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{
"id": "mp-849992",
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"structure_string": "La20 Cu9 O40\n1.0\n8.943503 0.000000 0.000000\n-2.456521 10.070226 0.000000\n-3.936002 -3.051244 10.572956\nLa Cu O\n20 9 40\ndirect\n0.276698 0.786069 0.712700 La\n0.079410 0.386321 0.911029 La\n0.122208 0.014344 0.888838 La\n0.326409 0.417748 0.681155 La\n0.920590 0.613679 0.088971 La\n0.703385 0.702712 0.770896 La\n0.509994 0.310200 0.980074 La\n0.120060 0.509760 0.383524 La\n0.908507 0.110202 0.579665 La\n0.311758 0.911248 0.181277 La\n0.490006 0.689800 0.019926 La\n0.296615 0.297288 0.229104 La\n0.091493 0.889798 0.420335 La\n0.879940 0.490240 0.616476 La\n0.688242 0.088752 0.818723 La\n0.673591 0.582252 0.318845 La\n0.480013 0.196104 0.511476 La\n0.877792 0.985656 0.111162 La\n0.519987 0.803896 0.488524 La\n0.723302 0.213931 0.287300 La\n0.299451 0.099888 0.698956 Cu\n0.099493 0.699371 0.899761 Cu\n0.900914 0.800537 0.599927 Cu\n0.299263 0.600224 0.199820 Cu\n0.700737 0.399776 0.800180 Cu\n0.099086 0.199463 0.400073 Cu\n0.500000 0.000000 0.000000 Cu\n0.900507 0.300629 0.100239 Cu\n0.700549 0.900112 0.301044 Cu\n0.092832 0.955199 0.654042 O\n0.994102 0.756287 0.753559 O\n0.188213 0.545250 0.774899 O\n0.985361 0.144775 0.973316 O\n0.410020 0.656895 0.627180 O\n0.211760 0.252474 0.825787 O\n0.014639 0.855225 0.026684 O\n0.105097 0.444372 0.145593 O\n0.404461 0.044010 0.845642 O\n0.005898 0.243713 0.246441 O\n0.205418 0.643485 0.046976 O\n0.607371 0.443560 0.650211 O\n0.907168 0.044801 0.345958 O\n0.304410 0.844113 0.945356 O\n0.504733 0.245093 0.745051 O\n0.765856 0.941144 0.695650 O\n0.365849 0.140284 0.095535 O\n0.963329 0.339954 0.495845 O\n0.566149 0.540448 0.896620 O\n0.164655 0.741163 0.294158 O\n0.036671 0.660046 0.504155 O\n0.433851 0.459552 0.103380 O\n0.835345 0.258837 0.705842 O\n0.234144 0.058856 0.304350 O\n0.634151 0.859716 0.904465 O\n0.894903 0.555628 0.854407 O\n0.495267 0.754907 0.254949 O\n0.695590 0.155887 0.054644 O\n0.392629 0.556440 0.349789 O\n0.595539 0.955990 0.154358 O\n0.289090 0.350625 0.451584 O\n0.195252 0.157065 0.553685 O\n0.794582 0.356515 0.953024 O\n0.788240 0.747526 0.174213 O\n0.385908 0.943182 0.574608 O\n0.589980 0.343105 0.372820 O\n0.811787 0.454750 0.225101 O\n0.614092 0.056818 0.425392 O\n0.710910 0.649375 0.548416 O\n0.804748 0.842935 0.446315 O\n",
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{
"id": "mp-849993",
"created_at": "2022-09-04T14:45:53.249602Z",
"structure_string": "Ni8 S16 O64\n1.0\n8.717264 0.000000 0.000000\n0.000000 8.867447 0.000000\n0.000000 0.000000 13.198095\nNi S O\n8 16 64\ndirect\n0.896314 0.859487 0.123729 Ni\n0.603686 0.859487 0.623729 Ni\n0.396314 0.640513 0.123729 Ni\n0.103686 0.640513 0.623729 Ni\n0.896314 0.359487 0.376271 Ni\n0.603686 0.359487 0.876271 Ni\n0.396314 0.140513 0.376271 Ni\n0.103686 0.140513 0.876271 Ni\n0.565693 0.926328 0.221583 S\n0.934307 0.926328 0.721583 S\n0.311164 0.842256 