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{
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{
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{
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"structure_string": "Rb3 Rh1\n1.0\n0.000000 4.272129 4.272129\n4.272129 0.000000 4.272129\n4.272129 4.272129 0.000000\nRb Rh\n3 1\ndirect\n0.250000 0.250000 0.250000 Rb\n0.750000 0.750000 0.750000 Rb\n0.500000 0.500000 0.500000 Rb\n0.000000 0.000000 0.000000 Rh\n",
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},
{
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"created_at": "2022-09-04T14:47:22.077201Z",
"structure_string": "Ta4 Si4 Pt4\n1.0\n3.856239 0.000000 0.000000\n0.000000 6.451746 0.000000\n0.000000 0.000000 7.429028\nTa Si Pt\n4 4 4\ndirect\n0.250000 0.525905 0.164531 Ta\n0.750000 0.474095 0.835469 Ta\n0.750000 0.974095 0.664531 Ta\n0.250000 0.025905 0.335469 Ta\n0.250000 0.767702 0.875026 Si\n0.750000 0.232298 0.124974 Si\n0.750000 0.732298 0.375026 Si\n0.250000 0.267702 0.624974 Si\n0.250000 0.652912 0.567572 Pt\n0.750000 0.347088 0.432428 Pt\n0.750000 0.847088 0.067572 Pt\n0.250000 0.152912 0.932428 Pt\n",
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{
"id": "mp-1105199",
"created_at": "2022-09-04T14:47:22.088348Z",
"structure_string": "Rb2 La2 Mn2 W2 O12\n1.0\n5.767439 -0.000009 -0.053684\n-0.000009 5.788331 -0.000016\n0.002053 -0.000023 8.359642\nRb La Mn W O\n2 2 2 2 12\ndirect\n0.243198 0.762006 0.000746 Rb\n0.756813 0.262009 0.999266 Rb\n0.245432 0.803301 0.499848 La\n0.754566 0.303306 0.500147 La\n0.254508 0.274418 0.752894 Mn\n0.745465 0.774417 0.247118 Mn\n0.757205 0.769072 0.744537 W\n0.242793 0.269069 0.255463 W\n0.536729 0.022048 0.691831 O\n0.463289 0.522029 0.308165 O\n0.504748 0.053173 0.308504 O\n0.495248 0.553172 0.691490 O\n0.986215 0.479928 0.256321 O\n0.013801 0.979904 0.743678 O\n0.959629 0.501257 0.746659 O\n0.040356 0.001268 0.253338 O\n0.819880 0.747988 0.503578 O\n0.180120 0.247977 0.496421 O\n0.719153 0.770224 0.967572 O\n0.280852 0.270218 0.032426 O\n",
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"formula_full": "Rb2 La2 Mn2 W2 O12",
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},
{
"id": "mp-1030419",
"created_at": "2022-09-04T14:47:25.194523Z",
"structure_string": "Te6 Mo2 W2 S2\n1.0\n1.729557 -2.995680 0.000000\n1.729557 2.995680 0.000000\n0.000000 0.000000 39.324333\nTe Mo W S\n6 2 2 2\ndirect\n0.000000 0.000000 0.704933 Te\n0.333333 0.666667 0.046980 Te\n0.333333 0.666667 0.422216 Te\n0.333333 0.666667 0.140993 Te\n0.333333 0.666667 0.516707 Te\n0.000000 0.000000 0.610475 Te\n0.000000 0.000000 0.093913 Mo\n0.333333 0.666667 0.281768 Mo\n0.000000 0.000000 0.469473 W\n0.333333 0.666667 0.657729 W\n0.000000 0.000000 0.319608 S\n0.000000 0.000000 0.243954 S\n",
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"formula_full": "Te6 Mo2 W2 S2",
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{
"id": "mp-761001",
