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{
"id": "mp-974758",
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{
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},
{
"id": "mp-756117",
"created_at": "2022-09-04T14:48:30.939222Z",
"structure_string": "Li4 Ti2 Te2 O12\n1.0\n4.991119 0.000000 0.000000\n0.000000 5.138877 0.000000\n0.000000 0.000000 8.496212\nLi Ti Te O\n4 2 2 12\ndirect\n0.000000 0.000000 0.302418 Li\n0.500000 0.000000 0.178345 Li\n0.000000 0.500000 0.678345 Li\n0.500000 0.500000 0.802418 Li\n0.000000 0.000000 0.891282 Ti\n0.500000 0.500000 0.391282 Ti\n0.500000 0.000000 0.586391 Te\n0.000000 0.500000 0.086391 Te\n0.257082 0.146567 0.743835 O\n0.297445 0.174748 0.416633 O\n0.198944 0.179302 0.075045 O\n0.698944 0.320698 0.575045 O\n0.797445 0.325252 0.916633 O\n0.757082 0.353433 0.243835 O\n0.242918 0.646567 0.243835 O\n0.202555 0.674748 0.916633 O\n0.301056 0.679302 0.575045 O\n0.801056 0.820698 0.075045 O\n0.702555 0.825252 0.416633 O\n0.742918 0.853433 0.743835 O\n",
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{
"id": "mp-562114",
"created_at": "2022-09-04T14:48:31.460320Z",
"structure_string": "V8 Co4 H16 C16 N8 O24\n1.0\n7.638644 0.000000 0.000000\n0.000000 10.506233 0.000000\n0.000000 0.000000 11.699940\nV Co H C N O\n8 4 16 16 8 24\ndirect\n0.404232 0.772071 0.352159 V\n0.095768 0.727929 0.852159 V\n0.095768 0.772071 0.147841 V\n0.904232 0.227929 0.852159 V\n0.404232 0.727929 0.647841 V\n0.904232 0.272071 0.147841 V\n0.595768 0.227929 0.647841 V\n0.595768 0.272071 0.352159 V\n0.750000 0.567117 0.250000 Co\n0.750000 0.932883 0.750000 Co\n0.250000 0.067117 0.250000 Co\n0.250000 0.432883 0.750000 Co\n0.281612 0.106766 0.509287 H\n0.373804 0.466263 0.187844 H\n0.781612 0.606766 0.990713 H\n0.126196 0.466263 0.312156 H\n0.626196 0.533737 0.812156 H\n0.373804 0.033737 0.812156 H\n0.873804 0.966263 0.312156 H\n0.281612 0.393234 0.490713 H\n0.626196 0.966263 0.187844 H\n0.218388 0.106766 0.990713 H\n0.873804 0.533737 0.687844 H\n0.718388 0.893234 0.490713 H\n0.218388 0.393234 0.009287 H\n0.126196 0.033737 0.687844 H\n0.781612 0.893234 0.009287 H\n0.718388 0.606766 0.509287 H\n0.655273 0.940851 0.005124 C\n0.429824 0.482028 0.103678 C\n0.344727 0.059149 0.994876 C\n0.570176 0.517972 0.896322 C\n0.429824 0.017972 0.896322 C\n0.344727 0.440851 0.005124 C\n0.155273 0.440851 0.494876 C\n0.655273 0.559149 0.994876 C\n0.070176 0.482028 0.396322 C\n0.929824 0.517972 0.603678 C\n0.570176 0.982028 0.103678 C\n0.929824 0.982028 0.396322 C\n0.070176 0.017972 0.603678 C\n0.844727 0.559149 0.505124 C\n0.155273 0.059149 0.505124 C\n0.844727 0.940851 0.494876 C\n0.414278 0.458786 0.901029 N\n0.085722 0.041214 0.401029 N\n0.914278 0.541214 0.401029 N\n0.585722 0.958786 0.901029 N\n0.585722 0.541214 0.098971 N\n0.414278 0.041214 0.098971 N\n0.914278 0.958786 0.598971 N\n0.085722 0.458786 