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{
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{
"id": "mp-1042302",
"created_at": "2022-09-04T14:46:37.724449Z",
"structure_string": "Zn2 W4 O14\n1.0\n7.109367 0.000000 0.000000\n0.000000 6.300876 0.000000\n0.000000 2.307299 7.895437\nZn W O\n2 4 14\ndirect\n0.161287 0.113751 0.347024 Zn\n0.661287 0.886249 0.652976 Zn\n0.146693 0.899575 0.786882 W\n0.646693 0.100425 0.213118 W\n0.679812 0.353380 0.778184 W\n0.179812 0.646620 0.221816 W\n0.363378 0.594086 0.366849 O\n0.863378 0.405914 0.633151 O\n0.748688 0.037261 0.425241 O\n0.248688 0.962739 0.574759 O\n0.030643 0.401564 0.272928 O\n0.530643 0.598436 0.727072 O\n0.411910 0.202156 0.227887 O\n0.911910 0.797844 0.772113 O\n0.054729 0.891033 0.242410 O\n0.554729 0.108967 0.757590 O\n0.259957 0.704091 0.988975 O\n0.759957 0.295909 0.011025 O\n0.117846 0.147082 0.838391 O\n0.617846 0.852918 0.161609 O\n",
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{
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"nsites": 39,
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"density": 6.844343464811745,
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"formula_full": "Na7 W8 O24",
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"spacegroup": 12
},
{
"id": "mp-755523",
"created_at": "2022-09-04T14:40:55.629390Z",
"structure_string": "Ta2 S4\n1.0\n12.834645 -1.686459 0.000000\n12.834645 1.686459 0.000000\n12.613046 0.000000 2.912614\nTa S\n2 4\ndirect\n0.917086 0.917086 0.917086 Ta\n0.082914 0.082914 0.082914 Ta\n0.789654 0.789654 0.789654 S\n0.210346 0.210346 0.210346 S\n0.623818 0.623818 0.623818 S\n0.376182 0.376182 0.376182 S\n",
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},
{
"id": "mp-1191822",
"created_at": "2022-09-04T14:48:18.148539Z",
"structure_string": "Sm4 C4 O16\n1.0\n4.937872 0.000000 0.000000\n0.000000 7.245916 0.000000\n0.000000 0.000000 8.429931\nSm C O\n4 4 16\ndirect\n0.250000 0.357487 0.334522 Sm\n0.250000 0.857487 0.165478 Sm\n0.750000 0.642513 0.665478 Sm\n0.750000 0.142513 0.834522 Sm\n0.250000 0.300868 0.677970 C\n0.250000 0.800868 0.822030 C\n0.750000 0.699132 0.322030 C\n0.750000 0.199132 0.177970 C\n0.250000 0.038534 0.396699 O\n0.250000 0.538534 0.103301 O\n0.750000 0.961466 0.603301 O\n0.750000 0.461466 0.896699 O\n0.750000 0.296402 0.304833 O\n0.750000 0.796402 0.195167 O\n0.250000 0.703598 0.695167 O\n0.250000 0.203598 0.804833 O\n0.977519 0.652991 0.389042 O\n0.522481 0.152991 0.110958 O\n0.477519 0.347009 0.610958 O\n0.022481 0.847009 0.889042 O\n0.022481 0.347009 0.610958 O\n0.477519 0.847009 0.889042 O\n0.522481 0.652991 0.389042 O\n0.977519 0.152991 0.110958 O\n",
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"formula_full": "Sm4 C4 O16",
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"energy": -193.75450448,
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"spacegroup": 62
},
{
"id": "mp-849407",
"created_at": "2022-09-04T14:41:18.086986Z",
"structure_string": "Li8 Mn12 B12 O36\n1.0\n6.344388 0.000000 0.000000\n3.066746 8.302491 0.000000\n0.295783 0.139485 14.265689\nLi Mn B O\n8 12 12 36\ndirect\n0.823890 0.867518 0.146416 Li\n0.858812 0.790668 0.491709 Li\n0.837289 0.840281 0.859987 Li\n0.305559 0.871004 0.152724 Li\n0.575266 0.343505 0.361289 Li\n0.562425 0.374245 0.651132 Li\n0.065925 0.368922 0.649436 Li\n0.094861 0.284484 0.990868 Li\n0.923470 0.137754 0.500986 Mn\n0.668115 0.675158 0.320301 Mn\n0.908577 0.176027 0.810566 Mn\n0.894119 0.208300 0.186373 Mn\n0.691431 0.626162 0.001571 Mn\n0.660790 0.696460 0.678787 Mn\n0.166730 0.696834 0.676629 Mn\n0.195721 0.633403 0.998217 Mn\n0.404396 0.192630 0.169079 Mn\n0.410907 0.161480 0.826007 Mn\n0.167644 0.668863 0.319752 Mn\n0.418939 0.130143 0.500500 Mn\n0.755724 0.999826 0.330945 B\n0.985669 0.507163 0.163440 B\n0.001224 0.498570 0.831959 B\n0.503252 0.987122 0.006273 B\n0.752826 0.498999 0.503123 B\n0.507229 0.500326 0.170426 B\n0.519258 0.493318 0.831383 B\n0.235547 0.001151 0.327073 B\n0.753827 0.003950 0.664888 B\n0.993645 0.004063 0.999488 B\n0.251347 0.496183 0.503365 B\n0.238308 0.010532 0.669584 B\n0.835136 0.852425 0.288399 O\n0.934264 0.638526 0.778963 O\n0.991447 0.529637 0.256867 O\n0.911990 0.638119 0.101092 O\n0.841369 0.851490 0.626341 