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{
"id": "mp-752572",
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"structure_string": "Li2 V3 O3 F5\n1.0\n-5.893621 0.000000 0.000000\n-2.783442 5.239792 0.000000\n-2.892133 1.778792 -4.867526\nLi V O F\n2 3 3 5\ndirect\n0.990904 0.004475 0.014875 Li\n0.260572 0.244271 0.239079 Li\n0.610261 0.627089 0.613062 V\n0.145004 0.640647 0.608390 V\n0.629330 0.124444 0.625592 V\n0.369396 0.852326 0.408169 O\n0.855436 0.857480 0.430176 O\n0.382745 0.376786 0.839704 O\n0.390924 0.871299 0.853318 F\n0.885522 0.871010 0.854473 F\n0.881349 0.396572 0.836703 F\n0.368265 0.373094 0.402481 F\n0.865069 0.373150 0.391883 F\n",
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{
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{
"id": "mp-1096331",
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"structure_string": "Y2 In1 Hg1\n1.0\n-6.107341 6.269156 8.767690\n6.107341 -6.269156 8.767690\n6.107341 6.269156 -8.767690\nY In Hg\n2 1 1\ndirect\n0.000000 0.246422 0.246422 Y\n0.000000 0.753578 0.753578 Y\n0.000000 0.000000 0.000000 In\n0.000000 0.500000 0.500000 Hg\n",
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},
{
"id": "mp-1188070",
"created_at": "2022-09-04T14:42:12.715858Z",
"structure_string": "Zn6 Sn2\n1.0\n4.524375 0.000000 0.000000\n-0.176591 5.831356 0.000000\n-1.640429 -2.840417 5.907048\nZn Sn\n6 2\ndirect\n0.241947 0.316435 0.168261 Zn\n0.243077 0.849175 0.168195 Zn\n0.240694 0.864538 0.731504 Zn\n0.758053 0.683565 0.831739 Zn\n0.756923 0.150825 0.831805 Zn\n0.759306 0.135462 0.268496 Zn\n0.781719 0.659531 0.317706 Sn\n0.218281 0.340469 0.682294 Sn\n",
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{
"id": "mp-1220903",
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"structure_string": "Na1 Ti2 Bi1 O6\n1.0\n3.850902 -3.894458 0.000000\n3.850902 3.894458 0.000000\n0.000000 0.000000 4.230809\nNa Ti Bi O\n1 2 1 6\ndirect\n0.000000 0.000000 0.565016 Na\n0.500000 0.000000 0.022793 Ti\n0.000000 0.500000 0.022793 Ti\n0.500000 0.500000 0.611366 Bi\n0.500000 0.000000 0.440415 O\n0.000000 0.500000 0.440415 O\n0.733522 0.733522 0.937233 O\n0.266478 0.266478 0.937233 O\n0.750694 0.249306 0.921368 O\n0.249306 0.750694 0.921368 O\n",
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{
"id": "mp-759567",
"created_at": "2022-09-04T14:42:12.717984Z",
"structure_string": "Li6 V6 P16 O58\n1.0\n9.779887 0.000000 0.000000\n4.869495 8.482622 0.000000\n0.085569 0.058933 14.150118\nLi V P O\n6 6 16 58\ndirect\n0.093870 0.682279 0.057366 Li\n0.310183 0.911590 0.443455 Li\n0.692881 0.082089 0.558384 Li\n0.773859 0.915145 0.942074 Li\n0.772582 0.319792 0.441506 Li\n0.914790 0.309713 0.941867 Li\n0.001936 0.432675 0.743015 V\n0.431165 0.569266 0.753149 V\n0.431448 0.002530 0.244740 V\n0.562009 0.999838 0.752043 V\n0.563277 0.432721 0.243402 V\n0.994822 0.569957 0.260130 V\n0.085268 0.680873 0.839704 P\n0.233036 0.683464 0.342175 P\n0.087351 0.226462 0.339736 P\n0.338795 0.333185 0.630737 P\n0.326774 0.338779 0.129230 P\n0.225009 0.087395 0.842361 P\n0.316471 0.912046 0.659826 P\n0.683632 0.229642 0.841590 P\n0.314151 0.771817 0.157588 P\n0.679326 0.089542 0.340604 P\n0.772719 0.910210 0.159792 P\n0.671122 0.662759 0.869386 P\n0.658833 0.666778 