0.489883 S\n0.188836 0.842256 0.989883 S\n0.811164 0.657744 0.489883 S\n0.688836 0.657744 0.989883 S\n0.065693 0.573672 0.221583 S\n0.434307 0.573672 0.721583 S\n0.565693 0.426328 0.278417 S\n0.934307 0.426328 0.778417 S\n0.311164 0.342256 0.010117 S\n0.188836 0.342256 0.510117 S\n0.811164 0.157744 0.010117 S\n0.688836 0.157744 0.510117 S\n0.434307 0.073672 0.778417 S\n0.065693 0.073672 0.278417 S\n0.294770 0.009978 0.475958 O\n0.205230 0.009978 0.975958 O\n0.004703 0.979348 0.355927 O\n0.495297 0.979348 0.855927 O\n0.530178 0.977526 0.329879 O\n0.969822 0.977526 0.829879 O\n0.739653 0.919433 0.224801 O\n0.760347 0.919433 0.724801 O\n0.278259 0.814664 0.086042 O\n0.221741 0.814664 0.586042 O\n0.023619 0.800565 0.013933 O\n0.476381 0.800565 0.513933 O\n0.994749 0.765374 0.720812 O\n0.505251 0.765374 0.220812 O\n0.267507 0.755560 0.403548 O\n0.232493 0.755560 0.903548 O\n0.767507 0.744440 0.403548 O\n0.732493 0.744440 0.903548 O\n0.005251 0.734626 0.220812 O\n0.494749 0.734626 0.720812 O\n0.976381 0.699435 0.513933 O\n0.523619 0.699435 0.013933 O\n0.778259 0.685336 0.086042 O\n0.721741 0.685336 0.586042 O\n0.239653 0.580567 0.224801 O\n0.260347 0.580567 0.724801 O\n0.469822 0.522474 0.829879 O\n0.030178 0.522474 0.329879 O\n0.504703 0.520652 0.355927 O\n0.995297 0.520652 0.855927 O\n0.794770 0.490022 0.475958 O\n0.705230 0.490022 0.975958 O\n0.294770 0.509978 0.024042 O\n0.205230 0.509978 0.524042 O\n0.495297 0.479348 0.644073 O\n0.004703 0.479348 0.144073 O\n0.530178 0.477526 0.170121 O\n0.969822 0.477526 0.670121 O\n0.739653 0.419433 0.275199 O\n0.760347 0.419433 0.775199 O\n0.278259 0.314664 0.413958 O\n0.221741 0.314664 0.913958 O\n0.476381 0.300565 0.986067 O\n0.023619 0.300565 0.486067 O\n0.505251 0.265374 0.279188 O\n0.994749 0.265374 0.779188 O\n0.267507 0.255560 0.096452 O\n0.232493 0.255560 0.596452 O\n0.767507 0.244440 0.096452 O\n0.732493 0.244440 0.596452 O\n0.494749 0.234626 0.779188 O\n0.005251 0.234626 0.279188 O\n0.523619 0.199435 0.486067 O\n0.976381 0.199435 0.986067 O\n0.778259 0.185336 0.413958 O\n0.721741 0.185336 0.913958 O\n0.260347 0.080567 0.775199 O\n0.239653 0.080567 0.275199 O\n0.469822 0.022474 0.670121 O\n0.030178 0.022474 0.170121 O\n0.995297 0.020652 0.644073 O\n0.504703 0.020652 0.144073 O\n0.794770 0.990022 0.024042 O\n0.705230 0.990022 0.524042 O\n",
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"elements": [
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{
"id": "mp-849995",
"created_at": "2022-09-04T14:43:11.319082Z",
"structure_string": "Li7 Sc9 Fe1 Si20 O60\n1.0\n9.047035 0.000000 0.000000\n-4.522776 10.217980 0.000000\n-0.004826 -3.568201 12.389459\nLi Sc Fe Si O\n7 9 1 20 60\ndirect\n0.701098 0.899677 0.051071 Li\n0.499323 0.500421 0.250664 Li\n0.298788 0.101546 0.450576 Li\n0.693528 0.899605 0.549731 Li\n0.096797 0.698371 0.648035 Li\n0.899809 0.300904 0.849929 Li\n0.299742 0.101183 0.951131 Li\n0.058231 0.894944 0.052076 Sc\n0.748952 0.698750 0.151695 Sc\n0.861761 0.500268 