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{
"id": "mp-754075",
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"structure_string": "Li2 Hf2 P2 C2 O14\n1.0\n6.599138 0.000000 0.000000\n0.000000 5.548790 0.000000\n0.000000 0.453393 8.831834\nLi Hf P C O\n2 2 2 2 14\ndirect\n0.452644 0.747132 0.836536 Li\n0.952644 0.252868 0.163464 Li\n0.247469 0.203066 0.661553 Hf\n0.747469 0.796934 0.338447 Hf\n0.751295 0.274656 0.558219 P\n0.251295 0.725344 0.441781 P\n0.262255 0.267869 0.947534 C\n0.762255 0.732131 0.052466 C\n0.721448 0.696139 0.919394 O\n0.269347 0.051125 0.887471 O\n0.291077 0.444056 0.839269 O\n0.938033 0.211880 0.657034 O\n0.559722 0.190700 0.643866 O\n0.266079 0.855994 0.593239 O\n0.742783 0.548735 0.517208 O\n0.242783 0.451265 0.482792 O\n0.766079 0.144006 0.406761 O\n0.059722 0.809300 0.356134 O\n0.438033 0.788120 0.342966 O\n0.791077 0.555944 0.160731 O\n0.769347 0.948875 0.112529 O\n0.221448 0.303861 0.080606 O\n",
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{
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"structure_string": "Na2 Sb2 As2 C2 O14\n1.0\n6.917536 0.000000 0.000000\n0.000000 5.674363 0.000000\n0.000000 0.164647 9.402215\nNa Sb As C O\n2 2 2 2 14\ndirect\n0.508645 0.763580 0.791304 Na\n0.008645 0.236420 0.208696 Na\n0.240384 0.206273 0.657356 Sb\n0.740384 0.793727 0.342644 Sb\n0.746797 0.283051 0.571656 As\n0.246797 0.716949 0.428344 As\n0.257258 0.276848 0.925400 C\n0.757258 0.723152 0.074600 C\n0.744254 0.690440 0.946516 O\n0.255543 0.062610 0.864557 O\n0.270291 0.451308 0.825934 O\n0.940373 0.205403 0.679135 O\n0.548428 0.179489 0.665746 O\n0.263606 0.844854 0.594121 O\n0.726572 0.585791 0.541645 O\n0.226572 0.414209 0.458355 O\n0.763606 0.155146 0.405879 O\n0.048428 0.820511 0.334254 O\n0.440373 0.794597 0.320865 O\n0.770291 0.548692 0.174066 O\n0.755543 0.937390 0.135443 O\n0.244254 0.309560 0.053484 O\n",
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{
"id": "mp-770332",
"created_at": "2022-09-04T14:44:50.104709Z",
"structure_string": "Na2 Bi2 C2 S2 O14\n1.0\n7.070633 0.000000 0.000000\n0.000000 5.727116 0.000000\n0.000000 0.086699 9.424288\nNa Bi C S O\n2 2 2 2 14\ndirect\n0.491862 0.246659 0.793847 Na\n0.991862 0.753341 0.206153 Na\n0.763805 0.780148 0.649112 Bi\n0.263805 0.219852 0.350888 Bi\n0.734375 0.721613 0.929168 C\n0.234375 0.278387 0.070832 C\n0.259544 0.721991 0.585445 S\n0.759544 0.278009 0.414555 S\n0.251135 0.305818 0.942266 O\n0.736503 0.932978 0.863853 O\n0.717871 0.543979 0.836860 O\n0.095306 0.789965 0.675122 O\n0.428114 0.842150 0.648293 O\n0.731130 0.196779 0.565194 O\n0.288205 0.465540 0.584993 O\n0.788205 0.534460 0.415007 O\n0.231130 0.803221 0.434806 O\n0.928114 0.157850 0.351707 O\n0.595306 0.210035 0.324878 O\n0.217871 0.456021 0.163140 O\n0.236503 0.067022 0.136147 O\n0.751135 0.694182 0.057734 O\n",
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},
{
"id": "mp-768198",
"created_at": "2022-09-04T14:47:01.370739Z",
