 0.134163 Co\n0.752228 0.752228 0.371463 Ni\n0.871145 0.871145 0.183006 O\n0.364549 0.364549 0.451001 O\n0.856346 0.856346 0.685882 O\n0.365106 0.365106 0.937368 O\n0.640339 0.640339 0.570591 O\n0.137643 0.137643 0.803121 O\n0.635049 0.635049 0.054936 O\n0.131421 0.131421 0.302933 O\n",
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"formula_full": "Li4 Mn1 Co2 Ni1 O8",
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{
"id": "mp-1077151",
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{
"id": "mp-1100935",
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"structure_string": "V2 H38 S4 N6 O27\n1.0\n7.246030 0.080512 -0.057653\n0.754557 7.884727 0.085424\n-0.345175 -0.291131 13.603771\nV H S N O\n2 38 4 6 27\ndirect\n0.456189 0.571474 0.767834 V\n0.543811 0.428526 0.232166 V\n0.021994 0.060276 0.896672 H\n0.103847 0.563976 0.001487 H\n0.152772 0.177738 0.682170 H\n0.098297 0.340174 0.267678 H\n0.103819 0.533370 0.284801 H\n0.186446 0.396813 0.432533 H\n0.129542 0.931669 0.812085 H\n0.170785 0.341459 0.747570 H\n0.182845 0.301877 0.547324 H\n0.244707 0.076057 0.876201 H\n0.188176 0.904439 0.936345 H\n0.235958 0.504419 0.540046 H\n0.190343 0.986237 0.358085 H\n0.279965 0.813977 0.420909 H\n0.381375 0.344862 0.501474 H\n0.403367 0.258980 0.077039 H\n0.427629 0.129631 0.167940 H\n0.349095 0.850107 0.300765 H\n0.417745 0.963920 0.396068 H\n0.582255 0.036080 0.603932 H\n0.650905 0.149893 0.699235 H\n0.572371 0.870369 0.832059 H\n0.596633 0.741020 0.922961 H\n0.618625 0.655138 0.498526 H\n0.720035 0.186023 0.579091 H\n0.809657 0.013763 0.641915 H\n0.764042 0.495581 0.459954 H\n0.811824 0.095561 0.063655 H\n0.755293 0.923943 0.123799 H\n0.817155 0.698123 0.452676 H\n0.829215 0.658541 0.252430 H\n0.870458 0.068331 0.187915 H\n0.813554 0.603186 0.567467 H\n0.896181 0.466630 0.715199 H\n0.901703 0.659826 0.732322 H\n0.847228 0.822262 0.317830 H\n0.896153 0.436024 0.998513 H\n0.978006 0.939724 0.103328 H\n0.237751 0.857941 0.624627 S\n0.408812 0.756481 0.101056 S\n0.591188 0.243519 0.898944 S\n0.762249 0.142059 0.375373 S\n0.146337 0.991419 0.879938 N\n0.242982 0.386078 0.505001 N\n0.308107 0.902229 0.369122 N\n0.691893 0.097771 0.630878 N\n0.757018 0.613922 0.494999 N\n0.853663 0.008581 0.120062 N\n0.080395 0.272368 0.715679 O\n0.065283 0.879714 0.681528 O\n0.164415 0.421725 0.305608 O\n0.283787 0.023777 0.588128 O\n0.221260 0.735462 0.541750 O\n0.231402 0.802432 0.044946 O\n0.249051 0.561137 0.811562 O\n0.399157 0.249526 0.150854 O\n0.392868 0.579073 0.139489 O\n0.426779 0.244968 0.960121 O\n0.467331 0.448952 0.667918 O\n0.400230 0.793740 0.692873 O\n0.430338 0.873755 0.185868 O\n0.569662 0.126245 0.814132 O\n0.599770 0.206260 0.307127 O\n0.532669 0.551048 0.332082 O\n0.573221 0.755032 0.039879 O\n0.607132 0.420927 0.860511 O\n0.600843 0.750474 0.849146 O\n0.750949 0.438863 0.188438 O\n0.768598 0.197568 0.955054 O\n0.778740 0.264538 0.458250 O\n0.716213 0.976223 0.411872 O\n0.835585 0.578275 0.694392 O\n0.934717 0.120286 0.318472 O\n0.919605 0.727632 0.284321 O\n0.000000 0.500000 0.000000 O\n",
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{
"id": "mp-757541",
