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{
"id": "mp-1182697",
"created_at": "2022-09-04T14:41:11.272891Z",
"structure_string": "Ba12 Zn12 O60\n1.0\n7.922173 0.000000 0.000000\n0.000000 11.482620 0.000000\n0.000000 0.000000 18.555641\nBa Zn O\n12 12 60\ndirect\n0.650136 0.011138 0.453805 Ba\n0.150136 0.988862 0.546195 Ba\n0.150136 0.488862 0.953805 Ba\n0.650136 0.511138 0.046195 Ba\n0.557061 0.992450 0.218765 Ba\n0.057061 0.007550 0.781235 Ba\n0.057061 0.507550 0.718765 Ba\n0.557061 0.492450 0.281235 Ba\n0.562542 0.991119 0.871043 Ba\n0.062542 0.008881 0.128957 Ba\n0.062542 0.508881 0.371043 Ba\n0.562542 0.491119 0.628957 Ba\n0.811014 0.728328 0.224820 Zn\n0.311014 0.271672 0.775180 Zn\n0.311014 0.771672 0.724820 Zn\n0.811014 0.228328 0.275180 Zn\n0.904654 0.737279 0.896877 Zn\n0.404654 0.262721 0.103123 Zn\n0.404654 0.762721 0.396877 Zn\n0.904654 0.237279 0.603123 Zn\n0.854165 0.729942 0.568090 Zn\n0.354165 0.270058 0.431910 Zn\n0.354165 0.770058 0.068090 Zn\n0.854165 0.229942 0.931910 Zn\n0.197275 0.546733 0.207105 O\n0.697275 0.453267 0.792895 O\n0.697275 0.953267 0.707105 O\n0.197275 0.046733 0.292895 O\n0.514570 0.560609 0.878057 O\n0.014570 0.439391 0.121943 O\n0.014570 0.939391 0.378057 O\n0.514570 0.060609 0.621943 O\n0.188863 0.506286 0.543124 O\n0.688863 0.493714 0.456876 O\n0.688863 0.993714 0.043124 O\n0.188863 0.006286 0.956876 O\n0.109069 0.601432 0.163160 O\n0.609069 0.398568 0.836840 O\n0.609069 0.898568 0.663160 O\n0.109069 0.101432 0.336840 O\n0.024892 0.622472 0.843895 O\n0.524892 0.377528 0.156105 O\n0.524892 0.877528 0.343895 O\n0.024892 0.122472 0.656105 O\n0.106058 0.597590 0.514183 O\n0.606058 0.402410 0.485817 O\n0.606058 0.902410 0.014183 O\n0.106058 0.097590 0.985817 O\n0.673858 0.627487 0.171185 O\n0.173858 0.372513 0.828815 O\n0.173858 0.872513 0.671185 O\n0.673858 0.127487 0.328815 O\n0.601977 0.614702 0.834262 O\n0.101977 0.385298 0.165738 O\n0.101977 0.885298 0.334262 O\n0.601977 0.114702 0.665738 O\n0.657085 0.597446 0.488516 O\n0.157085 0.402554 0.511484 O\n0.157085 0.902554 0.988516 O\n0.657085 0.097446 0.011484 O\n0.836622 0.632747 0.303312 O\n0.336622 0.367253 0.696688 O\n0.336622 0.867253 0.803312 O\n0.836622 0.132747 0.196688 O\n0.885698 0.636119 0.973641 O\n0.385698 0.363881 0.026359 O\n0.385698 0.863881 0.473641 O\n0.885698 0.136119 0.526359 O\n0.828935 0.627648 0.639528 O\n0.328935 0.372352 0.360472 O\n0.328935 0.872352 0.139528 O\n0.828935 0.127648 0.860472 O\n0.845451 0.875829 0.194921 O\n0.345451 0.124171 0.805079 O\n0.345451 0.624171 0.694921 O\n0.845451 0.375829 0.305079 O\n0.844698 0.873440 0.855482 O\n0.344698 0.126560 0.144518 O\n0.344698 0.626560 0.355482 O\n0.844698 0.373440 0.644518 O\n0.870225 0.859047 0.515677 O\n0.370225 0.140953 0.484323 O\n0.370225 0.640953 0.015677 O\n0.870225 0.359047 0.984323 O\n",
