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{
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{
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"formula_full": "Er2 Zr22 Si22 P2 O96",
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},
{
"id": "mp-756482",
"created_at": "2022-09-04T14:43:03.035816Z",
"structure_string": "Mn3 Co1 O8\n1.0\n4.924229 -2.915227 0.000000\n4.924229 2.915227 0.000000\n3.198366 0.000000 4.745212\nMn Co O\n3 1 8\ndirect\n0.500000 0.500000 0.000000 Mn\n0.500000 0.000000 0.500000 Mn\n0.000000 0.500000 0.500000 Mn\n0.500000 0.500000 0.500000 Co\n0.263236 0.263236 0.263236 O\n0.705218 0.267432 0.267432 O\n0.267432 0.267432 0.705218 O\n0.267432 0.705218 0.267432 O\n0.732568 0.294782 0.732568 O\n0.732568 0.732568 0.294782 O\n0.294782 0.732568 0.732568 O\n0.736764 0.736764 0.736764 O\n",
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{
"id": "mp-28917",
"created_at": "2022-09-04T14:47:02.428087Z",
"structure_string": "Ba4 Ti26 O44\n1.0\n5.040117 -5.857483 0.000000\n5.040117 5.857483 0.000000\n0.000000 0.000000 14.228652\nBa Ti O\n4 26 44\ndirect\n0.666687 0.666687 0.912254 Ba\n0.833313 0.833313 0.412254 Ba\n0.166687 0.166687 0.587746 Ba\n0.333313 0.333313 0.087746 Ba\n0.298339 0.557575 0.325942 Ti\n0.201661 0.942425 0.825942 Ti\n0.057575 0.798339 0.174058 Ti\n0.442425 0.701661 0.674058 Ti\n0.701661 0.442425 0.674058 Ti\n0.798339 0.057575 0.174058 Ti\n0.942425 0.201661 0.825942 Ti\n0.557575 0.298339 0.325942 Ti\n0.756026 0.243974 0.500000 Ti\n0.743974 0.256026 0.000000 Ti\n0.243974 0.756026 0.500000 Ti\n0.256026 0.743974 0.000000 Ti\n0.921724 0.426276 0.153182 Ti\n0.578276 0.073724 0.653182 Ti\n0.926276 0.421724 0.346818 Ti\n0.573724 0.078276 0.846818 Ti\n0.078276 0.573724 0.846818 Ti\n0.421724 0.926276 0.346818 Ti\n0.073724 0.578276 0.653182 Ti\n0.426276 0.921724 0.153182 Ti\n0.500000 0.500000 0.500000 Ti\n0.000000 0.000000 0.000000 Ti\n0.832756 0.832756 0.666577 Ti\n0.667244 0.667244 0.166577 Ti\n0.332756 0.332756 0.833423 Ti\n0.167244 0.167244 0.333423 Ti\n0.971556 0.213180 0.420059 O\n0.528444 0.286820 0.920059 O\n0.713180 0.471556 0.079941 O\n0.786820 0.028444 0.579941 O\n0.028444 0.786820 0.579941 O\n0.471556 0.713180 0.079941 O\n0.286820 0.528444 0.920059 O\n0.213180 0.971556 0.420059 O\n0.125204 0.382172 0.252342 O\n0.374796 0.117828 0.752342 O\n0.882172 0.625204 0.247658 O\n0.617828 0.874796 0.747658 O\n0.874796 0.617828 0.747658 O\n0.625204 0.882172 0.247658 O\n0.117828 0.374796 0.752342 O\n0.382172 0.125204 0.252342 O\n0.657750 0.657750 0.594229 O\n0.842250 0.842250 0.094229 O\n0.157750 0.157750 0.905771 O\n0.342250 0.342250 0.405771 O\n0.964396 0.212685 0.080013 O\n0.535604 0.287315 0.580013 O\n0.712685 0.464396 0.419987 O\n0.787315 0.035604 0.919987 O\n0.035604 0.787315 0.919987 O\n0.464396 0.712685 0.419987 O\n0.287315 0.535604 0.580013 O\n0.212685 0.964396 0.080013 O\n0.770729 0.270729 0.250000 O\n0.729271 0.229271 0.750000 O\n0.598318 0.098519 0.410175 O\n0.901682 0.401481 0.910175 O\n0.598519 0.098318 0.089825 O\n0.901481 0.401682 0.589825 O\n0.401682 0.901481 0.589825 O\n0.098318 0.598519 0.089825 O\n0.401481 0.901682 0.910175 O\n0.098519 0.598318 0.410175 O\n0.004332 0.004332 0.251722 O\n0.495668 0.495668 0.751722 O\n0.504332 0.504332 0.248278 O\n0.995668 0.995668 0.748278 O\n0.270729 0.770729 0.250000 O\n0.229271 0.729271 0.750000 O\n",
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{
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{
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"structure_string": "Li8 Co4 Ge4 O16\n1.0\n-0.000002 0.000002 5.524136\n5.109233 6.443193 0.000001\n-5.102751 6.436726 0.000004\nLi Co Ge O\n8 4 4 16\ndirect\n0.336331 0.372560 0.874278 Li\n0.336331 0.872561 0.374278 Li\n0.663667 0.872561 0.874279 Li\n0.663669 0.372560 0.374278 Li\n0.828865 0.747270 0.248164 Li\n0.828867 0.247269 0.748164 Li\n0.171135 0.747270 0.748164 Li\n0.171134 0.247269 0.248164 Li\n0.167364 0.500793 0.500405 Co\n0.832635 0.500791 0.000405 Co\n0.167367 0.000792 0.000405 Co\n0.832633 0.000791 0.500405 Co\n0.669173 0.125752 0.120678 Ge\n0.669172 0.625750 0.620680 Ge\n0.330828 0.625750 0.120680 Ge\n0.330827 0.125753 0.620677 Ge\n0.676265 0.301575 0.946716 O\n0.676266 0.801574 0.446717 O\n0.323733 0.801575 0.946717 O\n0.323739 0.301576 0.446714 O\n0.178539 0.683556 0.291158 O\n0.178542 0.183554 0.791158 O\n0.821459 0.683555 0.791156 O\n0.821458 0.183554 0.291158 O\n0.177570 0.455374 0.063259 O\n0.177564 0.955373 0.563259 O\n0.822431 0.455370 0.563260 O\n0.822437 0.955372 0.063258 O\n0.636367 0.568827 0.176742 O\n0.636377 0.068824 0.676745 O\n0.363634 0.568827 0.676742 O\n0.363620 0.068824 0.176744 O\n",
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