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{
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{
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"structure_string": "Rb1 Mg1 Cu2 H3 S2 O10\n1.0\n-4.569596 -2.785425 2.513835\n5.054952 -3.603550 -2.785336\n4.145822 -3.239468 5.781221\nRb Mg Cu H S O\n1 1 2 3 2 10\ndirect\n0.484197 0.993278 0.496688 Rb\n0.238308 0.231779 0.013389 Mg\n0.966168 0.516510 0.031154 Cu\n0.511326 0.811784 0.981951 Cu\n0.757664 0.540717 0.747242 H\n0.211506 0.426201 0.260218 H\n0.696532 0.649717 0.881195 H\n0.074830 0.237031 0.703951 S\n0.914951 0.774963 0.306428 S\n0.764740 0.107646 0.766394 O\n0.196153 0.446772 0.766317 O\n0.225216 0.941215 0.209189 O\n0.792991 0.542121 0.278185 O\n0.692520 0.499622 0.885523 O\n0.242317 0.469801 0.122978 O\n0.148108 0.063833 0.813199 O\n0.819007 0.934233 0.205407 O\n0.171557 0.321185 0.500351 O\n0.857700 0.722987 0.509242 O\n",
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{
"id": "mp-542146",
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"structure_string": "K8 Fe4 H32 S8 O48\n1.0\n9.649043 0.000000 0.000000\n0.000000 10.111800 0.000000\n0.000000 1.061753 11.851923\nK Fe H S O\n8 4 32 8 48\ndirect\n0.270786 0.759852 0.168535 K\n0.770786 0.240148 0.331465 K\n0.729214 0.240148 0.831465 K\n0.229214 0.759852 0.668535 K\n0.741293 0.739455 0.167937 K\n0.241293 0.260545 0.332063 K\n0.258707 0.260545 0.832063 K\n0.758707 0.739455 0.667937 K\n0.000000 0.000000 0.000000 Fe\n0.500000 0.000000 0.500000 Fe\n0.500000 0.500000 0.000000 Fe\n0.000000 0.500000 0.500000 Fe\n0.260097 0.603651 0.919423 H\n0.760097 0.396349 0.580577 H\n0.739903 0.396349 0.080577 H\n0.239903 0.603651 0.419423 H\n0.360459 0.727162 0.920969 H\n0.860459 0.272838 0.579031 H\n0.639541 0.272838 0.079031 H\n0.139541 0.727162 0.420969 H\n0.251679 0.387720 0.081903 H\n0.751679 0.612280 0.418097 H\n0.748321 0.612280 0.918097 H\n0.248321 0.387720 0.581903 H\n0.362635 0.270736 0.090769 H\n0.862635 0.729264 0.409231 H\n0.637365 0.729264 0.909231 H\n0.137365 0.270736 0.590769 H\n0.279334 0.970716 0.941404 H\n0.779334 0.029284 0.558596 H\n0.720666 0.029284 0.058596 H\n0.220666 0.970716 0.441404 H\n0.278099 0.051563 0.053431 H\n0.778099 0.948437 0.446569 H\n0.721901 0.948437 0.946569 H\n0.221901 0.051563 0.553431 H\n0.013398 0.266036 0.076596 H\n0.513398 0.733964 0.423404 H\n0.986602 0.733964 0.923404 H\n0.486602 0.266036 0.576596 H\n0.981796 0.272767 0.946902 H\n0.481796 0.727233 0.553098 H\n0.018204 0.727233 0.053098 H\n0.518204 0.272767 0.446902 H\n0.506293 0.049252 0.202629 S\n0.006293 0.950748 0.297371 S\n0.493707 0.950748 0.797371 S\n0.993707 0.049252 0.702629 S\n0.993458 0.478872 0.208950 S\n0.493458 0.521128 0.291050 S\n0.006542 0.521128 0.791050 S\n0.506542 0.478872 0.708950 S\n0.372566 0.882874 0.858503 O\n0.872566 