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{
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{
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{
"id": "mp-18853",
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"structure_string": "Tl2 V4 Ag2 O12\n1.0\n5.235533 5.515337 0.000000\n-5.235533 5.515337 0.000000\n0.000000 1.550648 5.784852\nTl V Ag O\n2 4 2 12\ndirect\n0.284732 0.715268 0.250000 Tl\n0.715268 0.284732 0.750000 Tl\n0.203774 0.367204 0.782495 V\n0.632796 0.796226 0.717505 V\n0.796226 0.632796 0.217505 V\n0.367204 0.203774 0.282495 V\n0.896089 0.103911 0.250000 Ag\n0.103911 0.896089 0.750000 Ag\n0.351022 0.330488 0.516642 O\n0.669512 0.648978 0.983358 O\n0.648978 0.669512 0.483358 O\n0.330488 0.351022 0.016642 O\n0.427781 0.888625 0.772954 O\n0.111375 0.572219 0.727046 O\n0.572219 0.111375 0.227046 O\n0.888625 0.427781 0.272954 O\n0.955591 0.793258 0.144003 O\n0.206742 0.044409 0.355997 O\n0.044409 0.206742 0.855997 O\n0.793258 0.955591 0.644003 O\n",
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"formula_full": "Tl2 V4 Ag2 O12",
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"spacegroup": 15
},
{
"id": "mp-12953",
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"structure_string": "Tm1 Ag1 Te2\n1.0\n2.170957 -3.760208 0.000000\n2.170957 3.760208 0.000000\n0.000000 0.000000 6.998389\nTm Ag Te\n1 1 2\ndirect\n0.000000 0.000000 0.000000 Tm\n0.000000 0.000000 0.500000 Ag\n0.666667 0.333333 0.747790 Te\n0.333333 0.666667 0.252210 Te\n",
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{
"id": "mp-1198399",
"created_at": "2022-09-04T14:47:00.167535Z",
"structure_string": "K21 Tl7 Cl42 O14\n1.0\n-7.953847 7.953847 9.415824\n7.953847 -7.953847 9.415824\n7.953847 7.953847 -9.415824\nK Tl Cl O\n21 7 42 14\ndirect\n0.500000 0.500000 0.000000 K\n0.212638 0.212638 0.425276 K\n0.787362 0.787362 0.574724 K\n0.212638 0.787362 0.000000 K\n0.787362 0.212638 0.000000 K\n0.860003 0.147523 0.287520 K\n0.860003 0.572483 0.712480 K\n0.147523 0.860003 0.287520 K\n0.572483 0.860003 0.712480 K\n0.139997 0.852477 0.712480 K\n0.139997 0.427517 0.287520 K\n0.852477 0.139997 0.712480 K\n0.427517 0.139997 0.287520 K\n0.625203 0.905195 0.279992 K\n0.625203 0.345211 0.720008 K\n0.905195 0.625203 0.279992 K\n0.345211 0.625203 0.720008 K\n0.374797 0.094805 0.720008 K\n0.374797 0.654789 0.279992 K\n0.094805 0.374797 0.720008 K\n0.654789 0.374797 0.279992 K\n0.000000 0.000000 0.000000 Tl\n0.000000 0.500000 0.500000 Tl\n0.500000 0.000000 0.500000 Tl\n0.000000 0.000000 0.500000 Tl\n0.500000 0.500000 0.500000 Tl\n0.000000 0.500000 0.000000 Tl\n0.500000 0.000000 0.000000 Tl\n0.835734 0.835734 0.000000 Cl\n0.164266 0.164266 0.000000 Cl\n0.160757 0.000000 0.160757 Cl\n0.839243 0.000000 0.839243 Cl\n0.000000 0.839243 0.839243 Cl\n0.000000 0.160757 0.160757 Cl\n0.866274 0.366274 0.500000 Cl\n0.366274 0.866274 0.500000 Cl\n0.133726 0.633726 0.500000 Cl\n0.633726 0.133726 0.500000 Cl\n0.381379 0.120694 0.502073 Cl\n0.618621 0.879306 0.497927 Cl\n0.381379 0.879306 0.260685 Cl\n0.618621 0.120694 0.739315 Cl\n0.120694 0.618621 0.739315 Cl\n0.879306 0.381379 0.260685 Cl\n0.120694 0.381379 0.502073 Cl\n0.879306 0.618621 0.497927 Cl\n0.816445 0.470690 0.000000 Cl\n0.470690 0.816445 0.000000 Cl\n0.816445 0.816445 0.345754 Cl\n0.470690 0.470690 0.654246 Cl\n0.183555 0.529310 0.000000 Cl\n0.529310 0.183555 0.000000 Cl\n0.183555 0.183555 0.654246 Cl\n0.529310 0.529310 0.345754 Cl\n0.007495 0.681761 0.000000 