0.598971 N\n0.910901 0.429729 0.174163 O\n0.250000 0.704999 0.250000 O\n0.750000 0.295001 0.750000 O\n0.603111 0.792645 0.670692 O\n0.664260 0.250000 0.500000 O\n0.164260 0.750000 0.000000 O\n0.410901 0.929729 0.325837 O\n0.835740 0.250000 0.000000 O\n0.603111 0.707355 0.329308 O\n0.250000 0.795001 0.750000 O\n0.396889 0.292645 0.670692 O\n0.589099 0.429729 0.325837 O\n0.410901 0.570271 0.674163 O\n0.896889 0.707355 0.170692 O\n0.089099 0.929729 0.174163 O\n0.396889 0.207355 0.329308 O\n0.910901 0.070271 0.825837 O\n0.103111 0.292645 0.829308 O\n0.750000 0.204999 0.250000 O\n0.896889 0.792645 0.829308 O\n0.089099 0.570271 0.825837 O\n0.589099 0.070271 0.674163 O\n0.103111 0.207355 0.170692 O\n0.335740 0.750000 0.500000 O\n",
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{
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"created_at": "2022-09-04T14:48:16.649166Z",
"structure_string": "Hf1 Cu3\n1.0\n-2.000588 2.000588 3.551939\n2.000588 -2.000588 3.551939\n2.000588 2.000588 -3.551939\nHf Cu\n1 3\ndirect\n0.000000 0.000000 0.000000 Hf\n0.750000 0.250000 0.500000 Cu\n0.250000 0.750000 0.500000 Cu\n0.500000 0.500000 0.000000 Cu\n",
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{
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"structure_string": "Pu2 Te1 O2\n1.0\n-1.992272 1.992272 6.273179\n1.992272 -1.992272 6.273179\n1.992272 1.992272 -6.273179\nPu Te O\n2 1 2\ndirect\n0.342235 0.342235 0.000000 Pu\n0.657765 0.657765 0.000000 Pu\n0.000000 0.000000 0.000000 Te\n0.750000 0.250000 0.500000 O\n0.250000 0.750000 0.500000 O\n",
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{
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"structure_string": "Nb12 Al12 O48\n1.0\n3.808214 -0.321569 0.021724\n-1.387236 5.974566 -1.861657\n0.017219 0.309766 39.294825\nNb Al O\n12 12 48\ndirect\n0.103042 0.209857 0.289059 Nb\n0.099316 0.208314 0.456307 Nb\n0.099279 0.208162 0.622923 Nb\n0.099196 0.208271 0.789602 Nb\n0.098573 0.208233 0.955730 Nb\n0.194744 0.392412 0.211871 Nb\n0.805256 0.607588 0.121463 Nb\n0.901427 0.791767 0.377604 Nb\n0.900721 0.791838 0.710410 Nb\n0.896958 0.790143 0.044274 Nb\n0.900804 0.791729 0.543731 Nb\n0.900684 0.791686 0.877027 Nb\n0.096929 0.191920 0.114338 Al\n0.205803 0.402841 0.052399 Al\n0.206621 0.404360 0.386917 Al\n0.207361 0.406948 0.554037 Al\n0.207549 0.407684 0.887386 Al\n0.207210 0.406887 0.720673 Al\n0.792639 0.593052 0.779296 Al\n0.792790 0.593113 0.612661 Al\n0.792451 0.592316 0.445947 Al\n0.794197 0.597159 0.280934 Al\n0.793379 0.595640 0.946416 Al\n0.903071 0.808080 0.218995 Al\n0.064862 0.120663 0.062304 O\n0.059883 0.117946 0.227147 O\n0.065091 0.115577 0.560008 O\n0.065142 0.115220 0.393571 O\n0.064983 0.115631 0.726683 O\n0.065143 0.116270 0.893340 O\n0.137998 0.279330 0.003965 O\n0.138388 0.278087 0.163749 O\n0.141634 0.284866 0.504717 O\n0.141035 0.278631 