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{
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{
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{
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],
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"formula_full": "Ba2 Tl2 Cu1 O6",
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{
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"structure_string": "Li1 In1 Ag2\n1.0\n0.000000 3.329620 3.329620\n3.329620 0.000000 3.329620\n3.329620 3.329620 0.000000\nLi In Ag\n1 1 2\ndirect\n0.500000 0.500000 0.500000 Li\n0.000000 0.000000 0.000000 In\n0.750000 0.750000 0.750000 Ag\n0.250000 0.250000 0.250000 Ag\n",
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"formula_full": "Li1 In1 Ag2",
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"updated_at": "2021-11-28T01:37:21.956000Z",
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},
{
"id": "mp-1043075",
"created_at": "2022-09-04T14:46:10.728463Z",
"structure_string": "Zn2 W8 O12\n1.0\n1.628298 -5.441114 0.000000\n1.628298 5.441114 0.000000\n0.000000 0.000000 16.542186\nZn W O\n2 8 12\ndirect\n0.307872 0.692128 0.750000 Zn\n0.692128 0.307872 0.250000 Zn\n0.138276 0.861724 0.049730 W\n0.613696 0.386304 0.633434 W\n0.861724 0.138276 0.950270 W\n0.386304 0.613696 0.366566 W\n0.138276 0.861724 0.450270 W\n0.861724 0.138276 0.549730 W\n0.386304 0.613696 0.133434 W\n0.613696 0.386304 0.866566 W\n0.500000 0.500000 0.500000 O\n0.500000 0.500000 0.000000 O\n0.992127 0.007873 0.856104 O\n0.007873 0.992127 0.143896 O\n0.007873 0.992127 0.356104 O\n0.992127 0.007873 0.643896 O\n0.268364 0.731636 0.876166 O\n0.731636 0.268364 0.123834 O\n0.731636 0.268364 0.376166 O\n0.268364 0.731636 0.623834 O\n0.693172 0.306828 0.750000 O\n0.306828 0.693172 0.250000 O\n",
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"elements": [
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"formula_full": "Zn2 W8 O12",
"formula_reduced": "Zn(W2O3)2",
"formula_anonymous": "AB4C6",
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},
{
"id": "mp-5125",
"created_at": "2022-09-04T14:46:10.734756Z",
"structure_string": "Na12 Fe4 Se12\n1.0\n7.232129 0.000000 0.000000\n0.000000 7.481285 0.000000\n0.000000 7.168212 13.022571\nNa Fe Se\n12 4 12\ndirect\n0.017165 0.124552 0.592995 Na\n0.517165 0.875448 0.907005 Na\n0.482835 0.124552 0.092995 Na\n0.982835 0.875448 0.407005 Na\n0.000112 0.495955 0.276423 Na\n0.500112 0.504045 0.223577 Na\n0.999888 0.504045 0.723577 Na\n0.516700 0.048689 0.613775 Na\n0.983300 0.048689 0.113775 Na\n0.483300 0.951311 0.386225 Na\n0.016700 0.951311 0.886225 Na\n0.499888 0.495955 0.776423 Na\n0.620145 0.500400 0.425885 Fe\n0.379855 0.499600 0.574115 Fe\n0.120145 0.499600 0.074115 Fe\n0.879855 0.500400 0.925885 Fe\n0.216468 0.200762 0.225468 Se\n0.288656 0.487733 0.423606 Se\n0.211344 0.487733 0.923606 Se\n0.711344 0.512267 0.576394 Se\n0.788656 0.512267 0.076394 Se\n0.716468 0.799238 0.274532 Se\n0.783532 0.799238 0.774532 Se\n0.283532 0.200762 0.725468 Se\n0.742322 0.204274 0.426975 Se\n0.242322 0.795726 0.073025 Se\n0.257678 0.795726 0.573025 Se\n0.757678 0.204274 0.926975 Se\n",
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],
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"volume": 704.5942545834672,
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"formula_full": "Na12 Fe4 Se12",
"formula_reduced": "Na3FeSe3",
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}
]
}