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{
"id": "mp-1202879",
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{
"id": "mp-1041774",
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"structure_string": "Zn4 Sn8 O16\n1.0\n10.951491 0.000000 0.000000\n0.000000 3.206607 0.000000\n0.000000 0.262023 10.911581\nZn Sn O\n4 8 16\ndirect\n0.392385 0.522313 0.744820 Zn\n0.607615 0.522313 0.244820 Zn\n0.891738 0.465433 0.748189 Zn\n0.108262 0.465433 0.248189 Zn\n0.621527 0.125618 0.573717 Sn\n0.378473 0.125618 0.073717 Sn\n0.877868 0.874238 0.072895 Sn\n0.361013 0.220202 0.400100 Sn\n0.858945 0.772676 0.402601 Sn\n0.638987 0.220202 0.900100 Sn\n0.141055 0.772676 0.902601 Sn\n0.122132 0.874238 0.572895 Sn\n0.798952 0.807497 0.891599 O\n0.759437 0.404725 0.136052 O\n0.485787 0.644157 0.015530 O\n0.298385 0.221863 0.893874 O\n0.240563 0.404725 0.636052 O\n0.489104 0.041654 0.235569 O\n0.260687 0.587855 0.138059 O\n0.988275 0.941093 0.234470 O\n0.514213 0.644157 0.515530 O\n0.984255 0.368088 0.013177 O\n0.739313 0.587855 0.638059 O\n0.011725 0.941093 0.734470 O\n0.510896 0.041654 0.735569 O\n0.015745 0.368088 0.513177 O\n0.201048 0.807497 0.391599 O\n0.701615 0.221863 0.393874 O\n",
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"formula_full": "Zn4 Sn8 O16",
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{
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"structure_string": "Ca4 Sb4 Pt4\n1.0\n4.640811 0.000000 0.000000\n0.000000 7.400201 0.000000\n0.000000 0.000000 7.969041\nCa Sb Pt\n4 4 4\ndirect\n0.750000 0.992122 0.698084 Ca\n0.250000 0.007878 0.301916 Ca\n0.750000 0.492122 0.801916 Ca\n0.250000 0.507878 0.198084 Ca\n0.750000 0.313933 0.409451 Sb\n0.250000 0.186067 0.909451 Sb\n0.250000 0.686067 0.590549 Sb\n0.750000 0.813933 0.090549 Sb\n0.250000 0.802344 0.915168 Pt\n0.250000 0.302344 0.584832 Pt\n0.750000 0.697656 0.415168 Pt\n0.750000 0.197656 0.084832 Pt\n",
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{
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{
"id": "mp-17891",
"created_at": "2022-09-04T14:43:10.785756Z",
"structure_string": "Na4 Y4 Si4 O16\n1.0\n5.191029 0.000000 0.000000\n0.000000 6.489841 0.000000\n0.000000 0.000000 11.273462\nNa Y Si O\n4 4 4 16\ndirect\n0.500000 0.500000 0.000000 Na\n0.500000 0.000000 0.000000 Na\n0.000000 0.000000 0.500000 Na\n0.000000 0.500000 0.500000 Na\n0.499001 0.250000 0.280438 Y\n0.500999 0.750000 0.719562 Y\n0.000999 0.250000 0.780438 Y\n0.999001 0.750000 0.219562 Y\n0.561158 0.750000 0.399936 Si\n0.938842 0.750000 0.899936 Si\n0.438842 0.250000 0.600064 Si\n0.061158 0.250000 0.100064 Si\n0.749026 0.250000 0.113433 O\n0.250974 0.750000 0.886567 O\n0.750974 0.250000 0.613433 O\n0.249026 0.750000 0.386567 O\n0.833764 0.750000 0.037071 O\n0.166236 0.250000 0.962929 O\n0.666236 0.750000 0.537071 O\n0.333764 0.250000 0.462929 O\n0.700875 0.552465 0.328536 O\n0.299125 0.052465 0.671464 O\n0.799125 0.552465 0.828536 O\n0.200875 0.052465 0.171464 O\n0.200875 0.447535 0.171464 O\n0.799125 0.947535 0.828536 O\n0.299125 0.447535 0.671464 O\n0.700875 0.947535 0.328536 O\n",
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"volume": 379.7911296208237,
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"formula_full": "Na4 Y4 Si4 O16",
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{
"id": "mp-1175091",
"created_at": "2022-09-04T14:43:10.789177Z",
"structure_string": "Li7 Mn2 Co3 O12\n1.0\n1.452004 7.619565 0.000000\n-1.452004 7.619565 0.000000\n0.000000 1.704117 9.699863\nLi Mn Co O\n7 2 3 12\ndirect\n0.581923 0.581923 0.754328 Li\n0.755635 0.755635 0.238855 Li\n0.909158 0.909158 0.759002 Li\n0.252948 0.252948 0.756800 Li\n0.415529 0.415529 0.242166 Li\n0.082473 0.082473 0.243976 Li\n0.333763 0.333763 0.001650 Li\n0.995272 0.995272 0.004269 Mn\n0.167559 0.167559 0.497485 Mn\n0.496300 0.496300 0.504191 Co\n0.677715 0.677715 0.993459 Co\n0.841432 0.841432 0.498077 Co\n0.464774 0.464774 0.888807 O\n0.630812 0.630812 0.386988 O\n0.782553 0.782553 0.878914 O\n0.120935 0.120935 0.894319 O\n0.286479 0.286479 0.389171 O\n0.955070 0.955070 0.382515 O\n0.705333 0.705333 0.607273 O\n0.884426 0.884426 0.115849 O\n0.049927 0.049927 0.611344 O\n0.369988 0.369988 0.624205 O\n0.538573 0.538573 0.110840 O\n0.201420 0.201420 0.115517 O\n",
