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{
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{
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"formula_full": "Ba12 Li3 Ir9 O36",
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{
"id": "mp-542495",
"created_at": "2022-09-04T14:46:17.943313Z",
"structure_string": "Ta13 Se26\n1.0\n9.180104 0.000000 0.000000\n1.126695 9.740325 0.000000\n3.090229 3.166869 10.616350\nTa Se\n13 26\ndirect\n0.000000 0.000000 0.000000 Ta\n0.214592 0.716673 0.069198 Ta\n0.785408 0.283327 0.930802 Ta\n0.717220 0.069910 0.214218 Ta\n0.282780 0.930090 0.785782 Ta\n0.931179 0.785976 0.282965 Ta\n0.068821 0.214024 0.717035 Ta\n0.151572 0.487468 0.360325 Ta\n0.848428 0.512532 0.639675 Ta\n0.488085 0.360568 0.151699 Ta\n0.511915 0.639432 0.848301 Ta\n0.640939 0.848681 0.512821 Ta\n0.359061 0.151319 0.487179 Ta\n0.930358 0.725241 0.082046 Se\n0.069642 0.274759 0.917954 Se\n0.705475 0.022827 0.009276 Se\n0.294525 0.977173 0.990724 Se\n0.002726 0.949394 0.784571 Se\n0.997274 0.050606 0.215429 Se\n0.633892 0.800953 0.310726 Se\n0.366108 0.199047 0.689274 Se\n0.781034 0.252570 0.710108 Se\n0.218966 0.747430 0.289892 Se\n0.232719 0.651711 0.858189 Se\n0.767281 0.348289 0.141811 Se\n0.868022 0.507849 0.399276 Se\n0.131978 0.492151 0.600724 Se\n0.490662 0.348467 0.935695 Se\n0.509338 0.651533 0.064305 Se\n0.332234 0.884343 0.558070 Se\n0.667766 0.115657 0.441930 Se\n0.185447 0.427269 0.160022 Se\n0.814553 0.572731 0.839978 Se\n0.410881 0.108800 0.252816 Se\n0.589119 0.891200 0.747184 Se\n0.090423 0.201359 0.478741 Se\n0.909577 0.798641 0.521259 Se\n0.562459 0.579583 0.630443 Se\n0.437541 0.420417 0.369557 Se\n",
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{
"id": "mp-1071627",
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"structure_string": "La1 Si1 Ni4\n1.0\n2.617829 -4.165704 0.000000\n2.617830 4.165704 0.000000\n0.000000 0.000000 3.969350\nLa Si Ni\n1 1 4\ndirect\n0.000000 0.000000 0.000000 La\n0.500000 0.500000 0.500000 Si\n0.343492 0.656508 0.000000 Ni\n0.656508 0.343492 0.000000 Ni\n0.500000 0.000000 0.500000 Ni\n0.000000 0.500000 0.500000 Ni\n",
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{
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"structure_string": "Nd2 Co1 Sn4\n1.0\n0.000000 0.000000 4.565882\n4.559413 0.000000 0.000000\n2.279706 8.511017 0.000000\nNd Co Sn\n2 1 4\ndirect\n0.250000 0.906773 0.186455 Nd\n0.750000 0.112429 0.775142 Nd\n0.250000 0.704735 0.590529 Co\n0.250000 0.267654 0.464691 Sn\n0.750000 0.766181 0.467639 Sn\n0.250000 0.559062 0.881877 Sn\n0.750000 0.443166 0.113668 Sn\n",
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{
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"structure_string": "Ba2 Ta1 Bi1 O6\n1.0\n0.000000 4.343478 4.343478\n4.343478 0.000000 4.343478\n4.343478 4.343478 0.000000\nBa Ta Bi O\n2 1 1 6\ndirect\n0.250000 0.250000 0.250000 Ba\n0.750000 0.750000 0.750000 Ba\n0.500000 0.500000 0.500000 Ta\n0.000000 0.000000 0.000000 Bi\n0.269221 0.730779 0.730779 O\n0.730779 0.730779 0.269221 O\n0.730779 0.269221 0.730779 O\n0.730779 0.269221 0.269221 O\n0.269221 0.269221 0.730779 O\n0.269221 0.730779 0.269221 O\n",
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{
"id": "mp-531170",
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{
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{
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"structure_string": "Er8 Os2 Br8\n1.0\n6.201748 6.271148 0.000000\n-6.201748 6.271148 0.000000\n0.000000 0.082153 6.531093\nEr Os Br\n8 2 8\ndirect\n0.249643 0.901032 0.010078 Er\n0.750357 0.098968 0.989922 Er\n0.098968 0.750357 0.489922 Er\n0.901032 0.249643 0.510078 Er\n0.751104 0.902146 0.509245 Er\n0.248896 0.097854 0.490755 Er\n0.097854 0.248896 0.990755 Er\n0.902146 0.751104 0.009245 Er\n0.994669 0.005331 0.250000 Os\n0.005331 0.994669 0.750000 Os\n0.422266 0.815511 0.402989 Br\n0.577734 0.184489 0.597011 Br\n0.184489 0.577734 0.097011 Br\n0.815511 0.422266 0.902989 Br\n0.418023 0.193870 0.098736 Br\n0.581977 0.806130 0.901264 Br\n0.806130 0.581977 0.401264 Br\n0.193870 0.418023 0.598736 Br\n",
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{
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}