0.117126 0.641497 O\n0.627434 0.117126 0.141497 O\n0.127434 0.882874 0.358503 O\n0.373955 0.114260 0.158411 O\n0.873955 0.885740 0.341589 O\n0.626045 0.885740 0.841589 O\n0.126045 0.114260 0.658411 O\n0.087475 0.393788 0.145347 O\n0.587475 0.606212 0.354653 O\n0.912525 0.606212 0.854653 O\n0.412525 0.393788 0.645347 O\n0.846365 0.454428 0.179652 O\n0.346365 0.545572 0.320348 O\n0.153635 0.545572 0.820348 O\n0.653635 0.454428 0.679652 O\n0.019786 0.928187 0.175853 O\n0.519786 0.071813 0.324147 O\n0.980214 0.071813 0.824147 O\n0.480214 0.928187 0.675853 O\n0.505623 0.907225 0.184582 O\n0.005623 0.092775 0.315418 O\n0.494377 0.092775 0.815418 O\n0.994377 0.907225 0.684582 O\n0.513703 0.562890 0.167631 O\n0.013703 0.437110 0.332369 O\n0.486297 0.437110 0.832369 O\n0.986297 0.562890 0.667631 O\n0.026724 0.621649 0.183801 O\n0.526724 0.378351 0.316199 O\n0.973276 0.378351 0.816199 O\n0.473276 0.621649 0.683801 O\n0.335815 0.641038 0.963895 O\n0.835815 0.358962 0.536105 O\n0.664185 0.358962 0.036105 O\n0.164185 0.641038 0.463895 O\n0.338273 0.356670 0.047557 O\n0.838273 0.643330 0.452443 O\n0.661727 0.643330 0.952443 O\n0.161727 0.356670 0.547557 O\n0.220004 0.023592 0.990337 O\n0.720004 0.976408 0.509663 O\n0.779996 0.976408 0.009663 O\n0.279996 0.023592 0.490337 O\n0.980922 0.211157 0.016451 O\n0.480922 0.788843 0.483549 O\n0.019078 0.788843 0.983549 O\n0.519078 0.211157 0.516451 O\n",
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"formula_full": "K8 Fe4 H32 S8 O48",
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{
"id": "mp-768238",
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"structure_string": "Li12 La4 Ni4 O16\n1.0\n5.883093 0.000000 0.000000\n1.320337 7.294245 0.000000\n2.205633 0.462352 9.529414\nLi La Ni O\n12 4 4 16\ndirect\n0.972769 0.804877 0.124702 Li\n0.319795 0.061248 0.097889 Li\n0.040321 0.450442 0.128786 Li\n0.970892 0.054284 0.375681 Li\n0.677217 0.433885 0.402465 Li\n0.324120 0.316031 0.346846 Li\n0.675880 0.683969 0.653154 Li\n0.322783 0.566115 0.597535 Li\n0.029108 0.945716 0.624319 Li\n0.959679 0.549558 0.871214 Li\n0.680205 0.938751 0.902111 Li\n0.027231 0.195123 0.875298 Li\n0.520003 0.627733 0.122798 La\n0.505256 0.877557 0.375834 La\n0.494744 0.122443 0.624166 La\n0.479997 0.372267 0.877202 La\n0.685818 0.186289 0.150340 Ni\n0.037204 0.693944 0.376575 Ni\n0.962796 0.306056 0.623425 Ni\n0.314182 0.813711 0.849660 Ni\n0.830212 0.364734 0.019514 O\n0.656163 0.933509 0.112467 O\n0.821469 0.616746 0.270681 O\n0.358818 0.319677 0.135547 O\n0.656960 0.178176 0.356391 O\n0.184677 0.879316 0.235237 O\n0.820557 0.859485 0.515618 O\n0.348503 0.567445 0.391648 O\n0.651497 0.432555 0.608352 O\n0.179443 0.140515 0.484382 O\n0.815323 0.120684 0.764763 O\n0.343040 0.821824 0.643609 O\n0.641182 0.680323 0.864453 O\n0.178531 0.383254 0.729319 O\n0.343837 0.066491 0.887533 O\n0.169788 0.635266 0.980486 O\n",