0.250836 Sc\n0.549896 0.302551 0.350583 Sc\n0.659850 0.103190 0.448356 Sc\n0.455714 0.697022 0.651420 Sc\n0.146510 0.499781 0.750102 Sc\n0.262028 0.304417 0.847801 Sc\n0.945708 0.098920 0.948796 Sc\n0.348789 0.899757 0.549377 Fe\n0.597981 0.369636 0.016695 Si\n0.127668 0.426396 0.080753 Si\n0.672898 0.171670 0.116763 Si\n0.200043 0.227508 0.183013 Si\n0.932446 0.025906 0.282779 Si\n0.400966 0.973800 0.219462 Si\n0.470378 0.772404 0.317973 Si\n0.004588 0.827029 0.386013 Si\n0.199481 0.577228 0.418125 Si\n0.728185 0.630859 0.484498 Si\n0.268398 0.372324 0.516204 Si\n0.796322 0.428215 0.583967 Si\n0.997996 0.170229 0.616182 Si\n0.522883 0.222517 0.681313 Si\n0.600558 0.027497 0.781045 Si\n0.079961 0.973250 0.714702 Si\n0.806182 0.773838 0.817211 Si\n0.327808 0.829624 0.882452 Si\n0.867549 0.569220 0.915238 Si\n0.398702 0.630267 0.984548 Si\n0.619312 0.232672 0.026116 O\n0.139526 0.110491 0.065100 O\n0.805625 0.114248 0.070138 O\n0.588004 0.685344 0.031844 O\n0.917979 0.687746 0.031117 O\n0.285378 0.563752 0.073841 O\n0.516162 0.035272 0.129529 O\n0.979375 0.464267 0.122604 O\n0.658092 0.487616 0.134292 O\n0.179846 0.363641 0.170177 O\n0.390057 0.285667 0.229581 O\n0.875888 0.908864 0.164970 O\n0.720658 0.290489 0.232251 O\n0.214829 0.934177 0.178314 O\n0.085743 0.163224 0.271832 O\n0.423281 0.838674 0.229869 O\n0.782337 0.059720 0.326510 O\n0.932266 0.709809 0.269913 O\n0.463768 0.091141 0.337355 O\n0.608238 0.720196 0.274210 O\n0.314285 0.634120 0.326432 O\n0.670420 0.514028 0.366623 O\n0.012681 0.537853 0.379015 O\n0.994038 0.967499 0.372612 O\n0.225229 0.443907 0.430095 O\n0.730253 0.310365 0.467524 O\n0.401425 0.315147 0.469939 O\n0.195311 0.884064 0.432685 O\n0.521285 0.888222 0.437302 O\n0.888600 0.767747 0.476439 O\n0.111099 0.236018 0.527462 O\n0.467794 0.102621 0.564247 O\n0.807534 0.111018 0.570728 O\n0.595655 0.688705 0.529881 O\n0.264715 0.696996 0.535457 O\n0.775324 0.564613 0.573036 O\n0.023368 0.035151 0.626845 O\n0.986625 0.485416 0.629917 O\n0.319454 0.490263 0.632821 O\n0.682012 0.356157 0.670139 O\n0.375252 0.262796 0.719637 O\n0.534210 0.911367 0.662097 O\n0.057304 0.287688 0.733899 O\n0.211787 0.914915 0.666593 O\n0.579103 0.164851 0.773260 O\n0.927379 0.834316 0.728545 O\n0.790786 0.080275 0.824661 O\n0.269575 0.711647 0.764767 O\n0.133862 0.088996 0.833037 O\n0.622394 0.741085 0.773793 O\n0.822082 0.635256 0.825211 O\n0.330568 0.511869 0.868369 O\n0.002784 0.514219 0.870197 O\n0.485851 0.963758 0.869662 O\n0.712010 0.432971 0.927339 O\n0.073780 0.309253 0.962595 O\n0.408380 0.314351 0.970816 O\n0.195387 0.886306 0.928707 O\n0.866696 0.889987 0.935585 O\n0.379902 0.766450 0.971350 O\n",
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{