0.370799 P\n0.913375 0.773468 0.656441 P\n0.765950 0.319673 0.658441 P\n0.914379 0.321614 0.158151 P\n0.000392 0.763958 0.569787 O\n0.090192 0.654551 0.334584 O\n0.208640 0.792032 0.249906 O\n0.234472 0.762538 0.071787 O\n0.093730 0.521180 0.820616 O\n0.253612 0.657409 0.834339 O\n0.179953 0.487467 0.169631 O\n0.097274 0.380573 0.324661 O\n0.987440 0.255525 0.066102 O\n0.081211 0.257947 0.836391 O\n0.339826 0.477609 0.677048 O\n0.187247 0.334659 0.674052 O\n0.384648 0.523753 0.321956 O\n0.344258 0.328296 0.526305 O\n0.335688 0.334453 0.024854 O\n0.523621 0.382542 0.825067 O\n0.332545 0.186047 0.174563 O\n0.477828 0.337086 0.174501 O\n0.256506 0.081672 0.338898 O\n0.204041 0.008096 0.746462 O\n0.238377 0.999602 0.929384 O\n0.254030 0.989175 0.567844 O\n0.379944 0.096257 0.820213 O\n0.488895 0.180448 0.672628 O\n0.658052 0.257945 0.334821 O\n0.343434 0.913487 0.165696 O\n0.520744 0.095206 0.318695 O\n0.239442 0.764473 0.427955 O\n0.757432 0.245399 0.568130 O\n0.478726 0.902826 0.681910 O\n0.659568 0.083569 0.840830 O\n0.784805 0.204740 0.744889 O\n0.341793 0.743523 0.670633 O\n0.512012 0.817167 0.328793 O\n0.618812 0.901657 0.179038 O\n0.762758 0.989410 0.068531 O\n0.749200 0.011220 0.431548 O\n0.790195 0.999782 0.250175 O\n0.742518 0.918032 0.662925 O\n0.523840 0.661805 0.825118 O\n0.476737 0.618174 0.175150 O\n0.670427 0.816211 0.828543 O\n0.664794 0.665945 0.475518 O\n0.674013 0.663915 0.974137 O\n0.615279 0.478768 0.676933 O\n0.812488 0.666279 0.326776 O\n0.665571 0.515089 0.330019 O\n0.919198 0.742436 0.165736 O\n0.992073 0.794802 0.752768 O\n0.000824 0.753615 0.930314 O\n0.905547 0.618215 0.677032 O\n0.819705 0.514105 0.827096 O\n0.745099 0.345694 0.170418 O\n0.907083 0.479718 0.182256 O\n0.771097 0.236008 0.924605 O\n0.911635 0.342381 0.665494 O\n0.992334 0.236411 0.423755 O\n0.011400 0.204367 0.243780 O\n",
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"formula_full": "Li6 V6 P16 O58",
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{
"id": "mp-1204574",
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"structure_string": "Fe6 P16 O74\n1.0\n4.799469 8.621009 0.000000\n-4.799469 8.621009 0.000000\n0.000000 0.366317 16.996878\nFe P O\n6 16 74\ndirect\n0.812994 0.762919 0.738474 Fe\n0.237081 0.187006 0.761526 Fe\n0.187006 0.237081 0.261526 Fe\n0.762919 0.812994 0.238474 Fe\n0.661582 0.338418 0.750000 Fe\n0.338418 0.661582 0.250000 Fe\n0.575727 0.096900 0.820194 P\n0.903100 0.424273 0.679806 P\n0.424273 0.903100 0.179806 P\n0.096900 0.575727 0.320194 P\n0.870279 0.010666 0.639325 P\n0.989334 0.129721 0.860675 P\n0.129721 0.989334 0.360675 P\n0.010666 0.870279 0.139325 P\n0.620371 0.625322 0.855413 P\n0.374678 0.379629 0.644587 P\n0.379629 0.374678 0.144587 P\n0.625322 0.620371 0.355413 P\n0.102607 0.530413 0.856697 P\n0.469587 0.897393 0.643303 P\n0.897393 0.469587 0.143303 P\n0.530413 0.102607 0.356697 P\n0.734151 0.948676 0.806957 O\n0.051324 0.265849 0.693043 O\n0.265849 0.051324 0.193043 O\n0.948676 0.734151 0.306957 O\n0.563205 0.254665 0.824683 O\n0.745335 0.436795 0.675317 O\n0.436795 0.745335 0.175317 O\n0.254665 0.563205 0.324683 O\n0.430399 0.086743 0.828564 O\n0.913257 0.569601 0.671436 O\n0.569601 0.913257 0.171436 O\n0.086743 0.430399 0.328564 O\n0.623797 0.046300 0.961887 