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{
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"structure_string": "Np1 Ga1 Rh2\n1.0\n0.000000 3.237051 3.237051\n3.237051 0.000000 3.237051\n3.237051 3.237051 0.000000\nNp Ga Rh\n1 1 2\ndirect\n0.000000 0.000000 0.000000 Np\n0.500000 0.500000 0.500000 Ga\n0.250000 0.250000 0.250000 Rh\n0.750000 0.750000 0.750000 Rh\n",
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{
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{
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"structure_string": "Na6 Zr6 Fe2 P12 O48\n1.0\n7.818700 0.022038 4.969684\n2.742382 7.306448 4.967765\n0.041466 0.024095 18.559493\nNa Zr Fe P O\n6 6 2 12 48\ndirect\n0.976885 0.005843 0.011620 Na\n0.002415 0.026554 0.489840 Na\n0.500240 0.500111 0.249872 Na\n0.497606 0.494498 0.750715 Na\n0.268464 0.916700 0.819570 Na\n0.913939 0.643961 0.634309 Na\n0.149502 0.149131 0.069211 Zr\n0.353986 0.355058 0.175915 Zr\n0.144526 0.142202 0.575748 Zr\n0.646542 0.644497 0.324175 Zr\n0.851929 0.853650 0.426834 Zr\n0.848522 0.855412 0.925617 Zr\n0.357473 0.353398 0.676379 Fe\n0.651839 0.642634 0.828902 Fe\n0.040657 0.751462 0.229091 P\n0.457473 0.042143 0.375051 P\n0.749175 0.460361 0.017943 P\n0.252100 0.534853 0.483639 P\n0.541079 0.957782 0.125086 P\n0.042335 0.740589 0.730586 P\n0.960254 0.249106 0.269331 P\n0.458723 0.042049 0.870536 P\n0.743162 0.457737 0.523784 P\n0.256546 0.544658 0.976172 P\n0.540443 0.963417 0.628161 P\n0.961293 0.257959 0.769663 P\n0.123306 0.280951 0.253905 O\n0.281269 0.510042 0.060596 O\n0.064475 0.919572 0.140883 O\n0.509142 0.121992 0.140698 O\n0.217994 0.583146 0.217569 O\n0.006461 0.783424 0.311401 O\n0.281024 0.065750 0.459042 O\n0.434863 0.218803 0.291003 O\n0.582153 0.436000 0.106658 O\n0.220190 0.372976 0.497154 O\n0.078861 0.711709 0.471684 O\n0.377751 0.992646 0.108065 O\n0.621013 0.008539 0.391911 O\n0.134154 0.271320 0.754768 O\n0.917373 0.283080 0.030965 O\n0.781741 0.623287 0.002949 O\n0.417584 0.562881 0.394598 O\n0.269314 0.508480 0.567876 O\n0.564126 0.781393 0.209120 O\n0.065212 0.912908 0.642949 O\n0.718177 0.933746 0.041016 O\n0.505366 0.131764 0.640378 O\n0.217301 0.572994 0.718421 O\n0.994918 0.216784 0.187358 O\n0.009362 0.777912 0.811606 O\n0.782859 0.417221 0.281639 O\n0.491823 0.878348 0.358682 O\n0.283658 0.065457 0.956523 O\n0.935725 0.081447 0.358313 O\n0.435070 0.217957 0.787462 O\n0.718282 0.493018 0.438940 O\n0.574505 0.436596 0.610338 O\n0.220912 0.381793 0.993307 O\n0.088914 0.725615 0.961819 O\n0.877525 0.718727 0.245574 O\n0.377563 0.992087 0.611613 O\n0.622585 0.006951 0.888494 O\n0.914923 0.282048 0.534204 O\n0.779570 0.621724 0.506177 O\n0.422906 0.573328 0.887811 O\n0.562130 0.786873 0.713506 O\n0.722305 0.927314 0.545917 O\n0.990461 0.225312 0.687977 O\n0.788948 0.432166 0.777274 O\n0.488717 0.873382 0.858815 O\n0.935962 0.085441 0.857044 O\n0.718499 0.491822 0.936488 O\n0.873409 0.716628 0.746170 O\n",
