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{
"id": "mp-1091364",
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"structure_string": "Li2 Dy2 Sn4\n1.0\n2.166788 -9.500251 0.000000\n2.166788 9.500251 0.000000\n0.000000 0.000000 4.564433\nLi Dy Sn\n2 2 4\ndirect\n0.673440 0.326560 0.750000 Li\n0.326560 0.673440 0.250000 Li\n0.893222 0.106778 0.750000 Dy\n0.106778 0.893222 0.250000 Dy\n0.543430 0.456570 0.750000 Sn\n0.456570 0.543430 0.250000 Sn\n0.252976 0.747024 0.750000 Sn\n0.747024 0.252976 0.250000 Sn\n",
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{
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},
{
"id": "mp-1187055",
"created_at": "2022-09-04T14:43:14.399813Z",
"structure_string": "Sn3 Se1\n1.0\n0.000000 3.733138 3.733138\n3.733138 0.000000 3.733138\n3.733138 3.733138 0.000000\nSn Se\n3 1\ndirect\n0.250000 0.250000 0.250000 Sn\n0.750000 0.750000 0.750000 Sn\n0.500000 0.500000 0.500000 Sn\n0.000000 0.000000 0.000000 Se\n",
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{
"id": "mp-34891",
"created_at": "2022-09-04T14:42:14.649170Z",
"structure_string": "Li2 Mn15 O32\n1.0\n19.300896 -2.911625 0.000000\n19.300896 2.911625 0.000000\n18.861665 0.000000 5.023918\nLi Mn O\n2 15 32\ndirect\n0.156510 0.156510 0.156510 Li\n0.844711 0.844711 0.844711 Li\n0.623189 0.132469 0.623189 Mn\n0.132469 0.623189 0.623189 Mn\n0.871148 0.379886 0.871148 Mn\n0.623189 0.623189 0.132469 Mn\n0.379886 0.871148 0.871148 Mn\n0.124960 0.624294 0.124960 Mn\n0.999522 0.999522 0.999522 Mn\n0.094766 0.094766 0.094766 Mn\n0.871148 0.871148 0.379886 Mn\n0.624294 0.124960 0.124960 Mn\n0.377194 0.870212 0.377194 Mn\n0.124960 0.124960 0.624294 Mn\n0.249698 0.249698 0.249698 Mn\n0.870212 0.377194 0.377194 Mn\n0.377194 0.377194 0.870212 Mn\n0.790077 0.319061 0.319061 O\n0.441930 0.441930 0.441930 O\n0.319061 0.319061 0.790077 O\n0.319061 0.790077 0.319061 O\n0.025741 0.574582 0.574582 O\n0.928850 0.464429 0.928850 O\n0.689927 0.689927 0.689927 O\n0.574582 0.574582 0.025741 O\n0.809861 0.809861 0.809861 O\n0.928850 0.928850 0.464429 O\n0.574582 0.025741 0.574582 O\n0.464429 0.928850 0.928850 O\n0.270996 0.831002 0.831002 O\n0.167983 0.729038 0.167983 O\n0.941185 0.941185 0.941185 O\n0.831002 0.831002 0.270996 O\n0.059279 0.059279 0.059279 O\n0.167983 0.167983 0.729038 O\n0.831002 0.270996 0.831002 O\n0.729038 0.167983 0.167983 O\n0.519095 0.082282 0.082282 O\n0.418832 0.978402 0.418832 O\n0.190740 0.190740 0.190740 O\n0.308391 0.308391 0.308391 O\n0.082282 0.082282 0.519095 O\n0.418832 0.418832 0.978402 O\n0.082281 0.519095 0.082282 O\n0.978402 0.418832 0.418832 O\n0.683955 0.207633 0.683955 O\n0.558886 0.558886 0.558886 O\n0.683955 0.683955 0.207633 O\n0.207633 0.683955 0.683955 O\n",
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],
"chemical_system": "Li-Mn-O",
"density": 3.9698675395851555,
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"volume": 564.6579514798722,
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"formula_full": "Li2 Mn15 O32",
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"formula_anonymous": "A2B15C32",
"energy": -383.73007751,
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"spacegroup": 160
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{
"id": "mp-1205224",
"created_at": "2022-09-04T14:42:14.653260Z",
"structure_string": "Ge8 H80 Se24 N32\n1.0\n-6.469561 6.469561 11.042115\n6.469561 -6.469561 11.042115\n6.469561 6.469561 -11.042115\nGe H Se N\n8 80 24 32\ndirect\n0.539371 0.039371 0.500000 Ge\n0.039371 0.539371 0.500000 Ge\n0.789371 0.789371 0.000000 Ge\n0.289371 0.289371 0.000000 Ge\n0.688653 0.188653 0.500000 Ge\n0.188653 0.688653 0.500000 Ge\n0.938653 0.938653 0.000000 Ge\n0.438653 0.438653 0.000000 Ge\n0.431574 0.428999 0.532473 H\n0.396526 0.928999 0.997424 H\n0.649102 0.681574 0.502576 H\n0.149102 0.646526 0.967527 H\n0.896526 0.899102 0.467527 H\n0.931574 0.399102 0.002576 H\n0.178999 0.146526 0.497424 H\n0.678999 0.181574 0.032473 H\n0.664010 0.659325 0.175948 H\n0.983377 0.159325 0.995316 H\n0.238061 0.914010 0.504684 H\n0.738061 