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"structure_string": "Li6 V6 P16 O58\n1.0\n9.753327 0.000000 0.000000\n-4.874982 -8.473059 0.000000\n-0.075878 0.024284 -14.201066\nLi V P O\n6 6 16 58\ndirect\n0.689026 0.912139 0.941385 Li\n0.231928 0.905429 0.447209 Li\n0.228579 0.320552 0.940325 Li\n0.093533 0.327876 0.443442 Li\n0.302243 0.080462 0.056006 Li\n0.951980 0.970207 0.505113 Li\n0.999623 0.567289 0.754548 V\n0.000023 0.437232 0.244404 V\n0.567498 0.568963 0.255620 V\n0.440568 0.436621 0.743045 V\n0.567380 0.003413 0.745518 V\n0.437701 0.998187 0.252768 V\n0.683928 0.910211 0.158969 P\n0.695490 0.779095 0.657415 P\n0.222007 0.910359 0.660835 P\n0.338037 0.666640 0.868345 P\n0.330216 0.664543 0.369200 P\n0.085789 0.774154 0.154340 P\n0.919447 0.692714 0.339335 P\n0.233161 0.319755 0.158167 P\n0.771938 0.686354 0.841533 P\n0.085165 0.314691 0.657734 P\n0.913986 0.226584 0.839692 P\n0.670934 0.335382 0.630532 P\n0.660506 0.332731 0.133126 P\n0.782849 0.088930 0.340138 P\n0.308563 0.223585 0.340636 P\n0.320099 0.092018 0.840435 P\n0.795967 0.007382 0.424310 O\n0.654057 0.912772 0.669810 O\n0.761711 0.767210 0.926751 O\n0.658535 0.742240 0.171458 O\n0.522060 0.901965 0.182801 O\n0.484542 0.819414 0.828135 O\n0.381299 0.910147 0.674274 O\n0.249174 0.012339 0.930692 O\n0.258261 0.917922 0.163887 O\n0.481087 0.669719 0.326253 O\n0.538035 0.618262 0.667684 O\n0.324788 0.814278 0.328652 O\n0.334299 0.661006 0.972995 O\n0.325869 0.665330 0.473795 O\n0.185397 0.660037 0.823292 O\n0.383703 0.478640 0.179291 O\n0.340521 0.520038 0.824647 O\n0.083460 0.739941 0.671116 O\n0.998746 0.794246 0.245513 O\n0.006203 0.789324 0.423045 O\n0.005008 0.766407 0.065321 O\n0.093927 0.619622 0.176692 O\n0.184547 0.512580 0.326921 O\n0.912904 0.655172 0.836289 O\n0.084292 0.470171 0.673203 O\n0.258073 0.347378 0.670790 O\n0.797987 0.795045 0.749755 O\n0.788467 0.798765 0.571820 O\n0.205800 0.214084 0.420219 O\n0.744717 0.655023 0.334824 O\n0.920609 0.535517 0.326437 O\n0.088007 0.343639 0.166271 O\n0.814607 0.480942 0.676774 O\n0.906565 0.380126 0.824392 O\n0.009631 0.233404 0.922858 O\n0.018552 0.233700 0.566203 O\n0.988746 0.200603 0.743694 O\n0.918925 0.263531 0.334945 O\n0.656764 0.474830 0.180610 O\n0.618856 0.526739 0.820447 O\n0.813098 0.337580 0.176909 O\n0.652253 0.326131 0.029113 O\n0.665415 0.329205 0.526500 O\n0.669506 0.184653 0.675068 O\n0.465459 0.382808 0.330744 O\n0.518752 0.331195 0.674488 O\n0.743208 0.082622 0.839662 O\n0.800679 0.011006 0.243498 O\n0.743924 0.986196 0.066804 O\n0.620611 0.085324 0.326764 O\n0.513844 0.179479 0.177149 O\n0.478617 0.097325 0.818780 O\n0.343635 0.261185 0.835508 O\n0.243210 0.247769 0.067324 O\n0.214310 0.200544 0.241668 O\n0.342527 0.083519 0.340527 O\n0.214996 0.983780 0.570355 O\n0.207336 0.002334 0.750771 O\n",
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{
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"structure_string": "Zn12 N72\n1.0\n6.071790 0.000000 0.000000\n0.000000 13.031897 0.000000\n0.000000 0.000000 16.469681\nZn N\n12 72\ndirect\n0.195215 0.184831 0.578752 Zn\n0.804785 0.815169 0.421248 Zn\n0.304785 0.684831 0.421248 Zn\n0.804785 0.815169 0.078752 Zn\n0.695215 0.315169 0.578752 Zn\n0.195215 0.184831 0.921248 Zn\n0.695215 0.315169 0.921248 Zn\n0.304785 0.684831 0.078752 Zn\n0.589720 0.496989 0.750000 Zn\n0.410280 0.503011 0.250000 Zn\n0.910280 0.996989 0.250000 Zn\n0.089720 0.003011 0.750000 