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"structure_string": "Li12 Si12 Bi12 O48\n1.0\n5.966679 0.000000 0.000000\n0.000000 8.948948 0.000000\n0.000000 0.000000 21.120764\nLi Si Bi O\n12 12 12 48\ndirect\n0.918475 0.239002 0.994621 Li\n0.418475 0.760998 0.005379 Li\n0.608620 0.745169 0.169907 Li\n0.929863 0.258610 0.162129 Li\n0.429863 0.758610 0.337871 Li\n0.108620 0.245169 0.330093 Li\n0.918475 0.260998 0.494621 Li\n0.418475 0.739002 0.505379 Li\n0.608620 0.754831 0.669907 Li\n0.929863 0.241390 0.662129 Li\n0.429863 0.741390 0.837871 Li\n0.108620 0.254831 0.830093 Li\n0.976907 0.940576 0.079056 Si\n0.540927 0.444753 0.086717 Si\n0.009267 0.553144 0.248335 Si\n0.509267 0.053144 0.251665 Si\n0.040927 0.944753 0.413283 Si\n0.476907 0.440576 0.420944 Si\n0.976907 0.559424 0.579056 Si\n0.540927 0.055247 0.586717 Si\n0.009267 0.946856 0.748335 Si\n0.509267 0.446856 0.751665 Si\n0.040927 0.555247 0.913283 Si\n0.476907 0.059424 0.920944 Si\n0.057256 0.514840 0.076870 Bi\n0.447047 0.022419 0.093604 Bi\n0.028733 0.981105 0.241335 Bi\n0.528733 0.481105 0.258665 Bi\n0.947047 0.522419 0.406396 Bi\n0.557256 0.014840 0.423130 Bi\n0.057256 0.985160 0.576870 Bi\n0.447047 0.477581 0.593604 Bi\n0.028733 0.518895 0.741335 Bi\n0.528733 0.018895 0.758665 Bi\n0.947047 0.977581 0.906396 Bi\n0.557256 0.485160 0.923130 Bi\n0.458881 0.967496 0.987280 O\n0.958881 0.032504 0.012720 O\n0.529271 0.565299 0.027709 O\n0.775901 0.344579 0.081164 O\n0.314421 0.337986 0.080337 O\n0.204659 0.830932 0.078217 O\n0.743902 0.855151 0.098332 O\n0.047329 0.064797 0.134759 O\n0.529840 0.539559 0.152665 O\n0.037396 0.459999 0.182578 O\n0.442764 0.927530 0.196906 O\n0.284376 0.164489 0.253294 O\n0.740166 0.144220 0.231379 O\n0.784376 0.664489 0.246706 O\n0.240166 0.644220 0.268621 O\n0.942764 0.427530 0.303094 O\n0.537396 0.959999 0.317422 O\n0.029840 0.039559 0.347335 O\n0.547329 0.564797 0.365241 O\n0.243902 0.355151 0.401668 O\n0.704659 0.330932 0.421783 O\n0.814421 0.837986 0.419663 O\n0.275901 0.844579 0.418836 O\n0.029271 0.065299 0.472291 O\n0.458881 0.532504 0.487280 O\n0.958881 0.467496 0.512720 O\n0.529271 0.934701 0.527709 O\n0.775901 0.155421 0.581164 O\n0.314421 0.162014 0.580337 O\n0.204659 0.669068 0.578217 O\n0.743902 0.644849 0.598332 O\n0.047329 0.435203 0.634759 O\n0.529840 0.960441 0.652665 O\n0.037396 0.040001 0.682578 O\n0.442764 0.572470 0.696906 O\n0.740166 0.355780 0.731379 O\n0.284376 0.335511 0.753294 O\n0.240166 0.855780 0.768621 O\n0.784376 0.835511 0.746706 O\n0.942764 0.072470 0.803094 O\n0.537396 0.540001 0.817422 O\n0.029840 0.460441 0.847335 O\n0.547329 0.935203 0.865241 O\n0.243902 0.144849 0.901668 O\n0.704659 0.169068 0.921783 O\n0.814421 0.662014 0.919663 O\n0.275901 0.655421 0.918836 O\n0.029271 0.434701 0.972291 O\n",
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{
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"structure_string": "Ca6 Tb2\n1.0\n3.788980 -6.562706 0.000000\n3.788980 6.562706 0.000000\n0.000000 0.000000 6.251866\nCa Tb\n6 2\ndirect\n0.170311 0.340623 0.250000 Ca\n0.659377 0.829689 0.250000 Ca\n0.170311 0.829689 0.250000 Ca\n0.829689 0.659377 0.750000 Ca\n0.340623 0.170311 0.750000 Ca\n0.829689 0.170311 0.750000 Ca\n0.333333 0.666667 0.750000 Tb\n0.666667 0.333333 0.250000 Tb\n",
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{
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{
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{
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}