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"structure_string": "Li12 Mn8 P16 O56\n1.0\n9.848638 0.000000 0.000000\n-0.100418 -9.869706 0.000000\n-2.554470 0.006811 -11.049411\nLi Mn P O\n12 8 16 56\ndirect\n0.884346 0.711706 0.549106 Li\n0.911047 0.107567 0.973877 Li\n0.588528 0.610183 0.027132 Li\n0.663559 0.919719 0.540702 Li\n0.622471 0.225640 0.449513 Li\n0.340004 0.066113 0.462716 Li\n0.414128 0.393575 0.969785 Li\n0.147824 0.588063 0.044669 Li\n0.351654 0.089911 0.956465 Li\n0.086423 0.893859 0.029598 Li\n0.174019 0.581559 0.545932 Li\n0.106696 0.280067 0.448905 Li\n0.795687 0.919496 0.322505 Mn\n0.743359 0.213811 0.174914 Mn\n0.755254 0.713893 0.825141 Mn\n0.705013 0.426685 0.672574 Mn\n0.295308 0.578388 0.326017 Mn\n0.240669 0.285137 0.173673 Mn\n0.260345 0.782820 0.825477 Mn\n0.202925 0.074717 0.673736 Mn\n0.974471 0.451604 0.246427 P\n0.880743 0.708498 0.110558 P\n0.940286 0.929477 0.758395 P\n0.876355 0.149896 0.575439 P\n0.620768 0.644077 0.427259 P\n0.559508 0.430663 0.241079 P\n0.476817 0.050724 0.240324 P\n0.620962 0.211413 0.887843 P\n0.383541 0.793781 0.109338 P\n0.525740 0.950078 0.753812 P\n0.438681 0.570204 0.757536 P\n0.379099 0.351132 0.575642 P\n0.121159 0.849375 0.424068 P\n0.060974 0.068975 0.244133 P\n0.117309 0.292852 0.889609 P\n0.025558 0.549210 0.759262 P\n0.984977 0.421749 0.377324 O\n0.968888 0.837536 0.438658 O\n0.914793 0.087268 0.270242 O\n0.889992 0.348851 0.155713 O\n0.898589 0.594371 0.216931 O\n0.825973 0.829414 0.166967 O\n0.771989 0.651192 0.999803 O\n0.980675 0.266118 0.920858 O\n0.884857 0.074315 0.704587 O\n0.936176 0.933154 0.890738 O\n0.871731 0.542597 0.779686 O\n0.806544 0.283637 0.586459 O\n0.833033 0.821418 0.691373 O\n0.778624 0.060343 0.479799 O\n0.716399 0.569067 0.531983 O\n0.655513 0.313749 0.299619 O\n0.684566 0.785465 0.418005 O\n0.630370 0.043562 0.219252 O\n0.627057 0.570345 0.301577 O\n0.559407 0.440559 0.108861 O\n0.520446 0.768876 0.078980 O\n0.729060 0.157156 0.999445 O\n0.676320 0.331841 0.827622 O\n0.602560 0.094394 0.785116 O\n0.583397 0.589893 0.729278 O\n0.609123 0.846925 0.843126 O\n0.478129 0.088738 0.370386 O\n0.530286 0.344569 0.559094 O\n0.467155 0.650589 0.433251 O\n0.519415 0.928430 0.621959 O\n0.389288 0.141137 0.143092 O\n0.413141 0.416858 0.270750 O\n0.409280 0.901769 0.222570 O\n0.311880 0.673547 0.158168 O\n0.277796 0.863588 0.002198 O\n0.481252 0.228399 0.920629 O\n0.438368 0.563573 0.890636 O\n0.383670 0.420795 0.704529 O\n0.377324 0.961413 0.784968 O\n0.317826 0.209099 0.582000 O\n0.328589 0.671774 0.693228 O\n0.279239 0.435678 0.480611 O\n0.212937 0.939639 0.518323 O\n0.165844 0.175268 0.313314 O\n0.178274 0.707038 0.411035 O\n0.124805 0.468102 0.215320 O\n0.065811 0.066654 0.111644 O\n0.116286 0.921206 0.294354 O\n0.020864 0.725854 0.078162 O\n0.223363 0.364747 0.995723 O\n0.188460 0.173303 0.841233 O\n0.091059 0.400864 0.776089 O\n0.112656 0.640276 0.859258 O\n0.085341 0.909006 0.732001 O\n0.026327 0.162028 0.559862 O\n0.028461 0.591482 0.631996 O\n",
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"formula_full": "Li12 Mn8 P16 O56",
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{
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},
{
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}
]
}