"structure_string": "Li2 Ce2 P2 C2 O14\n1.0\n7.000202 0.000000 0.000000\n0.000000 5.226608 0.000000\n0.000000 0.548165 9.123653\nLi Ce P C O\n2 2 2 2 14\ndirect\n0.505406 0.759725 0.802751 Li\n0.005406 0.240275 0.197249 Li\n0.238674 0.219934 0.657497 Ce\n0.738674 0.780066 0.342503 Ce\n0.740613 0.277596 0.580215 P\n0.240613 0.722404 0.419785 P\n0.265025 0.273797 0.950681 C\n0.765025 0.726203 0.049319 C\n0.717457 0.694834 0.921562 O\n0.270800 0.046624 0.891835 O\n0.303698 0.465221 0.851513 O\n0.921922 0.211717 0.670485 O\n0.564361 0.144061 0.651752 O\n0.264624 0.806595 0.580686 O\n0.709573 0.573449 0.566811 O\n0.209573 0.426551 0.433189 O\n0.764624 0.193405 0.419314 O\n0.064361 0.855939 0.348248 O\n0.421922 0.788283 0.329515 O\n0.803698 0.534779 0.148487 O\n0.770800 0.953376 0.108165 O\n0.217457 0.305166 0.078438 O\n",
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"density": 3.0049714988919214,
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"formula_full": "Li2 Ce2 P2 C2 O14",
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{
"id": "mp-779778",
"created_at": "2022-09-04T14:47:00.711802Z",
"structure_string": "Li6 Fe6 P6 C6 O42\n1.0\n5.153347 0.000000 0.000000\n-0.735467 8.361306 0.000000\n-0.025286 -0.082828 19.403035\nLi Fe P C O\n6 6 6 6 42\ndirect\n0.769221 0.892095 0.083549 Li\n0.768835 0.891611 0.417564 Li\n0.244913 0.718939 0.818630 Li\n0.226146 0.108620 0.917384 Li\n0.230899 0.108649 0.250173 Li\n0.232287 0.108611 0.585242 Li\n0.802423 0.663876 0.918962 Fe\n0.803244 0.668003 0.250599 Fe\n0.805652 0.668497 0.584105 Fe\n0.195347 0.333323 0.084077 Fe\n0.199708 0.333503 0.749453 Fe\n0.196489 0.332464 0.416554 Fe\n0.732608 0.575997 0.750548 P\n0.726616 0.577133 0.084085 P\n0.727925 0.577315 0.416891 P\n0.272183 0.423530 0.250159 P\n0.275915 0.425049 0.582024 P\n0.275485 0.420592 0.916779 P\n0.707763 0.957596 0.250264 C\n0.708627 0.956392 0.584459 C\n0.705333 0.954071 0.912940 C\n0.291939 0.042901 0.082865 C\n0.291875 0.042669 0.416517 C\n0.285567 0.043791 0.752435 C\n0.950038 0.926983 0.250466 O\n0.950350 0.924828 0.583426 O\n0.947794 0.924881 0.916665 O\n0.378892 0.907348 0.082596 O\n0.377269 0.906995 0.416776 O\n0.334512 0.900977 0.758690 O\n0.539286 0.831222 0.584700 O\n0.539223 0.831646 0.250589 O\n0.538525 0.826098 0.908966 O\n0.794788 0.687832 0.021238 O\n0.795731 0.691340 0.145633 O\n0.794945 0.689677 0.354929 O\n0.794913 0.690540 0.478914 O\n0.833217 0.681355 0.812691 O\n0.793465 0.678273 0.686529 O\n0.139427 0.578669 0.912175 O\n0.125278 0.575236 0.250356 O\n0.129195 0.576642 0.581445 O\n0.432435 0.521893 0.083884 O\n0.433972 0.520454 0.416682 O\n0.431569 0.532656 0.758855 O\n0.566172 0.479710 0.250021 O\n0.569808 0.479949 0.579780 O\n0.570993 0.474003 0.917753 O\n0.872509 0.425065 0.084361 O\n0.868331 0.419045 0.748654 O\n0.874680 0.425183 0.416548 O\n0.204473 0.310353 0.187980 O\n0.205342 0.310555 0.312024 O\n0.204326 0.309115 0.521115 O\n0.217801 0.317211 0.645721 O\n0.208690 0.307974 0.854788 O\n0.196273 0.314442 0.979369 O\n0.459006 0.169554 0.082641 O\n0.466356 0.161297 0.749140 O\n0.460053 0.168618 0.416541 O\n0.618299 0.089681 0.914975 O\n0.622400 0.093569 0.249753 O\n0.625018 0.092592 0.583859 O\n0.049406 0.072548 0.083313 O\n0.052972 0.091292 0.749017 O\n0.049749 0.073287 0.416192 O\n",
