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{
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"results": [
{
"id": "mp-768027",
"created_at": "2022-09-04T14:39:21.712404Z",
"structure_string": "Na8 Mn4 P4 C4 O28\n1.0\n5.245502 0.000000 0.000000\n0.248928 8.979630 0.000000\n0.048056 0.037790 13.360435\nNa Mn P C O\n8 4 4 4 28\ndirect\n0.758957 0.749896 0.230562 Na\n0.755886 0.761641 0.505086 Na\n0.760110 0.750536 0.747609 Na\n0.241744 0.239957 0.254403 Na\n0.239890 0.238731 0.497824 Na\n0.248557 0.248196 0.749625 Na\n0.248970 0.251811 0.998543 Na\n0.771735 0.065003 0.888062 Na\n0.216035 0.648482 0.374503 Mn\n0.223270 0.647019 0.879145 Mn\n0.784280 0.352196 0.125792 Mn\n0.772441 0.355940 0.625575 Mn\n0.288171 0.576670 0.121496 P\n0.292346 0.578722 0.629669 P\n0.713757 0.425195 0.377436 P\n0.700635 0.420484 0.872209 P\n0.270632 0.919870 0.374187 C\n0.280173 0.934390 0.871373 C\n0.723768 0.074027 0.624782 C\n0.731229 0.080804 0.126680 C\n0.712144 0.944634 0.125774 O\n0.737035 0.934248 0.628309 O\n0.051388 0.850775 0.374650 O\n0.071951 0.855332 0.874608 O\n0.494497 0.865116 0.865835 O\n0.466441 0.825331 0.373071 O\n0.234878 0.665159 0.024716 O\n0.213540 0.672046 0.212670 O\n0.217457 0.673748 0.538408 O\n0.226822 0.666201 0.727028 O\n0.579535 0.534072 0.129098 O\n0.593087 0.550001 0.627798 O\n0.850240 0.577156 0.375757 O\n0.840092 0.566754 0.868402 O\n0.141515 0.427077 0.122256 O\n0.163250 0.425629 0.628227 O\n0.416254 0.458989 0.375683 O\n0.401375 0.451187 0.876629 O\n0.789840 0.328378 0.287549 O\n0.778912 0.337143 0.474204 O\n0.753574 0.320952 0.777715 O\n0.773728 0.318283 0.961711 O\n0.536595 0.178813 0.126980 O\n0.516134 0.155190 0.622263 O\n0.952239 0.150144 0.124347 O\n0.935609 0.153170 0.625400 O\n0.284755 0.058371 0.374961 O\n0.254538 0.078089 0.875349 O\n",
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"formula_full": "Na8 Mn4 P4 C4 O28",
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},
{
"id": "mp-1174052",
"created_at": "2022-09-04T14:39:21.801319Z",
"structure_string": "Li6 Mn2 Co2 O10\n1.0\n5.018660 0.000000 0.000000\n-1.707591 5.639188 0.000000\n-0.853603 -1.869033 6.275713\nLi Mn Co O\n6 2 2 10\ndirect\n0.194278 0.898210 0.404410 Li\n0.999337 0.497472 0.994331 Li\n0.402762 0.302806 0.795108 Li\n0.605284 0.697227 0.205111 Li\n0.794202 0.103103 0.597506 Li\n0.797539 0.597849 0.600431 Li\n0.999446 0.997284 0.996179 Mn\n0.396861 0.795523 0.794907 Mn\n0.614114 0.218421 0.211931 Co\n0.211342 0.402207 0.410201 Co\n0.295235 0.864656 0.080034 O\n0.124563 0.472651 0.703524 O\n0.483111 0.250973 0.485399 O\n0.698706 0.680077 0.902843 O\n0.900854 0.049540 0.279435 O\n0.113754 0.946533 0.725546 O\n0.896540 0.524425 0.293624 O\n0.286770 0.326336 0.101152 O\n0.481511 0.750257 0.518039 O\n0.703791 0.124450 0.900288 O\n",
"nsites": 20,
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"elements": [
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"density_atomic": 0.11260627013168793,
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"formula_full": "Li6 Mn2 Co2 O10",
"formula_reduced": "Li3MnCoO5",
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},
{
"id": "mp-850907",
"created_at": "2022-09-04T14:39:21.728725Z",
