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{
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{
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"structure_string": "Sr4 V2 Cu4 O14\n1.0\n12.535471 3.762399 0.000000\n-12.535471 3.762399 0.000000\n0.000000 3.677360 3.773720\nSr V Cu O\n4 2 4 14\ndirect\n0.373760 0.149961 0.006953 Sr\n0.627900 0.851253 0.026612 Sr\n0.851253 0.627900 0.026612 Sr\n0.149961 0.373760 0.006953 Sr\n0.831064 0.831064 0.370362 V\n0.189803 0.189803 0.520680 V\n0.436263 0.058419 0.524017 Cu\n0.564420 0.942921 0.511973 Cu\n0.942921 0.564420 0.511973 Cu\n0.058419 0.436263 0.524017 Cu\n0.132928 0.132928 0.211613 O\n0.860391 0.860391 0.999716 O\n0.675825 0.325185 0.020642 O\n0.327204 0.676420 0.514083 O\n0.676420 0.327204 0.514083 O\n0.325185 0.675825 0.020642 O\n0.171535 0.827617 0.021976 O\n0.829379 0.171150 0.514981 O\n0.171150 0.829379 0.514981 O\n0.827617 0.171535 0.021976 O\n0.752151 0.635214 0.598190 O\n0.236996 0.363416 0.485208 O\n0.363416 0.236996 0.485208 O\n0.635214 0.752151 0.598190 O\n",
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"formula_full": "Sr4 V2 Cu4 O14",
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{
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"created_at": "2022-09-04T14:45:21.127399Z",
"structure_string": "Y4 Mn2 Ni2 O12\n1.0\n5.279875 0.000004 0.018260\n0.000004 5.599818 -0.000014\n0.027528 -0.000019 7.579403\nY Mn Ni O\n4 2 2 12\ndirect\n0.480900 0.429282 0.748714 Y\n0.019099 0.929283 0.751287 Y\n0.519100 0.570718 0.251286 Y\n0.980901 0.070717 0.248713 Y\n0.500000 0.000000 0.000000 Mn\n0.000000 0.500000 0.500000 Mn\n0.500000 0.000000 0.500000 Ni\n0.000000 0.500000 0.000000 Ni\n0.202019 0.188055 0.947455 O\n0.297981 0.688054 0.552545 O\n0.797981 0.811945 0.052545 O\n0.702019 0.311946 0.447455 O\n0.183538 0.207259 0.557522 O\n0.316461 0.707258 0.942478 O\n0.816461 0.792741 0.442478 O\n0.683539 0.292742 0.057522 O\n0.108072 0.462765 0.257620 O\n0.391928 0.962765 0.242381 O\n0.891928 0.537235 0.742380 O\n0.608072 0.037235 0.757619 O\n",
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{
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"created_at": "2022-09-04T14:45:21.130116Z",
"structure_string": "Li2 Bi6 P12 O40\n1.0\n5.215359 -6.901158 0.000000\n5.215359 6.901158 0.000000\n0.000000 0.000000 12.949743\nLi Bi P O\n2 6 12 40\ndirect\n0.566481 0.566481 0.000000 Li\n0.433519 0.433519 0.500000 Li\n0.124285 0.124285 0.500000 Bi\n0.717929 0.282071 0.250000 Bi\n0.282071 0.717929 0.750000 Bi\n0.757501 0.242499 0.750000 Bi\n0.242499 0.757501 0.250000 Bi\n0.875715 0.875715 0.000000 Bi\n0.129571 0.391036 0.167262 P\n0.391036 0.129571 0.832738 P\n0.202358 0.300128 0.714831 P\n0.300128 0.202358 0.285169 P\n0.136411 0.717386 0.518453 P\n0.717386 0.136411 0.481547 P\n0.863589 0.282614 0.018453 P\n0.282614 0.863589 0.981547 P\n0.797642 0.699872 0.214831 P\n0.699872 0.797642 0.785169 P\n0.870429 0.608964 0.667262 P\n0.608964 0.870429 0.332738 P\n0.165706 0.224302 0.201891 O\n0.224302 0.165706 0.798109 O\n0.052983 0.347350 0.055631 O\n0.347350 0.052983 0.944369 O\n0.300874 0.288445 0.614234 O\n0.288445 0.300874 0.385766 O\n0.990098 0.574366 0.742398 O\n0.574366 0.990098 0.257602 O\n0.457052 0.266896 0.228265 O\n0.266896 0.457052 0.771735 O\n0.761242 0.975175 0.816984 O\n0.975175 0.761242 0.183016 O\n0.282039 0.526004 0.155097 O\n0.526004 0.282039 0.844903 O\n0.119753 0.682781 0.404689 O\n0.682781 0.119753 0.595311 O\n0.104578 0.814485 0.946887 O\n0.814485 0.104578 0.053113 O\n0.241823 0.628481 0.575808 O\n0.628481 0.241823 0.424192 O\n0.758177 0.371519 0.075808 O\n0.371519 0.758177 0.924192 O\n0.895422 0.185515 0.446887 O\n0.185515 0.895422 0.553113 O\n0.880247 0.317219 0.904689 O\n0.317219 0.880247 0.095311 O\n0.717961 0.473996 0.655097 O\n0.473996 0.717961 0.344903 O\n0.024825 0.238758 0.683016 O\n0.238758 0.024825 0.316984 O\n0.542948 0.733104 0.728265 O\n0.733104 0.542948 0.271735 O\n0.009902 0.425634 0.242398 O\n0.425634 0.009902 0.757602 O\n0.699126 0.711555 0.114234 O\n0.711555 0.699126 0.885766 O\n0.947017 0.652650 0.555631 O\n0.652650 0.947017 0.444369 O\n0.834294 0.775698 0.701891 O\n0.775698 0.834294 0.298109 O\n",
