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{
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{
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"formula_full": "Ba8 Y8 I40",
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},
{
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"structure_string": "Y1 Sn1\n1.0\n3.800305 0.000000 0.000000\n0.000000 3.800305 0.000000\n0.000000 0.000000 3.800305\nY Sn\n1 1\ndirect\n0.500000 0.500000 0.500000 Y\n0.000000 0.000000 0.000000 Sn\n",
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},
{
"id": "mp-27779",
"created_at": "2022-09-04T14:43:10.451908Z",
"structure_string": "Hg4 Mo24 Cl56\n1.0\n13.077925 0.000000 0.000000\n0.000000 13.077925 0.000000\n0.000000 0.000000 13.077925\nHg Mo Cl\n4 24 56\ndirect\n0.750000 0.750000 0.750000 Hg\n0.250000 0.250000 0.750000 Hg\n0.750000 0.250000 0.250000 Hg\n0.250000 0.750000 0.250000 Hg\n0.386655 0.225275 0.280536 Mo\n0.280536 0.386655 0.225275 Mo\n0.225275 0.280536 0.386655 Mo\n0.774725 0.719464 0.386655 Mo\n0.280536 0.613345 0.774725 Mo\n0.774725 0.280536 0.613345 Mo\n0.719464 0.613345 0.225275 Mo\n0.719464 0.386655 0.774725 Mo\n0.225275 0.719464 0.613345 Mo\n0.386655 0.774725 0.719464 Mo\n0.613345 0.225275 0.719464 Mo\n0.613345 0.774725 0.280536 Mo\n0.113345 0.274725 0.219464 Mo\n0.219464 0.113345 0.274725 Mo\n0.274725 0.219464 0.113345 Mo\n0.725275 0.780536 0.113345 Mo\n0.219464 0.886655 0.725275 Mo\n0.725275 0.219464 0.886655 Mo\n0.780536 0.886655 0.274725 Mo\n0.780536 0.113345 0.725275 Mo\n0.274725 0.780536 0.886655 Mo\n0.113345 0.725275 0.780536 Mo\n0.886655 0.274725 0.780536 Mo\n0.886655 0.725275 0.219464 Mo\n0.384884 0.384884 0.384884 Cl\n0.615116 0.615116 0.384884 Cl\n0.384884 0.615116 0.615116 Cl\n0.615116 0.384884 0.615116 Cl\n0.115116 0.115116 0.115116 Cl\n0.884884 0.884884 0.115116 Cl\n0.115116 0.884884 0.884884 Cl\n0.884884 0.115116 0.884884 Cl\n0.374015 0.068846 0.173885 Cl\n0.173885 0.374015 0.068846 Cl\n0.068846 0.173885 0.374015 Cl\n0.931154 0.826115 0.374015 Cl\n0.173885 0.625985 0.931154 Cl\n0.931154 0.173885 0.625985 Cl\n0.826115 0.625985 0.068846 Cl\n0.826115 0.374015 0.931154 Cl\n0.068846 0.826115 0.625985 Cl\n0.374015 0.931154 0.826115 Cl\n0.625985 0.068846 0.826115 Cl\n0.625985 0.931154 0.173885 Cl\n0.125985 0.431154 0.326115 Cl\n0.326115 0.125985 0.431154 Cl\n0.431154 0.326115 0.125985 Cl\n0.568846 0.673885 0.125985 Cl\n0.326115 0.874015 0.568846 Cl\n0.568846 0.326115 0.874015 Cl\n0.673885 0.874015 0.431154 Cl\n0.673885 0.125985 0.568846 Cl\n0.431154 0.673885 0.874015 Cl\n0.125985 0.568846 0.673885 Cl\n0.874015 0.431154 0.673885 Cl\n0.874015 0.568846 0.326115 Cl\n0.565952 0.187267 0.328569 Cl\n0.328569 0.565952 0.187267 Cl\n0.187267 