"structure_string": "Li4 Mn8 B8 O24\n1.0\n5.791399 0.000000 0.000000\n1.531159 9.674713 0.000000\n1.679964 3.884772 8.845677\nLi Mn B O\n4 8 8 24\ndirect\n0.937982 0.197683 0.537372 Li\n0.559961 0.805262 0.974704 Li\n0.060743 0.299099 0.969023 Li\n0.057984 0.805975 0.468484 Li\n0.827073 0.613292 0.809952 Mn\n0.656964 0.393864 0.692155 Mn\n0.670637 0.881450 0.200601 Mn\n0.817395 0.123869 0.307117 Mn\n0.179369 0.872121 0.705932 Mn\n0.336612 0.120030 0.799363 Mn\n0.339664 0.599990 0.318419 Mn\n0.178978 0.386854 0.191041 Mn\n0.669781 0.951628 0.635578 B\n0.836198 0.045248 0.859787 B\n0.845149 0.535311 0.369237 B\n0.667111 0.462391 0.126770 B\n0.332829 0.538433 0.866141 B\n0.155857 0.462832 0.635641 B\n0.164282 0.957528 0.132553 B\n0.324891 0.046812 0.370719 B\n0.815893 0.912820 0.979549 O\n0.969621 0.440045 0.753655 O\n0.980191 0.942114 0.252519 O\n0.839938 0.832808 0.645792 O\n0.839535 0.402145 0.490596 O\n0.487572 0.933252 0.756097 O\n0.840373 0.342959 0.137443 O\n0.649901 0.159343 0.821426 O\n0.651225 0.644826 0.337114 O\n0.536700 0.576461 0.762201 O\n0.686871 0.090654 0.518033 O\n0.673238 0.600771 0.007830 O\n0.318201 0.401003 0.980209 O\n0.305594 0.911112 0.486418 O\n0.484754 0.442429 0.243836 O\n0.332739 0.346262 0.657297 O\n0.340132 0.838596 0.151138 O\n0.139550 0.647924 0.835892 O\n0.529372 0.075983 0.266013 O\n0.166325 0.598230 0.512356 O\n0.131835 0.161368 0.344917 O\n0.041442 0.074342 0.749694 O\n0.048838 0.567699 0.263768 O\n0.168395 0.091183 0.006881 O\n",
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"B",
"O"
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"density_atomic": 0.08877690945445911,
"volume": 495.6243720397946,
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"formula_full": "Li4 Mn8 B8 O24",
"formula_reduced": "LiMn2(BO3)2",
"formula_anonymous": "AB2C2D6",
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{
"id": "mp-677069",
"created_at": "2022-09-04T14:39:21.735897Z",
"structure_string": "Tl3 V24 S32\n1.0\n9.180827 0.000000 0.000000\n-1.253163 9.331853 0.000000\n-1.288905 -0.735204 11.961421\nTl V S\n3 24 32\ndirect\n0.953725 0.948168 0.070827 Tl\n0.541381 0.565669 0.435593 Tl\n0.309368 0.295224 0.688650 Tl\n0.333938 0.944878 0.002696 V\n0.102044 0.639526 0.968608 V\n0.401165 0.378331 0.025686 V\n0.374860 0.319593 0.246570 V\n0.764668 0.058149 0.287624 V\n0.397293 0.861321 0.258225 V\n0.065166 0.658962 0.255003 V\n0.730803 0.417353 0.176943 V\n0.107600 0.213867 0.269538 V\n0.143787 0.093266 0.460063 V\n0.535158 0.857817 0.577902 V\n0.122252 0.551931 0.469208 V\n0.814205 0.385205 0.483086 V\n0.528088 0.125045 0.485938 V\n0.923336 0.853876 0.515055 V\n0.851809 0.941165 0.755956 V\n0.140210 0.609211 0.767618 V\n0.866291 0.247397 0.701375 V\n0.636596 0.250879 0.829195 V\n0.303907 0.852111 0.735894 V\n0.668725 0.606857 0.766041 V\n0.585754 0.663031 0.008354 V\n0.961155 0.385756 0.008180 V\n0.654940 0.028784 0.958274 V\n0.875083 0.601305 0.086411 S\n0.270808 0.170398 0.087213 S\n0.571089 0.907331 0.118791 S\n0.152026 0.441325 0.185428 S\n0.610288 0.257176 0.028708 S\n0.196319 0.793034 0.125168 S\n0.512470 0.541057 0.170777 S\n0.885263 0.230489 0.160351 S\n0.625279 0.271058 0.329592 S\n0.981049 0.912937 0.333133 S\n0.281985 0.709537 0.381231 S\n0.939237 0.210853 0.408722 S\n0.316365 0.079801 0.322864 S\n0.889172 0.579969 0.378371 S\n0.258281 0.349189 0.425082 S\n0.610992 0.921376 0.403511 S\n0.333405 0.999514 0.574849 S\n0.754380 0.748264 0.623619 S\n0.034436 0.424271 0.621935 S\n0.107016 0.739668 0.604590 S\n0.658332 0.072013 0.672637 S\n0.659459 0.376499 0.634916 S\n0.002514 0.068113 0.631023 S\n0.424988 0.663547 0.669919 S\n0.079842 0.842836 0.846685 S\n0.528413 0.458152 0.874288 S\n0.866146 0.170598 0.886754 S\n0.345556 0.714987 0.909275 S\n0.901025 0.520514 0.835066 S\n0.436604 0.053070 0.849169 S\n0.709052 0.812250 0.884466 S\n0.177395 0.417999 0.914853 S\n",
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{
"id": "mp-1237644",