Zn\n0.086188 0.321033 0.114521 N\n0.913812 0.678967 0.885479 N\n0.413812 0.821033 0.885479 N\n0.913812 0.678967 0.614521 N\n0.586188 0.178967 0.114521 N\n0.086188 0.321033 0.385479 N\n0.586188 0.178967 0.385479 N\n0.413812 0.821033 0.614521 N\n0.288626 0.529159 0.553029 N\n0.711374 0.470841 0.446971 N\n0.211374 0.029159 0.446971 N\n0.711374 0.470841 0.053029 N\n0.788626 0.970841 0.553029 N\n0.288626 0.529159 0.946971 N\n0.788626 0.970841 0.946971 N\n0.211374 0.029159 0.053029 N\n0.562037 0.442690 0.630539 N\n0.437963 0.557310 0.369461 N\n0.937963 0.942690 0.369461 N\n0.437963 0.557310 0.130539 N\n0.062037 0.057310 0.630539 N\n0.562037 0.442690 0.869461 N\n0.062037 0.057310 0.869461 N\n0.937963 0.942690 0.130539 N\n0.421297 0.486829 0.590323 N\n0.578703 0.513171 0.409677 N\n0.078703 0.986829 0.409677 N\n0.578703 0.513171 0.090323 N\n0.921297 0.013171 0.590323 N\n0.421297 0.486829 0.909677 N\n0.921297 0.013171 0.909677 N\n0.078703 0.986829 0.090323 N\n0.027498 0.298421 0.050469 N\n0.972502 0.701579 0.949531 N\n0.472502 0.798421 0.949531 N\n0.972502 0.701579 0.550469 N\n0.527498 0.201579 0.050469 N\n0.027498 0.298421 0.449531 N\n0.527498 0.201579 0.449531 N\n0.472502 0.798421 0.550469 N\n0.102761 0.535604 0.750000 N\n0.897239 0.464396 0.250000 N\n0.397239 0.035604 0.250000 N\n0.602761 0.964396 0.750000 N\n0.285653 0.567099 0.750000 N\n0.714347 0.432901 0.250000 N\n0.214347 0.067099 0.250000 N\n0.785653 0.932901 0.750000 N\n0.273362 0.265069 0.678649 N\n0.726638 0.734931 0.321351 N\n0.226638 0.765069 0.321351 N\n0.726638 0.734931 0.178649 N\n0.773362 0.234931 0.678649 N\n0.273362 0.265069 0.821351 N\n0.773362 0.234931 0.821351 N\n0.226638 0.765069 0.178649 N\n0.268333 0.260270 0.750000 N\n0.731667 0.739730 0.250000 N\n0.231667 0.760270 0.250000 N\n0.768333 0.239730 0.750000 N\n0.970328 0.272443 0.517924 N\n0.029672 0.727557 0.482076 N\n0.529672 0.772443 0.482076 N\n0.029672 0.727557 0.017924 N\n0.470328 0.227557 0.517924 N\n0.970328 0.272443 0.982076 N\n0.470328 0.227557 0.982076 N\n0.529672 0.772443 0.017924 N\n0.420971 0.995234 0.750000 N\n0.579029 0.004766 0.250000 N\n0.079029 0.495234 0.250000 N\n0.920971 0.504766 0.750000 N\n",
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{
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{
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{
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"created_at": "2022-09-04T14:47:21.928864Z",
"structure_string": "Mn12 Pb32 N36\n1.0\n7.650848 0.000000 0.133554\n0.000000 11.578342 0.000000\n-4.986266 0.000000 17.964476\nMn Pb N\n12 32 36\ndirect\n0.638561 0.109085 0.759651 Mn\n0.361439 0.609085 0.740349 Mn\n0.361439 0.890915 0.240349 Mn\n0.638561 0.390915 0.259651 Mn\n0.823172 0.866489 0.571306 Mn\n0.176828 0.366489 0.928694 Mn\n0.176828 0.133511 0.428694 Mn\n0.823172 0.633511 0.071306 Mn\n0.770597 0.314298 0.562068 Mn\n0.229403 0.814298 0.937932 Mn\n0.229403 0.685702 0.437932 Mn\n0.770597 0.185702 0.062068 Mn\n0.489612 0.940827 0.105956 Pb\n0.510388 0.440827 0.394044 Pb\n0.510388 0.059173 0.894044 Pb\n0.489612 0.559173 0.605956 Pb\n0.510666 0.116469 0.587336 Pb\n0.489334 0.616469 0.912664 Pb\n0.489334 0.883531 0.412664 Pb\n0.510666 0.383531 0.087336 