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"formula_full": "Li2 Bi6 P12 O40",
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{
"id": "mp-556186",
"created_at": "2022-09-04T14:45:21.139118Z",
"structure_string": "P8 S4 N12 Cl20 O4\n1.0\n7.947273 0.000000 0.000000\n0.000000 8.861198 0.000000\n0.000000 0.000000 17.266152\nP S N Cl O\n8 4 12 20 4\ndirect\n0.312182 0.296699 0.119688 P\n0.912322 0.953784 0.287781 P\n0.687818 0.796699 0.380312 P\n0.187818 0.703301 0.619688 P\n0.412322 0.546216 0.712219 P\n0.087678 0.453784 0.212219 P\n0.812182 0.203301 0.880312 P\n0.587678 0.046216 0.787781 P\n0.176994 0.390637 0.624150 S\n0.823006 0.890637 0.875850 S\n0.676994 0.109363 0.375850 S\n0.323006 0.609363 0.124150 S\n0.306223 0.394944 0.692516 N\n0.151369 0.300292 0.174367 N\n0.409487 0.454719 0.104888 N\n0.651369 0.199708 0.825633 N\n0.193777 0.605056 0.192516 N\n0.590513 0.954719 0.395112 N\n0.090513 0.545281 0.604888 N\n0.848631 0.800292 0.325633 N\n0.693777 0.894944 0.807484 N\n0.806223 0.105056 0.307484 N\n0.909487 0.045281 0.895112 N\n0.348631 0.699708 0.674367 N\n0.748042 0.297353 0.981856 Cl\n0.180433 0.662053 0.025791 Cl\n0.014953 0.846280 0.660039 Cl\n0.819567 0.162053 0.474209 Cl\n0.154669 0.983660 0.315461 Cl\n0.751958 0.702647 0.481856 Cl\n0.654669 0.516340 0.684539 Cl\n0.845331 0.483660 0.184539 Cl\n0.915351 0.938084 0.172513 Cl\n0.680433 0.837947 0.974209 Cl\n0.485047 0.153720 0.160039 Cl\n0.251958 0.797353 0.518144 Cl\n0.345331 0.016340 0.815461 Cl\n0.415351 0.561916 0.827487 Cl\n0.985047 0.346280 0.839961 Cl\n0.248042 0.202647 0.018144 Cl\n0.514953 0.653720 0.339961 Cl\n0.084649 0.438084 0.327487 Cl\n0.584649 0.061916 0.672513 Cl\n0.319567 0.337947 0.525791 Cl\n0.558131 0.229979 0.368513 O\n0.058131 0.270021 0.631487 O\n0.941869 0.770021 0.868513 O\n0.441869 0.729979 0.131487 O\n",
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{
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{
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"structure_string": "Ca3 Sn1 O1\n1.0\n4.850871 0.000000 0.000000\n0.000000 4.850871 0.000000\n0.000000 0.000000 4.850871\nCa Sn O\n3 1 1\ndirect\n0.500000 0.000000 0.500000 Ca\n0.000000 0.500000 0.500000 Ca\n0.500000 0.500000 0.000000 Ca\n0.000000 0.000000 0.000000 Sn\n0.500000 0.500000 0.500000 O\n",
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{
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"structure_string": "Sr1 Ca7 Mn6 Fe2 O24\n1.0\n5.428409 -5.428961 0.000000\n5.428409 5.428961 0.000000\n0.000000 0.000000 7.631259\nSr Ca Mn Fe O\n1 7 6 2 24\ndirect\n0.749916 0.749916 0.000000 Sr\n0.749745 0.250272 0.500000 Ca\n0.749714 0.250198 0.000000 Ca\n0.250203 0.250203 0.500000 Ca\n0.250263 0.250263 0.000000 Ca\n0.749751 0.749751 0.500000 Ca\n0.250272 0.749745 0.500000 Ca\n0.250198 0.749714 0.000000 Ca\n0.499521 0.000595 0.749451 Mn\n0.499521 0.000595 0.250549 Mn\n0.000595 0.499521 0.749451 Mn\n0.000595 0.499521 0.250549 Mn\n0.499493 0.499493 0.749467 Mn\n0.499493 0.499493 0.250533 Mn\n0.000609 0.000609 0.749470 Fe\n0.000609 0.000609 0.250530 Fe\n0.000441 0.253615 0.749546 O\n0.000441 0.253615 0.250454 O\n0.499726 0.250583 0.749706 O\n0.499726 0.250583 0.250294 O\n0.002469 0.746373 0.747587 O\n0.002469 0.746373 0.252413 O\n0.497262 0.749411 0.747331 O\n0.497262 0.749411 0.252669 O\n0.746373 0.002469 0.747587 O\n0.746373 0.002469 0.252413 O\n0.253615 0.000441 0.749546 O\n0.253615 0.000441 0.250454 O\n0.749411 0.497262 0.747331 O\n0.749411 0.497262 0.252669 O\n0.250583 0.499726 0.749706 O\n0.250583 0.499726 0.250294 O\n0.000446 0.000446 0.500000 O\n0.002309 0.002309 0.000000 O\n0.499571 0.000244 0.500000 O\n0.497450 0.002620 0.000000 O\n0.000244 0.499571 0.500000 O\n0.002620 0.497450 0.000000 O\n0.499732 0.499732 0.500000 O\n0.497368 0.497368 0.000000 O\n",
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