O\n0.953700 0.376203 0.538113 O\n0.376203 0.953700 0.038113 O\n0.046300 0.623797 0.461887 O\n0.908174 0.846031 0.670000 O\n0.153969 0.091826 0.830000 O\n0.091826 0.153969 0.330000 O\n0.846031 0.908174 0.170000 O\n0.743546 0.147302 0.690547 O\n0.852698 0.256454 0.809453 O\n0.256454 0.852698 0.309453 O\n0.147302 0.743546 0.190547 O\n0.027083 0.007453 0.628594 O\n0.992547 0.972917 0.871406 O\n0.972917 0.992547 0.371406 O\n0.007453 0.027083 0.128594 O\n0.815973 0.028915 0.551448 O\n0.971085 0.184027 0.948552 O\n0.184027 0.971085 0.448552 O\n0.028915 0.815973 0.051448 O\n0.729689 0.658503 0.804267 O\n0.341497 0.270311 0.695733 O\n0.270311 0.341497 0.195733 O\n0.658503 0.729689 0.304267 O\n0.570399 0.524297 0.809734 O\n0.475703 0.429601 0.690266 O\n0.429601 0.475703 0.190266 O\n0.524297 0.570399 0.309734 O\n0.469701 0.772326 0.887451 O\n0.227674 0.530299 0.612549 O\n0.530299 0.227674 0.112549 O\n0.772326 0.469701 0.387451 O\n0.711208 0.545084 0.933896 O\n0.454916 0.288792 0.566104 O\n0.288792 0.454916 0.066104 O\n0.545084 0.711208 0.433896 O\n0.005933 0.669547 0.797931 O\n0.330453 0.994067 0.702069 O\n0.994067 0.330453 0.202069 O\n0.669547 0.005933 0.297931 O\n0.124199 0.375839 0.824838 O\n0.624161 0.875801 0.675162 O\n0.875801 0.624161 0.175162 O\n0.375839 0.124199 0.324838 O\n0.258165 0.520840 0.878577 O\n0.479160 0.741835 0.621423 O\n0.741835 0.479160 0.121423 O\n0.520840 0.258165 0.378577 O\n0.015627 0.577593 0.937817 O\n0.422407 0.984373 0.562183 O\n0.984373 0.422407 0.062183 O\n0.577593 0.015627 0.437817 O\n0.204620 0.795380 0.750000 O\n0.795380 0.204620 0.250000 O\n0.094415 0.303676 0.517300 O\n0.696324 0.905585 0.982700 O\n0.905585 0.696324 0.482700 O\n0.303676 0.094415 0.017300 O\n0.662531 0.272271 0.517164 O\n0.727729 0.337469 0.982836 O\n0.337469 0.727729 0.482836 O\n0.272271 0.662531 0.017164 O\n",
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{
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"structure_string": "Tb2 Co2 Si4\n1.0\n2.022833 -8.098331 0.000000\n2.022833 8.098331 0.000000\n0.000000 0.000000 3.992976\nTb Co Si\n2 2 4\ndirect\n0.107232 0.892768 0.250000 Tb\n0.892768 0.107232 0.750000 Tb\n0.679838 0.320162 0.750000 Co\n0.320162 0.679838 0.250000 Co\n0.750207 0.249793 0.250000 Si\n0.249793 0.750207 0.750000 Si\n0.542695 0.457305 0.750000 Si\n0.457305 0.542695 0.250000 Si\n",
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{
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{
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{
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"structure_string": "Li4 Cr3 Ni1 O8\n1.0\n4.425819 2.555241 0.007693\n2.962971 -1.710426 4.842988\n2.962738 -5.131595 0.000022\nLi Cr Ni O\n4 3 1 8\ndirect\n0.000607 0.997393 0.001276 Li\n0.999400 0.002618 0.498718 Li\n0.500007 0.999999 0.250006 Li\n0.500009 0.000002 0.749995 Li\n0.999969 0.499994 0.001259 Cr\n0.000008 0.500005 0.498740 Cr\n0.500027 0.499991 0.750002 Cr\n0.500002 0.500004 0.250002 Ni\n0.234013 0.270885 0.364563 O\n0.247203 0.273496 0.863257 O\n0.740384 0.275636 0.095840 O\n0.259608 0.724359 0.404159 O\n0.259604 0.724354 0.871484 O\n0.765983 0.729134 0.135430 O\n0.740399 0.275636 0.628519 O\n0.752776 0.726495 0.636751 O\n",
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}