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{
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"structure_string": "Li8 Co4 P16 O48\n1.0\n10.283338 0.000000 0.000000\n0.000000 9.231897 0.000000\n0.000000 0.363328 9.420439\nLi Co P O\n8 4 16 48\ndirect\n0.317267 0.098702 0.493866 Li\n0.821708 0.595622 0.004268 Li\n0.321708 0.404378 0.495732 Li\n0.678292 0.595622 0.504268 Li\n0.817267 0.901298 0.006134 Li\n0.182733 0.098702 0.993866 Li\n0.682733 0.901298 0.506134 Li\n0.178292 0.404378 0.995732 Li\n0.302290 0.748134 0.517405 Co\n0.197710 0.748134 0.017405 Co\n0.697710 0.251866 0.482595 Co\n0.802290 0.251866 0.982595 Co\n0.893600 0.731149 0.302471 P\n0.388659 0.948950 0.792125 P\n0.393600 0.268851 0.197529 P\n0.611341 0.051050 0.207875 P\n0.470653 0.757917 0.230319 P\n0.970653 0.242083 0.269681 P\n0.029347 0.757917 0.730319 P\n0.396241 0.522275 0.793584 P\n0.606400 0.731149 0.802471 P\n0.896241 0.477725 0.706416 P\n0.888659 0.051050 0.707875 P\n0.103759 0.522275 0.293584 P\n0.111341 0.948950 0.292125 P\n0.603759 0.477725 0.206416 P\n0.529347 0.242083 0.769681 P\n0.106400 0.268851 0.697529 P\n0.280089 0.251865 0.100600 O\n0.729206 0.063274 0.112917 O\n0.626175 0.747681 0.645152 O\n0.126155 0.936296 0.133756 O\n0.770794 0.063274 0.612917 O\n0.462855 0.749850 0.390305 O\n0.373825 0.252319 0.354848 O\n0.461261 0.095863 0.827407 O\n0.991238 0.165570 0.644602 O\n0.149260 0.737010 0.645847 O\n0.538951 0.576593 0.842018 O\n0.961261 0.904137 0.672593 O\n0.416903 0.351503 0.819448 O\n0.378656 0.557950 0.636444 O\n0.791380 0.435597 0.604692 O\n0.461049 0.423407 0.157982 O\n0.229206 0.936726 0.387083 O\n0.873845 0.063704 0.866244 O\n0.037145 0.749850 0.890305 O\n0.038951 0.423407 0.657982 O\n0.916903 0.648497 0.680552 O\n0.626155 0.063704 0.366244 O\n0.508762 0.165570 0.144602 O\n0.126175 0.252319 0.854848 O\n0.538739 0.904137 0.172593 O\n0.719911 0.748135 0.899400 O\n0.373845 0.936296 0.633756 O\n0.649260 0.262990 0.854153 O\n0.270794 0.936726 0.887083 O\n0.961049 0.576593 0.342018 O\n0.038739 0.095863 0.327407 O\n0.291380 0.564403 0.895308 O\n0.537145 0.250150 0.609695 O\n0.850740 0.262990 0.354153 O\n0.878656 0.442050 0.863556 O\n0.583097 0.648497 0.180552 O\n0.873825 0.747681 0.145152 O\n0.708620 0.435597 0.104692 O\n0.208620 0.564403 0.395308 O\n0.219911 0.251865 0.600600 O\n0.008762 0.834430 0.355398 O\n0.962855 0.250150 0.109695 O\n0.083097 0.351503 0.319448 O\n0.121344 0.557950 0.136444 O\n0.350740 0.737010 0.145847 O\n0.621344 0.442050 0.363556 O\n0.780089 0.748135 0.399400 O\n0.491238 0.834430 0.855398 O\n",
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{
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{
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