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],
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"volume": 214.63156241319686,
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"formula_full": "Li7 Mn2 Co3 O12",
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{
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"structure_string": "Li4 V4 P4 O20\n1.0\n10.464967 0.000000 0.000000\n0.000000 4.976301 0.000000\n0.000000 2.445815 6.795831\nLi V P O\n4 4 4 20\ndirect\n0.894885 0.037442 0.835880 Li\n0.394885 0.962558 0.664120 Li\n0.605115 0.037442 0.335880 Li\n0.105115 0.962558 0.164120 Li\n0.077649 0.579718 0.820039 V\n0.577649 0.420282 0.679961 V\n0.422351 0.579718 0.320039 V\n0.922351 0.420282 0.179961 V\n0.649961 0.802017 0.972646 P\n0.850039 0.802017 0.472646 P\n0.149961 0.197983 0.527354 P\n0.350039 0.197983 0.027354 P\n0.722890 0.644593 0.534384 O\n0.427110 0.200226 0.844400 O\n0.040901 0.733660 0.999170 O\n0.570356 0.675096 0.842029 O\n0.690495 0.116482 0.848019 O\n0.927110 0.799774 0.655600 O\n0.190495 0.883518 0.651981 O\n0.222890 0.355407 0.965616 O\n0.459099 0.733660 0.499170 O\n0.070356 0.324904 0.657971 O\n0.929644 0.675096 0.342029 O\n0.540901 0.266340 0.500830 O\n0.777110 0.644593 0.034384 O\n0.809505 0.116482 0.348019 O\n0.072890 0.200226 0.344400 O\n0.309505 0.883518 0.151981 O\n0.429644 0.324904 0.157971 O\n0.959099 0.266340 0.000830 O\n0.572890 0.799774 0.155600 O\n0.277110 0.355407 0.465616 O\n",
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"formula_full": "Li4 V4 P4 O20",
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{
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"structure_string": "Nd1 Eu1 Hf2 O6\n1.0\n0.000000 0.000000 4.215598\n4.048004 -3.983033 0.000000\n4.048004 3.983033 0.000000\nNd Eu Hf O\n1 1 2 6\ndirect\n0.500000 0.500000 0.500000 Nd\n0.500000 0.000000 -0.000000 Eu\n0.000000 0.000000 0.500000 Hf\n0.000000 0.500000 -0.000000 Hf\n0.500000 0.000000 0.500000 O\n0.500000 0.500000 -0.000000 O\n0.000000 0.322656 0.677344 O\n0.000000 0.677344 0.322656 O\n0.000000 0.819089 0.819089 O\n0.000000 0.180911 0.180911 O\n",
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"formula_full": "Nd1 Eu1 Hf2 O6",
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{
"id": "mp-684696",
"created_at": "2022-09-04T14:43:10.808982Z",
"structure_string": "Ba1 Na4 Ti2 Si10 B2 O30\n1.0\n7.567584 0.000000 0.000000\n0.888966 9.714366 0.000000\n0.699164 4.391219 8.689631\nBa Na Ti Si B O\n1 4 2 10 2 30\ndirect\n0.000000 0.000000 0.000000 Ba\n0.426657 0.734692 0.064343 Na\n0.435900 0.265566 0.384784 Na\n0.564100 0.734434 0.615216 Na\n0.573343 0.265308 0.935657 Na\n0.574811 0.893189 0.270380 Ti\n0.425189 0.106811 0.729620 Ti\n0.816247 0.398329 0.164105 Si\n0.896524 0.410597 0.647144 Si\n0.828340 0.055003 0.293692 Si\n0.773518 0.098424 0.687304 Si\n0.714491 0.622763 0.299682 Si\n0.285509 0.377237 0.700318 Si\n0.226482 0.901576 0.312696 Si\n0.171660 0.944997 0.706308 Si\n0.103476 0.589403 0.352856 Si\n0.183753 0.601671 0.835895 Si\n0.860142 0.457819 0.855463 B\n0.139858 0.542181 0.144537 B\n0.020774 0.427663 0.162061 O\n0.953912 0.976087 0.732212 O\n0.886101 0.549059 0.419089 O\n0.740779 0.900611 0.419508 O\n0.846835 0.271133 0.611079 O\n0.791841 0.219862 0.300545 O\n0.755959 0.519169 0.704711 O\n0.947037 0.320815 0.840395 O\n0.746931 0.418424 0.998583 O\n0.680423 0.503488 0.227616 O\n0.649390 0.074250 0.843237 O\n0.713478 0.076228 0.145839 O\n0.720596 0.797254 0.156596 O\n0.557793 0.665923 0.399783 O\n0.619394 0.072424 0.595471 O\n0.380606 0.927576 0.404529 O\n0.442207 0.334077 0.600217 O\n0.279404 0.202746 0.843404 O\n0.286522 0.923772 0.854161 O\n0.350610 0.925750 0.156763 O\n0.319577 0.496512 0.772384 O\n0.253069 0.581576 0.001417 O\n0.052963 0.679185 0.159605 O\n0.244041 0.480831 0.295289 O\n0.208159 0.780138 0.699455 O\n0.153165 0.728867 0.388921 O\n0.259221 0.099389 0.580492 O\n0.113899 0.450941 0.580911 O\n0.046088 0.023913 0.267788 O\n0.979226 0.572337 0.837939 O\n",
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