Cl\n0.681761 0.007495 0.000000 Cl\n0.007495 0.007495 0.325734 Cl\n0.681761 0.681761 0.674266 Cl\n0.992505 0.318239 0.000000 Cl\n0.318239 0.992505 0.000000 Cl\n0.992505 0.992505 0.674266 Cl\n0.318239 0.318239 0.325734 Cl\n0.117253 0.617253 0.234505 Cl\n0.382747 0.882747 0.765495 Cl\n0.117253 0.882747 0.500000 Cl\n0.382747 0.617253 0.500000 Cl\n0.617253 0.382747 0.500000 Cl\n0.882747 0.117253 0.500000 Cl\n0.617253 0.117253 0.234505 Cl\n0.882747 0.382747 0.765495 Cl\n0.658059 0.658059 0.000000 O\n0.341941 0.341941 0.000000 O\n0.678908 0.500000 0.178908 O\n0.321092 0.500000 0.821092 O\n0.500000 0.321092 0.821092 O\n0.500000 0.678908 0.178908 O\n0.736594 0.836164 0.099570 O\n0.736594 0.637024 0.900430 O\n0.836164 0.736594 0.099570 O\n0.637024 0.736594 0.900430 O\n0.263406 0.163836 0.900430 O\n0.263406 0.362976 0.099570 O\n0.163836 0.263406 0.900430 O\n0.362976 0.263406 0.099570 O\n",
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"formula_full": "K21 Tl7 Cl42 O14",
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{
"id": "mp-1034059",
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"structure_string": "Mg14 Ti1 Bi1 O16\n1.0\n8.735360 0.000000 0.000000\n0.000000 8.735360 0.000000\n0.000000 0.000000 4.417694\nMg Ti Bi O\n14 1 1 16\ndirect\n0.000000 0.500000 -0.000000 Mg\n0.500000 0.000000 -0.000000 Mg\n0.000000 0.249634 0.500000 Mg\n0.000000 0.750367 0.500000 Mg\n0.500000 0.236438 0.500000 Mg\n0.500000 0.763562 0.500000 Mg\n0.249634 -0.000000 0.500000 Mg\n0.236438 0.500000 0.500000 Mg\n0.750367 0.000000 0.500000 Mg\n0.763562 0.500000 0.500000 Mg\n0.241782 0.241782 0.000000 Mg\n0.241782 0.758218 -0.000000 Mg\n0.758218 0.241782 0.000000 Mg\n0.758218 0.758218 -0.000000 Mg\n0.000000 0.000000 -0.000000 Ti\n0.500000 0.500000 -0.000000 Bi\n0.257372 0.000000 -0.000000 O\n0.231600 0.500000 -0.000000 O\n0.742628 0.000000 -0.000000 O\n0.768400 0.500000 0.000000 O\n0.251027 0.251027 0.500000 O\n0.251027 0.748973 0.500000 O\n0.748973 0.251027 0.500000 O\n0.748973 0.748973 0.500000 O\n0.000000 0.000000 0.500000 O\n0.000000 0.500000 0.500000 O\n0.500000 0.000000 0.500000 O\n0.500000 0.500000 0.500000 O\n0.000000 0.257372 -0.000000 O\n0.000000 0.742628 0.000000 O\n0.500000 0.231600 -0.000000 O\n0.500000 0.768400 0.000000 O\n",
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{
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{
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"structure_string": "Mn12 Ge4 Ir4\n1.0\n6.609486 0.000000 0.000000\n0.000000 6.609486 0.000000\n0.000000 0.000000 6.609486\nMn Ge Ir\n12 4 4\ndirect\n0.120630 0.206179 0.453031 Mn\n0.453031 0.120630 0.206179 Mn\n0.206179 0.453031 0.120630 Mn\n0.293821 0.546969 0.620630 Mn\n0.953031 0.379370 0.793821 Mn\n0.793821 0.953031 0.379370 Mn\n0.046969 0.879370 0.706179 Mn\n0.546969 0.620630 0.293821 Mn\n0.706179 0.046969 0.879370 Mn\n0.620630 0.293821 0.546969 Mn\n0.879370 0.706179 0.046969 Mn\n0.379370 0.793821 0.953031 Mn\n0.938139 0.561861 0.438139 Ge\n0.561861 0.438139 0.938139 Ge\n0.438139 0.938139 0.561861 Ge\n0.061861 0.061861 0.061861 Ge\n0.310346 0.189654 0.810346 Ir\n0.189654 0.810346 0.310346 Ir\n0.810346 0.310346 0.189654 Ir\n0.689654 0.689654 0.689654 Ir\n",
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{
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{
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{
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{
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