0.337602 O\n0.141530 0.284718 0.671342 O\n0.141652 0.285172 0.838021 O\n0.261671 0.519939 0.107021 O\n0.261932 0.529045 0.276067 O\n0.260124 0.523844 0.440054 O\n0.260337 0.524666 0.606726 O\n0.260214 0.524702 0.773388 O\n0.260501 0.526370 0.940157 O\n0.359735 0.715839 0.049605 O\n0.360978 0.714128 0.382661 O\n0.366332 0.735275 0.217847 O\n0.361596 0.716551 0.549362 O\n0.361674 0.717092 0.882642 O\n0.361463 0.716567 0.716027 O\n0.638326 0.282908 0.450691 O\n0.633668 0.264725 0.115487 O\n0.638404 0.283449 0.783971 O\n0.640265 0.284160 0.283728 O\n0.638537 0.283433 0.617307 O\n0.639022 0.285872 0.950672 O\n0.738068 0.470954 0.057267 O\n0.739499 0.473630 0.393176 O\n0.738329 0.480061 0.226312 O\n0.739663 0.475334 0.726607 O\n0.739786 0.475298 0.559946 O\n0.739876 0.476156 0.893279 O\n0.862002 0.720670 0.329369 O\n0.861612 0.721913 0.169584 O\n0.858366 0.715134 0.828617 O\n0.858470 0.715282 0.661991 O\n0.858348 0.714828 0.495312 O\n0.858965 0.721369 0.995731 O\n0.934857 0.883730 0.439993 O\n0.940117 0.882054 0.106186 O\n0.934909 0.884423 0.773326 O\n0.935138 0.879337 0.271030 O\n0.935017 0.884369 0.606650 O\n0.934858 0.884780 0.939762 O\n",
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{
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"formula_full": "Rb16 Hg8 P8 Se40",
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{
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"structure_string": "Li6 Mn2 V6 O16\n1.0\n-2.897639 5.227629 0.001084\n-2.908411 -1.612038 9.825149\n3.062545 5.117446 -0.082264\nLi Mn V O\n6 2 6 16\ndirect\n0.496415 0.000318 0.500694 Li\n0.999989 0.499366 0.503157 Li\n0.997093 0.000240 0.500118 Li\n0.503323 0.500085 0.495498 Li\n0.747729 0.251626 0.505443 Li\n0.252504 0.748638 0.495068 Li\n0.752543 0.749635 0.496554 Mn\n0.246958 0.250392 0.503674 Mn\n0.004250 0.500178 0.999935 V\n0.752161 0.751692 0.996505 V\n0.748264 0.248897 0.002656 V\n0.499342 0.999894 0.999762 V\n0.248136 0.248927 0.003523 V\n0.251914 0.750210 0.997361 V\n0.888334 0.371128 0.227193 O\n0.385549 0.871745 0.223503 O\n0.608329 0.128171 0.775774 O\n0.116347 0.628865 0.772749 O\n0.870693 0.859267 0.256650 O\n0.373747 0.359039 0.263771 O\n0.099035 0.637267 0.254893 O\n0.589517 0.131664 0.258500 O\n0.651729 0.635066 0.251999 O\n0.142326 0.139110 0.260454 O\n0.854528 0.865080 0.738442 O\n0.353037 0.360784 0.747227 O\n0.407166 0.864728 0.740989 O\n0.903385 0.366420 0.748288 O\n0.632864 0.641399 0.737810 O\n0.122817 0.140163 0.741756 O\n",
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{
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{
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{
"id": "mp-558846",
"created_at": "2022-09-04T14:48:31.570164Z",