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"structure_string": "Sc4 W10 Se6 O24\n1.0\n7.545462 0.000000 0.000000\n0.493953 10.281709 0.000000\n3.090280 0.752682 10.433463\nSc W Se O\n4 10 6 24\ndirect\n0.690961 0.436085 0.724220 Sc\n0.397044 0.236821 0.396392 Sc\n0.367941 0.773362 0.410198 Sc\n0.085231 0.073908 0.025827 Sc\n0.772904 0.822224 0.873007 W\n0.188266 0.960138 0.762945 W\n0.118162 0.631369 0.897858 W\n0.677247 0.516647 0.982862 W\n0.001087 0.909796 0.533727 W\n0.015189 0.359899 0.827630 W\n0.739751 0.638881 0.218190 W\n0.968312 0.213329 0.564839 W\n0.838305 0.345618 0.182699 W\n0.726419 0.106090 0.933533 W\n0.355126 0.298963 0.069743 Se\n0.447842 0.185611 0.716456 Se\n0.530552 0.762707 0.680613 Se\n0.240873 0.772227 0.118335 Se\n0.703383 0.980006 0.281116 Se\n0.129183 0.504559 0.468370 Se\n0.098257 0.908999 0.143733 O\n0.604405 0.303653 0.018515 O\n0.347048 0.142080 0.020502 O\n0.182290 0.643648 0.527915 O\n0.196645 0.179713 0.764533 O\n0.999991 0.080253 0.439181 O\n0.488425 0.048718 0.339130 O\n0.311751 0.275539 0.231883 O\n0.252382 0.748911 0.747426 O\n0.595492 0.602899 0.656291 O\n0.505530 0.206096 0.552429 O\n0.237407 0.723666 0.273519 O\n0.340880 0.428891 0.440220 O\n0.814639 0.475392 0.307488 O\n0.827243 0.809135 0.682972 O\n0.816339 0.244170 0.765846 O\n0.994736 0.420081 0.622342 O\n0.612223 0.830367 0.258763 O\n0.682782 0.708926 0.037288 O\n0.443888 0.346578 0.760188 O\n0.992883 0.264819 0.014193 O\n0.535276 0.813571 0.525547 O\n0.780401 0.047278 0.121179 O\n0.081110 0.658576 0.093658 O\n",
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{
"id": "mp-1236388",
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"structure_string": "Li1 Al2 H4 Pb2 O4 F6\n1.0\n7.676855 -0.147310 -2.482415\n-2.516948 6.764619 0.015866\n-0.560955 -0.086411 4.790047\nLi Al H Pb O F\n1 2 4 2 4 6\ndirect\n0.445818 0.968138 0.903619 Li\n0.165298 0.681275 0.189295 Al\n0.830375 0.314083 0.805349 Al\n0.155657 0.490276 0.739376 H\n0.843120 0.505083 0.258787 H\n0.101433 0.858714 0.731355 H\n0.883384 0.134757 0.261254 H\n0.737777 0.788487 0.732298 Pb\n0.259091 0.221999 0.253489 Pb\n0.100673 0.466779 0.891339 O\n0.899765 0.530324 0.108452 O\n0.077631 0.860214 0.915905 O\n0.918332 0.138221 0.086143 O\n0.215571 0.865699 0.503212 F\n0.794681 0.129976 0.511699 F\n0.271329 0.544417 0.499774 F\n0.733541 0.456936 0.499525 F\n0.406913 0.810040 0.197471 F\n0.586694 0.188287 0.786660 F\n",
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{
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"structure_string": "V3 Cr3 Te2 O16\n1.0\n5.983502 0.000000 0.000000\n-2.979704 5.222723 0.000000\n-0.144304 -0.128427 9.245465\nV Cr Te O\n3 3 2 16\ndirect\n0.661007 0.829764 0.223739 V\n0.834291 0.663945 0.715065 V\n0.823960 0.170681 0.716815 V\n0.173345 0.831326 0.207657 Cr\n0.173103 0.341516 0.207842 Cr\n0.340787 0.173672 0.705178 Cr\n0.326112 0.663963 0.489425 Te\n0.661053 0.330403 0.991360 Te\n0.172142 0.829130 0.594702 O\n0.046588 0.524736 0.338786 O\n0.355749 0.677124 0.109045 O\n0.990959 0.996127 0.298412 O\n0.998734 0.014219 0.796244 O\n0.167717 0.345323 0.593172 O\n0.480439 0.954809 0.346627 O\n0.483244 0.524724 0.347564 O\n0.341425 0.168942 0.095588 O\n0.648219 0.824701 0.597924 O\n0.519047 0.473167 0.844382 O\n0.524146 0.044020 0.841523 O\n0.679023 0.329040 0.607365 O\n0.822684 0.650416 0.098855 O\n0.953970 0.468934 0.849443 O\n0.822257 0.169524 0.099006 O\n",
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{
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{
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{
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}