0.328569 0.565952 Cl\n0.812733 0.671431 0.565952 Cl\n0.328569 0.434048 0.812733 Cl\n0.812733 0.328569 0.434048 Cl\n0.671431 0.434048 0.187267 Cl\n0.671431 0.565952 0.812733 Cl\n0.187267 0.671431 0.434048 Cl\n0.565952 0.812733 0.671431 Cl\n0.434048 0.187267 0.671431 Cl\n0.434048 0.812733 0.328569 Cl\n0.934048 0.312733 0.171431 Cl\n0.171431 0.934048 0.312733 Cl\n0.312733 0.171431 0.934048 Cl\n0.687267 0.828569 0.934048 Cl\n0.171431 0.065952 0.687267 Cl\n0.687267 0.171431 0.065952 Cl\n0.828569 0.065952 0.312733 Cl\n0.828569 0.934048 0.687267 Cl\n0.312733 0.828569 0.065952 Cl\n0.934048 0.687267 0.828569 Cl\n0.065952 0.312733 0.828569 Cl\n0.065952 0.687267 0.171431 Cl\n",
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"elements": [
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},
{
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"structure_string": "Li5 Co3 Sn2 O10\n1.0\n5.263878 0.144578 0.074285\n-1.127452 5.149827 -0.119392\n-1.680718 -2.705118 7.359100\nLi Co Sn O\n5 3 2 10\ndirect\n0.221862 0.915239 0.401140 Li\n0.417270 0.292596 0.797068 Li\n0.500000 0.500000 0.500000 Li\n0.582730 0.707404 0.202932 Li\n0.778138 0.084761 0.598860 Li\n0.000000 0.500000 0.000000 Co\n0.702897 0.898615 0.899225 Co\n0.297103 0.101385 0.100775 Co\n0.107378 0.707090 0.698626 Sn\n0.892622 0.292910 0.301374 Sn\n0.059236 0.089084 0.851414 O\n0.324077 0.696615 0.950653 O\n0.142489 0.314903 0.546195 O\n0.215433 0.485591 0.222983 O\n0.458642 0.890528 0.661079 O\n0.541358 0.109472 0.338921 O\n0.784567 0.514409 0.777017 O\n0.857511 0.685097 0.453805 O\n0.675923 0.303385 0.049347 O\n0.940764 0.910916 0.148586 O\n",
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},
{
"id": "mp-1214386",
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},
{
"id": "mp-1190672",
"created_at": "2022-09-04T14:43:10.252040Z",
"structure_string": "Hf6 Cr4 Ga12\n1.0\n5.317308 0.000000 0.000000\n0.000000 7.725552 0.000000\n0.000000 0.000000 8.739714\nHf Cr Ga\n6 4 12\ndirect\n0.500000 0.155506 0.779879 Hf\n0.500000 0.155506 0.220121 Hf\n0.000000 0.844494 0.720121 Hf\n0.000000 0.844494 0.279879 Hf\n0.500000 0.714407 0.500000 Hf\n0.000000 0.285593 0.000000 Hf\n0.250000 0.500000 0.250000 Cr\n0.250000 0.500000 0.750000 Cr\n0.750000 0.500000 0.250000 Cr\n0.750000 0.500000 0.750000 Cr\n0.500000 0.766820 0.187538 Ga\n0.500000 0.766820 0.812462 Ga\n0.000000 0.233180 0.312462 Ga\n0.000000 0.233180 0.687538 Ga\n0.500000 0.365805 0.500000 Ga\n0.000000 0.634195 0.000000 Ga\n0.000000 0.562557 0.500000 Ga\n0.500000 0.437443 0.000000 Ga\n0.260435 0.039044 0.500000 Ga\n0.739565 0.039044 0.500000 Ga\n0.239565 0.960956 0.000000 Ga\n0.760435 0.960956 0.000000 Ga\n",
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