Pb\n0.708251 0.824990 0.726425 Pb\n0.291749 0.324990 0.773575 Pb\n0.291749 0.175010 0.273575 Pb\n0.708251 0.675010 0.226425 Pb\n0.760520 0.346300 0.724579 Pb\n0.239480 0.846300 0.775421 Pb\n0.239480 0.653700 0.275421 Pb\n0.760520 0.153700 0.224579 Pb\n0.741325 0.337324 0.916211 Pb\n0.258675 0.837324 0.583789 Pb\n0.258675 0.662676 0.083789 Pb\n0.741325 0.162676 0.416211 Pb\n0.008560 0.088147 0.831311 Pb\n0.991440 0.588147 0.668689 Pb\n0.991440 0.911853 0.168689 Pb\n0.008560 0.411853 0.331311 Pb\n0.993522 0.091395 0.626175 Pb\n0.006478 0.591395 0.873825 Pb\n0.006478 0.908605 0.373825 Pb\n0.993522 0.408605 0.126175 Pb\n0.124253 0.355995 0.528654 Pb\n0.875747 0.855995 0.971346 Pb\n0.875747 0.644005 0.471346 Pb\n0.124253 0.144005 0.028654 Pb\n0.582098 0.336351 0.594232 N\n0.417902 0.836351 0.905768 N\n0.417902 0.663649 0.405768 N\n0.582098 0.163649 0.094232 N\n0.573147 0.229311 0.804606 N\n0.426853 0.729311 0.695394 N\n0.426853 0.770689 0.195394 N\n0.573147 0.270689 0.304606 N\n0.778749 0.150993 0.971183 N\n0.221251 0.650993 0.528817 N\n0.221251 0.849007 0.028817 N\n0.778749 0.349007 0.471183 N\n0.629711 0.890115 0.595140 N\n0.370289 0.390115 0.904860 N\n0.370289 0.109885 0.404860 N\n0.629711 0.609885 0.095140 N\n0.809623 0.132209 0.712680 N\n0.190377 0.632209 0.787320 N\n0.190377 0.867791 0.287320 N\n0.809623 0.367791 0.212680 N\n0.972656 0.332876 0.624380 N\n0.027344 0.832876 0.875620 N\n0.027344 0.667124 0.375620 N\n0.972656 0.167124 0.124380 N\n0.021797 0.286586 0.868573 N\n0.978203 0.786586 0.631427 N\n0.978203 0.713414 0.131427 N\n0.021797 0.213414 0.368573 N\n0.186570 0.158037 0.520565 N\n0.813430 0.658037 0.979435 N\n0.813430 0.841963 0.479435 N\n0.186570 0.341963 0.020565 N\n0.554867 0.979226 0.775893 N\n0.445133 0.479226 0.724107 N\n0.445133 0.020774 0.224107 N\n0.554867 0.520774 0.275893 N\n",
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],
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"formula_full": "Mn12 Pb32 N36",
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{
"id": "mp-1214002",
"created_at": "2022-09-04T14:47:21.967142Z",
"structure_string": "Ce3 P6 Pd20\n1.0\n0.000000 6.163271 6.163271\n6.163271 0.000000 6.163271\n6.163271 6.163271 0.000000\nCe P Pd\n3 6 20\ndirect\n0.250000 0.250000 0.250000 Ce\n0.750000 0.750000 0.750000 Ce\n0.000000 0.000000 0.000000 Ce\n0.735603 0.264397 0.264397 P\n0.264397 0.735603 0.735603 P\n0.264397 0.735603 0.264397 P\n0.735603 0.264397 0.735603 P\n0.264397 0.264397 0.735603 P\n0.735603 0.735603 0.264397 P\n0.383761 0.383761 0.383761 Pd\n0.616239 0.616239 0.616239 Pd\n0.383761 0.383761 0.848718 Pd\n0.383761 0.848718 0.383761 Pd\n0.616239 0.616239 0.151282 Pd\n0.616239 0.151282 0.616239 Pd\n0.848718 0.383761 0.383761 Pd\n0.151282 0.616239 0.616239 Pd\n0.345418 0.000000 0.000000 Pd\n0.654582 0.000000 0.000000 Pd\n0.000000 0.345418 0.654582 Pd\n0.000000 0.654582 0.345418 Pd\n0.000000 0.345418 0.000000 Pd\n0.654582 0.000000 0.345418 Pd\n0.000000 0.654582 0.000000 Pd\n0.345418 0.000000 0.654582 Pd\n0.000000 0.000000 0.345418 Pd\n0.000000 0.000000 0.654582 Pd\n0.654582 0.345418 0.000000 Pd\n0.345418 0.654582 0.000000 Pd\n",
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]
}