O\n0.006529 0.504522 0.929090 O\n0.588779 0.851825 0.950599 O\n0.696761 0.647416 0.460610 O\n0.936389 0.147616 0.949396 O\n0.766659 0.485373 0.600617 O\n0.516385 0.971953 0.103704 O\n0.794372 0.362050 0.450259 O\n0.602738 0.344571 0.132828 O\n0.691933 0.142445 0.276339 O\n0.450242 0.607107 0.762722 O\n0.426639 0.631021 0.109809 O\n0.344895 0.858168 0.637624 O\n0.330928 0.845492 0.295219 O\n0.596250 0.331230 0.802906 O\n0.511078 0.530096 0.925169 O\n0.498684 0.518173 0.266453 O\n0.744428 0.020086 0.762898 O\n0.677867 0.139738 0.607811 O\n0.732752 0.012677 0.427360 O\n0.335562 0.357799 0.451029 O\n0.000275 0.005082 0.098273 O\n0.258064 0.484879 0.601226 O\n0.161576 0.644529 0.460569 O\n0.404289 0.137746 0.967212 O\n0.042366 0.860509 0.953683 O\n0.210522 0.038016 0.420511 O\n0.165726 0.141661 0.608518 O\n0.068025 0.347687 0.789427 O\n0.168371 0.125153 0.259333 O\n0.054229 0.349732 0.125690 O\n0.203361 0.033218 0.767131 O\n",
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"density": 3.1390475043054833,
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"formula_full": "Li8 Mn12 B12 O36",
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{
"id": "mp-27614",
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"structure_string": "Ca4 V4 O14\n1.0\n6.748645 0.000000 0.000000\n0.874065 6.978988 0.000000\n3.145909 0.112145 6.389938\nCa V O\n4 4 14\ndirect\n0.255516 0.658371 0.171919 Ca\n0.744484 0.341629 0.828081 Ca\n0.268344 0.060103 0.764471 Ca\n0.731656 0.939897 0.235529 Ca\n0.274274 0.555157 0.654183 V\n0.725726 0.444843 0.345817 V\n0.196170 0.164975 0.267065 V\n0.803830 0.835025 0.732935 V\n0.950350 0.302099 0.437309 O\n0.049650 0.697901 0.562691 O\n0.464132 0.598851 0.369520 O\n0.535868 0.401149 0.630480 O\n0.342977 0.053176 0.398690 O\n0.657023 0.946824 0.601310 O\n0.360567 0.316745 0.075908 O\n0.639433 0.683255 0.924092 O\n0.133019 0.990980 0.141174 O\n0.866981 0.009020 0.858826 O\n0.250952 0.719275 0.826843 O\n0.749048 0.280725 0.173157 O\n0.107654 0.373253 0.766514 O\n0.892346 0.626747 0.233486 O\n",
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{
"id": "mp-1409456",
"created_at": "2022-09-04T14:40:02.443957Z",
"structure_string": "Li2 V12 O26\n1.0\n-3.720038 0.000000 0.000000\n1.861292 11.312649 0.000000\n-0.035319 -4.294983 -11.352082\nLi V O\n2 12 26\ndirect\n0.811720 0.369964 0.764277 Li\n0.188280 0.630036 0.235723 Li\n0.773256 0.448403 0.074005 V\n0.226744 0.551597 0.925995 V\n0.219965 0.506827 0.611537 V\n0.780035 0.493173 0.388463 V\n0.947327 0.103382 0.958366 V\n0.052673 0.896618 0.041634 V\n0.426258 0.145340 0.484088 V\n0.573742 0.854660 0.515912 V\n0.927798 0.145607 0.283702 V\n0.072202 0.854393 0.716298 V\n0.436078 0.127979 0.769234 V\n0.563922 0.872021 0.230766 V\n0.754511 0.493837 0.928284 O\n0.245489 0.506163 0.071716 O\n0.247527 0.501897 0.429601 O\n0.752473 0.498103 0.570399 O\n0.935863 0.126530 0.441478 O\n0.064137 0.873470 0.558522 O\n0.443779 0.111573 0.931182 O\n0.556221 0.888427 0.068818 O\n0.959329 0.081386 0.782662 O\n0.040671 0.918614 0.217338 O\n0.448853 0.102567 0.304728 O\n0.551147 0.897433 0.695272 O\n0.739337 0.503703 0.244354 O\n0.260663 0.496297 0.755646 O\n0.854694 0.289537 0.027754 O\n0.145305 0.710463 0.972246 O\n0.344201 0.303372 0.550590 O\n0.655799 0.696628 0.449410 O\n0.850998 0.305800 0.321442 O\n0.149002 0.694200 0.678558 O\n0.357490 0.284954 0.803455 O\n0.642510 0.715046 0.196545 O\n0.959320 0.081590 0.106509 O\n0.040680 0.918410 0.893491 O\n0.456784 0.086100 0.599984 O\n0.543216 0.913900 0.400016 O\n",
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{
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{
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"structure_string": "Sr2 Nd1 Nb1 O6\n1.0\n0.000000 4.307883 4.307883\n4.307883 0.000000 4.307883\n4.307883 4.307883 0.000000\nSr Nd Nb O\n2 1 1 6\ndirect\n0.250000 0.250000 0.250000 Sr\n0.750000 0.750000 0.750000 Sr\n0.500000 0.500000 0.500000 Nd\n0.000000 0.000000 0.000000 Nb\n0.766945 0.233055 0.233055 O\n0.233055 0.766945 0.766945 O\n0.233055 0.766945 0.233055 O\n0.766945 0.233055 0.766945 O\n0.233055 0.233055 0.766945 O\n0.766945 0.766945 0.233055 O\n",
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{
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