0.233377 0.324052 H\n0.483377 0.488061 0.824052 H\n0.164010 0.988061 0.004684 H\n0.409325 0.733377 0.495316 H\n0.909325 0.414010 0.675948 H\n0.291873 0.249446 0.357189 H\n0.392257 0.749446 0.957573 H\n0.684684 0.541873 0.542427 H\n0.184684 0.642257 0.142811 H\n0.892257 0.934684 0.642811 H\n0.791873 0.434684 0.042427 H\n0.999446 0.142257 0.457573 H\n0.499446 0.041873 0.857189 H\n0.725284 0.732000 0.155912 H\n0.076088 0.232000 0.006716 H\n0.319372 0.975284 0.493284 H\n0.819372 0.326088 0.344088 H\n0.576088 0.569372 0.844088 H\n0.225284 0.069372 0.993284 H\n0.482000 0.826088 0.506716 H\n0.982000 0.475284 0.655912 H\n0.677746 0.840936 0.362358 H\n0.978578 0.340936 0.163190 H\n0.065388 0.927746 0.336810 H\n0.565388 0.228578 0.137642 H\n0.478578 0.315388 0.637642 H\n0.177746 0.815388 0.836810 H\n0.590936 0.728578 0.663190 H\n0.090936 0.427746 0.862358 H\n0.235081 0.363843 0.420535 H\n0.443307 0.863843 0.128761 H\n0.564546 0.485081 0.371239 H\n0.064546 0.693307 0.079465 H\n0.943307 0.814546 0.579465 H\n0.735081 0.314546 0.871239 H\n0.113843 0.193307 0.628761 H\n0.613843 0.985081 0.920535 H\n0.337391 0.475864 0.423678 H\n0.552186 0.975864 0.138473 H\n0.663714 0.587391 0.361527 H\n0.163714 0.802186 0.076322 H\n0.052186 0.913714 0.576322 H\n0.837391 0.413714 0.861527 H\n0.225864 0.302186 0.638473 H\n0.725864 0.087391 0.923678 H\n0.719596 0.914784 0.332096 H\n0.082688 0.414784 0.195188 H\n0.137500 0.969596 0.304812 H\n0.637500 0.332688 0.167904 H\n0.582688 0.387500 0.667904 H\n0.219596 0.887500 0.804812 H\n0.664784 0.832688 0.695188 H\n0.164784 0.469596 0.832096 H\n0.394308 0.359036 0.360693 H\n0.498344 0.859036 0.964728 H\n0.783615 0.644308 0.535272 H\n0.283615 0.748344 0.139307 H\n0.998344 0.033615 0.639307 H\n0.894308 0.533615 0.035272 H\n0.109036 0.248344 0.464728 H\n0.609036 0.144308 0.860693 H\n0.584554 0.743633 0.115828 H\n0.127805 0.243633 0.159079 H\n0.218726 0.834554 0.340921 H\n0.718726 0.377805 0.384172 H\n0.627805 0.468726 0.884172 H\n0.084554 0.968726 0.840921 H\n0.493633 0.877805 0.659079 H\n0.993633 0.334554 0.615828 H\n0.754679 0.120790 0.647224 Se\n0.973567 0.620790 0.366111 Se\n0.857455 0.004679 0.133889 Se\n0.357455 0.223567 0.852776 Se\n0.473567 0.107455 0.352776 Se\n0.254679 0.607455 0.633889 Se\n0.870790 0.723567 0.866111 Se\n0.370790 0.504679 0.147224 Se\n0.749876 0.090354 0.351182 Se\n0.239172 0.590354 0.340478 Se\n0.148694 0.999876 0.159522 Se\n0.648694 0.489172 0.148818 Se\n0.739172 0.398694 0.648818 Se\n0.249876 0.898694 0.659522 Se\n0.840354 0.989172 0.840478 Se\n0.340354 0.499876 0.851182 Se\n0.476027 0.138846 0.646673 Se\n0.992172 0.638846 0.662819 Se\n0.579353 0.726027 0.837181 Se\n0.079353 0.242172 0.853327 Se\n0.492172 0.829353 0.353327 Se\n0.976027 0.329353 0.337181 Se\n0.888846 0.742172 0.162819 Se\n0.388846 0.226027 0.146673 Se\n0.728886 0.841951 0.333940 N\n0.008011 0.341951 0.113064 N\n0.144947 0.978886 0.386936 N\n0.644947 0.258011 0.166060 N\n0.508011 0.394947 0.666060 N\n0.228886 0.894947 0.886936 N\n0.591951 0.758011 0.613064 N\n0.091951 0.478886 0.833940 N\n0.261786 0.319734 0.354903 N\n0.464831 0.819734 0.057947 N\n0.656884 0.511786 0.442053 N\n0.156884 0.714831 0.145097 N\n0.964831 0.906884 0.645097 N\n0.761786 0.406884 0.942053 N\n0.069734 0.214831 0.557947 N\n0.569734 0.011786 0.854903 N\n0.670052 0.736778 0.184000 N\n0.052778 0.236778 0.066726 N\n0.236052 0.920052 0.433274 N\n0.736052 0.302778 0.316000 N\n0.552778 0.486052 0.816000 N\n0.170052 0.986052 0.933274 N\n0.486778 0.802778 0.566726 N\n0.986778 0.420052 0.684000 N\n0.365094 0.402929 0.425609 N\n0.477320 0.902929 0.037835 N\n0.689485 0.615094 0.462165 N\n0.189485 0.727320 0.074391 N\n0.977320 0.939485 0.574391 N\n0.865094 0.439485 0.962165 N\n0.152929 0.227320 0.537835 N\n0.652929 0.115094 0.925609 N\n",
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"formula_full": "Ge8 H80 Se24 N32",
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{
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{
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{
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