"structure_string": "Cs8 As16 Pd12 O56\n1.0\n16.560396 0.000000 0.000000\n0.000000 16.560396 0.000000\n0.000000 0.000000 6.173520\nCs As Pd O\n8 16 12 56\ndirect\n0.762623 0.918463 0.472496 Cs\n0.581537 0.262623 0.472496 Cs\n0.737377 0.581537 0.527504 Cs\n0.418463 0.737377 0.472496 Cs\n0.918463 0.237377 0.527504 Cs\n0.262623 0.418463 0.527504 Cs\n0.081537 0.762623 0.527504 Cs\n0.237377 0.081537 0.472496 Cs\n0.651480 0.082018 0.920191 As\n0.571654 0.657119 0.002629 As\n0.071654 0.157119 0.997371 As\n0.417982 0.151480 0.920191 As\n0.657119 0.428346 0.997371 As\n0.348520 0.917982 0.920191 As\n0.342881 0.571654 0.997371 As\n0.082018 0.348520 0.079809 As\n0.157119 0.928346 0.002629 As\n0.928346 0.842881 0.997371 As\n0.151480 0.582018 0.079809 As\n0.848520 0.417982 0.079809 As\n0.842881 0.071654 0.002629 As\n0.917982 0.651480 0.079809 As\n0.428346 0.342881 0.002629 As\n0.582018 0.848520 0.920191 As\n0.000000 0.500000 0.305635 Pd\n0.000000 0.500000 0.848474 Pd\n0.500000 0.500000 0.764108 Pd\n0.500000 0.000000 0.694365 Pd\n0.750000 0.750000 0.000000 Pd\n0.500000 0.000000 0.151526 Pd\n0.000000 0.000000 0.764108 Pd\n0.500000 0.500000 0.235892 Pd\n0.250000 0.250000 0.000000 Pd\n0.250000 0.750000 0.000000 Pd\n0.750000 0.250000 0.000000 Pd\n0.000000 0.000000 0.235892 Pd\n0.912162 0.411068 0.860086 O\n0.258599 0.965641 0.026509 O\n0.033220 0.118558 0.759998 O\n0.675469 0.653085 0.004482 O\n0.684095 0.172646 0.815168 O\n0.153085 0.824531 0.004482 O\n0.120404 0.966953 0.763179 O\n0.175469 0.153085 0.995518 O\n0.741401 0.034359 0.026509 O\n0.466953 0.379596 0.763179 O\n0.827354 0.684095 0.184832 O\n0.118558 0.966780 0.240002 O\n0.465641 0.241401 0.026509 O\n0.533220 0.618558 0.240002 O\n0.478797 0.122479 0.707240 O\n0.911068 0.587838 0.860086 O\n0.978797 0.622479 0.292760 O\n0.966780 0.881442 0.759998 O\n0.965641 0.741401 0.973491 O\n0.881442 0.033220 0.240002 O\n0.088932 0.412162 0.860086 O\n0.033047 0.120404 0.236821 O\n0.618558 0.466780 0.759998 O\n0.758599 0.465641 0.973491 O\n0.966953 0.879596 0.236821 O\n0.122479 0.521203 0.292760 O\n0.377521 0.978797 0.707240 O\n0.815905 0.327354 0.184832 O\n0.034359 0.258599 0.973491 O\n0.846915 0.175469 0.004482 O\n0.412162 0.911068 0.139914 O\n0.879596 0.033047 0.763179 O\n0.411068 0.087838 0.139914 O\n0.087838 0.588932 0.860086 O\n0.533047 0.620404 0.763179 O\n0.241401 0.534359 0.973491 O\n0.672646 0.815905 0.815168 O\n0.653085 0.324531 0.995518 O\n0.324531 0.346915 0.004482 O\n0.184095 0.672646 0.184832 O\n0.534359 0.758599 0.026509 O\n0.466780 0.381442 0.240002 O\n0.622479 0.021203 0.707240 O\n0.587838 0.088932 0.139914 O\n0.381442 0.533220 0.759998 O\n0.021203 0.377521 0.292760 O\n0.588932 0.912162 0.139914 O\n0.172646 0.315905 0.184832 O\n0.327354 0.184095 0.815168 O\n0.379596 0.533047 0.236821 O\n0.346915 0.675469 0.995518 O\n0.521203 0.877521 0.707240 O\n0.620404 0.466953 0.236821 O\n0.877521 0.478797 0.292760 O\n0.824531 0.846915 0.995518 O\n0.315905 0.827354 0.815168 O\n",
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}