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{
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"structure_string": "K2 Cr2 P2 C2 O14\n1.0\n10.424134 0.004888 -0.125316\n0.003005 6.258439 -0.001274\n0.175755 -0.001011 5.258706\nK Cr P C O\n2 2 2 2 14\ndirect\n0.210302 0.382456 0.235188 K\n0.789692 0.881950 0.764532 K\n0.358098 0.771726 0.780366 Cr\n0.641899 0.270656 0.219771 Cr\n0.442612 0.267369 0.719523 P\n0.557336 0.766824 0.280658 P\n0.132436 0.753223 0.707196 C\n0.867635 0.252885 0.292632 C\n0.982502 0.236941 0.335779 O\n0.185266 0.762505 0.935315 O\n0.226899 0.759595 0.527324 O\n0.351386 0.074232 0.774801 O\n0.353229 0.460936 0.778006 O\n0.440876 0.762902 0.107208 O\n0.482327 0.269153 0.435793 O\n0.517676 0.769334 0.564428 O\n0.559019 0.262545 0.893066 O\n0.646978 0.959879 0.222132 O\n0.648290 0.573146 0.225480 O\n0.773309 0.259111 0.472727 O\n0.814564 0.261633 0.064620 O\n0.017670 0.736696 0.663455 O\n",
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{
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"structure_string": "Li4 Fe4 P4 C4 O28\n1.0\n16.966870 0.101907 0.045512\n0.447549 5.154946 0.005400\n0.017776 0.004785 6.437518\nLi Fe P C O\n4 4 4 4 28\ndirect\n0.057730 0.771734 0.250575 Li\n0.442601 0.223370 0.757366 Li\n0.641224 0.246059 0.452261 Li\n0.944023 0.225911 0.750813 Li\n0.166935 0.801685 0.750031 Fe\n0.333554 0.204775 0.247808 Fe\n0.669088 0.803296 0.757467 Fe\n0.831264 0.197700 0.254078 Fe\n0.212410 0.734158 0.249708 P\n0.287699 0.271016 0.748187 P\n0.711438 0.735216 0.255899 P\n0.788253 0.276332 0.747935 P\n0.021451 0.702553 0.751552 C\n0.477931 0.284934 0.259831 C\n0.524308 0.703853 0.740138 C\n0.978213 0.294270 0.247950 C\n0.033362 0.945807 0.751614 O\n0.044341 0.386820 0.249652 O\n0.085476 0.541305 0.750928 O\n0.155879 0.799222 0.062850 O\n0.155652 0.799625 0.437473 O\n0.213503 0.121365 0.749163 O\n0.239655 0.440598 0.249824 O\n0.259567 0.564127 0.748448 O\n0.285775 0.884676 0.248770 O\n0.343627 0.207368 0.560688 O\n0.343106 0.207514 0.935729 O\n0.420302 0.467910 0.246697 O\n0.458470 0.610192 0.741936 O\n0.453323 0.055082 0.248609 O\n0.535742 0.946379 0.750772 O\n0.548822 0.328293 0.282262 O\n0.588705 0.542117 0.729114 O\n0.662676 0.795767 0.058246 O\n0.658757 0.840753 0.440342 O\n0.710926 0.140089 0.733137 O\n0.732003 0.434928 0.282832 O\n0.763422 0.570944 0.741072 O\n0.789413 0.868156 0.251620 O\n0.846273 0.199122 0.565950 O\n0.838726 0.204183 0.942409 O\n0.914146 0.454480 0.246784 O\n0.955336 0.610263 0.752017 O\n0.966986 0.050537 0.247475 O\n",
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{
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"structure_string": "Li2 Ti2 P2 C2 O14\n1.0\n6.447695 0.000000 0.000000\n0.000000 5.243688 0.000000\n0.000000 1.129391 8.165135\nLi Ti P C O\n2 2 2 2 14\ndirect\n0.250000 0.754670 0.099213 Li\n0.750000 0.245330 0.900787 Li\n0.750000 0.795985 0.315701 Ti\n0.250000 0.204015 0.684299 Ti\n0.250000 0.750644 0.424019 P\n0.750000 0.249356 0.575981 P\n0.750000 0.686305 0.034654 C\n0.250000 0.313695 0.965346 C\n0.750000 0.929838 0.070720 O\n0.250000 0.375428 0.104957 O\n0.750000 0.520129 0.170191 O\n0.060976 0.800843 0.308431 O\n0.439024 0.800843 0.308431 O\n0.750000 0.080761 0.437765 O\n0.250000 0.464991 0.503648 O\n0.750000 0.535009 0.496352 O\n0.250000 0.919239 0.562235 O\n0.939024 0.199157 0.691569 O\n0.560976 0.199157 0.691569 O\n0.250000 0.479871 0.829809 O\n0.750000 0.624572 0.895043 O\n0.250000 0.070162 0.929280 O\n",