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"formula_full": "Na6 Zr6 Fe2 P12 O48",
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{
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"structure_string": "Sr8 P16 O48\n1.0\n8.055077 0.000000 0.000000\n0.000000 7.312516 0.000000\n0.000000 0.172232 17.714777\nSr P O\n8 16 48\ndirect\n0.655882 0.483426 0.327543 Sr\n0.155882 0.516574 0.172457 Sr\n0.344118 0.516574 0.672457 Sr\n0.844118 0.483426 0.827543 Sr\n0.117755 0.019189 0.102628 Sr\n0.617755 0.980811 0.397372 Sr\n0.882245 0.980811 0.897372 Sr\n0.382245 0.019189 0.602628 Sr\n0.790544 0.757338 0.089657 P\n0.290544 0.242662 0.410343 P\n0.209456 0.242662 0.910343 P\n0.709456 0.757338 0.589657 P\n0.802185 0.361542 0.040732 P\n0.302185 0.638458 0.459268 P\n0.197815 0.638458 0.959268 P\n0.697815 0.361542 0.540732 P\n0.514374 0.869558 0.192743 P\n0.014374 0.130442 0.307257 P\n0.485626 0.130442 0.807257 P\n0.985626 0.869558 0.692743 P\n0.517585 0.269721 0.144560 P\n0.017585 0.730279 0.355440 P\n0.482415 0.730279 0.855440 P\n0.982415 0.269721 0.644560 P\n0.340589 0.260991 0.117383 O\n0.840589 0.739009 0.382617 O\n0.659411 0.739009 0.882617 O\n0.159411 0.260991 0.617383 O\n0.566659 0.082928 0.187776 O\n0.066659 0.917072 0.312224 O\n0.433341 0.917072 0.812224 O\n0.933341 0.082928 0.687776 O\n0.563325 0.424464 0.195209 O\n0.063325 0.575536 0.304791 O\n0.436675 0.575536 0.804791 O\n0.936675 0.424464 0.695209 O\n0.337021 0.090316 0.464266 O\n0.837021 0.909684 0.035734 O\n0.662979 0.909684 0.535734 O\n0.162979 0.090316 0.964266 O\n0.911173 0.730196 0.153857 O\n0.944107 0.322470 0.093882 O\n0.411173 0.269804 0.346143 O\n0.588827 0.730196 0.653857 O\n0.633156 0.266044 0.070348 O\n0.133156 0.733956 0.429652 O\n0.366844 0.733956 0.929652 O\n0.866844 0.266044 0.570348 O\n0.168185 0.840377 0.679338 O\n0.668185 0.159623 0.820662 O\n0.831815 0.159623 0.320662 O\n0.331815 0.840377 0.179338 O\n0.910766 0.801826 0.765217 O\n0.410766 0.198174 0.734783 O\n0.089234 0.198174 0.234783 O\n0.589234 0.801826 0.265217 O\n0.895506 0.788804 0.619044 O\n0.395506 0.211196 0.880956 O\n0.104494 0.211196 0.380956 O\n0.604494 0.788804 0.119044 O\n0.681783 0.309759 0.459307 O\n0.181783 0.690241 0.040693 O\n0.318217 0.690241 0.540693 O\n0.818217 0.309759 0.959307 O\n0.741884 0.576398 0.541476 O\n0.241884 0.423602 0.958524 O\n0.258116 0.423602 0.458524 O\n0.758116 0.576398 0.041476 O\n0.555893 0.322470 0.593882 O\n0.055893 0.677530 0.906118 O\n0.444107 0.677530 0.406118 O\n0.088827 0.269804 0.846143 O\n",
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{
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{
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{
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