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{
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{
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{
"id": "mp-1205217",
"created_at": "2022-09-04T14:46:53.765834Z",
"structure_string": "In4 Mo4 H4 Se4 O28\n1.0\n2.855676 10.408794 0.000000\n-2.855676 10.408794 0.000000\n0.000000 9.498936 10.454176\nIn Mo H Se O\n4 4 4 4 28\ndirect\n0.882761 0.579945 0.405718 In\n0.420055 0.117239 0.094282 In\n0.117239 0.420055 0.594282 In\n0.579945 0.882761 0.905718 In\n0.462863 0.745078 0.700887 Mo\n0.254922 0.537137 0.799113 Mo\n0.537138 0.254922 0.299113 Mo\n0.745078 0.462863 0.200887 Mo\n0.749589 0.202300 0.823969 H\n0.797700 0.250411 0.676031 H\n0.250411 0.797700 0.176031 H\n0.202300 0.749589 0.323969 H\n0.271727 0.969345 0.430328 Se\n0.030655 0.728273 0.069672 Se\n0.728273 0.030655 0.569672 Se\n0.969345 0.271727 0.930328 Se\n0.502922 0.771166 0.502817 O\n0.228834 0.497078 0.997183 O\n0.497078 0.228834 0.497183 O\n0.771166 0.502922 0.002817 O\n0.788150 0.585845 0.598999 O\n0.414155 0.211850 0.901001 O\n0.211850 0.414155 0.401001 O\n0.585845 0.788150 0.098999 O\n0.017447 0.229047 0.491792 O\n0.770953 0.982553 0.008208 O\n0.982553 0.770953 0.508208 O\n0.229047 0.017447 0.991792 O\n0.219773 0.780227 0.750000 O\n0.780227 0.219773 0.250000 O\n0.671547 0.328453 0.750000 O\n0.328453 0.671547 0.250000 O\n0.501443 0.634666 0.848620 O\n0.365334 0.498557 0.651380 O\n0.498557 0.365334 0.151380 O\n0.634666 0.501443 0.348620 O\n0.387149 0.058292 0.281059 O\n0.941708 0.612851 0.218941 O\n0.612851 0.941708 0.718941 O\n0.058292 0.387149 0.781059 O\n0.267757 0.062873 0.661262 O\n0.937127 0.732243 0.838738 O\n0.732243 0.937127 0.338738 O\n0.062873 0.267757 0.161262 O\n",
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"formula_full": "In4 Mo4 H4 Se4 O28",
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{
"id": "mp-768159",
"created_at": "2022-09-04T14:46:37.156107Z",
"structure_string": "Li2 Sn2 P2 C2 O14\n1.0\n6.548304 0.000000 0.000000\n0.000000 5.234350 0.000000\n0.000000 0.615862 8.935639\nLi Sn P C O\n2 2 2 2 14\ndirect\n0.468759 0.765169 0.838405 Li\n0.968759 0.234831 0.161595 Li\n0.248275 0.211145 0.657616 Sn\n0.748275 0.788855 0.342384 Sn\n0.750988 0.269309 0.571492 P\n0.250988 0.730691 0.428508 P\n0.259810 0.272802 0.938347 C\n0.759810 0.727198 0.061653 C\n0.729873 0.690618 0.928338 O\n0.262279 0.042983 0.881211 O\n0.283320 0.463896 0.830555 O\n0.937151 0.197427 0.670204 O\n0.564426 0.170474 0.662549 O\n0.259347 0.848158 0.583341 O\n0.737922 0.566164 0.538822 O\n0.237922 0.433836 0.461178 O\n0.759347 0.151842 0.416659 O\n0.064426 0.829526 0.337451 O\n0.437151 0.802573 0.329796 O\n0.783320 0.536104 0.169445 O\n0.762279 0.957017 0.118789 O\n0.229873 0.309382 0.071662 O\n",
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]
}