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{
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"structure_string": "Si2 H14 N4 F10\n1.0\n6.312371 0.086512 0.000000\n0.086062 6.310963 0.000000\n0.000000 0.000000 7.259414\nSi H N F\n2 14 4 10\ndirect\n0.747867 0.751356 0.271898 Si\n0.247867 0.251356 0.728102 Si\n0.876149 0.219402 0.915085 H\n0.614048 0.273627 0.920234 H\n0.224632 0.617150 0.918628 H\n0.270831 0.877592 0.917227 H\n0.114048 0.773627 0.079766 H\n0.376149 0.719402 0.084915 H\n0.770831 0.377592 0.082773 H\n0.724632 0.117150 0.081372 H\n0.610098 0.639250 0.574567 H\n0.868378 0.666277 0.589106 H\n0.706314 0.879051 0.592872 H\n0.110098 0.139250 0.425433 H\n0.206314 0.379051 0.407128 H\n0.368378 0.166277 0.410894 H\n0.747181 0.248045 0.000048 N\n0.247181 0.748045 0.999952 N\n0.732157 0.732947 0.533710 N\n0.232157 0.232947 0.466290 N\n0.762230 0.768714 0.037647 F\n0.262230 0.268714 0.962353 F\n0.945410 0.932409 0.292511 F\n0.549569 0.571135 0.253963 F\n0.934269 0.547911 0.270708 F\n0.560868 0.955135 0.276059 F\n0.049569 0.071135 0.746037 F\n0.445410 0.432409 0.707489 F\n0.060868 0.455135 0.723941 F\n0.434269 0.047911 0.729292 F\n",
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{
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"structure_string": "Ba2 Mg2 F8\n1.0\n2.082583 -7.433187 0.000000\n2.082583 7.433187 0.000000\n0.000000 0.000000 5.934655\nBa Mg F\n2 2 8\ndirect\n0.650355 0.349645 0.147771 Ba\n0.349645 0.650355 0.647771 Ba\n0.916154 0.083846 0.189949 Mg\n0.083846 0.916154 0.689949 Mg\n0.421630 0.578370 0.203878 F\n0.578370 0.421630 0.703878 F\n0.804257 0.195743 0.379477 F\n0.195743 0.804257 0.879477 F\n0.027268 0.972732 0.006203 F\n0.972732 0.027268 0.506203 F\n0.162253 0.837747 0.422202 F\n0.837747 0.162253 0.922202 F\n",
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"formula_full": "Ba2 Mg2 F8",
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},
{
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"structure_string": "Na2 Zr1 N2\n1.0\n1.678643 -2.907495 0.000000\n1.678643 2.907495 0.000000\n0.000000 0.000000 8.885520\nNa Zr N\n2 1 2\ndirect\n0.666667 0.333333 0.293268 Na\n0.333333 0.666667 0.706732 Na\n0.000000 0.000000 0.000000 Zr\n0.666667 0.333333 0.868626 N\n0.333333 0.666667 0.131374 N\n",
"nsites": 5,
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},
{
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"structure_string": "Be1 Pd2\n1.0\n-1.386777 1.386777 4.964592\n1.386777 -1.386777 4.964592\n1.386777 1.386777 -4.964592\nBe Pd\n1 2\ndirect\n0.000000 0.000000 0.000000 Be\n0.356659 0.356659 0.000000 Pd\n0.643341 0.643341 0.000000 Pd\n",
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},
{
"id": "mp-1208478",
"created_at": "2022-09-04T14:39:06.322223Z",
"structure_string": "Tb16 Mg4 Rh4\n1.0\n0.000000 6.883996 6.883996\n6.883996 0.000000 6.883996\n6.883996 6.883996 0.000000\nTb Mg Rh\n16 4 4\ndirect\n0.348062 0.348062 0.348062 Tb\n0.348062 0.348062 0.955814 Tb\n0.348062 0.955814 0.348062 Tb\n0.955814 0.348062 0.348062 Tb\n0.813059 0.186941 0.186941 Tb\n0.186941 0.813059 0.813059 Tb\n0.186941 0.813059 0.186941 Tb\n0.813059 0.186941 0.813059 Tb\n0.186941 0.186941 0.813059 Tb\n0.813059 0.813059 0.186941 Tb\n0.935346 0.564654 0.564654 Tb\n0.564654 0.935346 0.935346 Tb\n0.564654 0.935346 0.564654 Tb\n0.935346 0.564654 0.935346 Tb\n0.564654 0.564654 0.935346 Tb\n0.935346 0.935346 0.564654 Tb\n0.579578 0.579578 0.579578 Mg\n0.579578 0.579578 0.261267 Mg\n0.579578 0.261267 0.579578 Mg\n0.261267 0.579578 0.579578 Mg\n0.142398 0.142398 0.142398 Rh\n0.142398 0.142398 0.572805 Rh\n0.142398 0.572805 0.142398 Rh\n0.572805 0.142398 0.142398 Rh\n",
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],
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"density": 7.766612802679243,
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"volume": 652.4568928617168,
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"formula_full": "Tb16 Mg4 Rh4",
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},
{
"id": "mp-1195564",
"created_at": "2022-09-04T14:39:05.633488Z",
"structure_string": "Sm4 Tl8 P8 S28\n1.0\n3.395668 11.545349 0.000000\n-3.395668 11.545349 0.000000\n0.000000 9.829134 16.234768\nSm Tl P S\n4 8 8 28\ndirect\n0.883268 0.807112 0.235176 Sm\n0.192888 0.116732 0.264824 Sm\n0.116732 0.192888 0.764824 Sm\n0.807112 0.883268 0.735176 Sm\n0.818874 0.816432 0.026067 Tl\n0.183568 0.181126 0.473933 Tl\n0.181126 0.183568 0.973933 Tl\n0.816432 0.818874 0.526067 Tl\n0.535648 0.486473 0.119300 Tl\n0.513527 0.464352 0.380700 Tl\n0.464352 0.513527 0.880700 Tl\n0.486473 0.535648 0.619300 Tl\n0.330980 0.335268 0.137457 P\n0.664732 0.669020 0.362543 P\n0.669020 0.664732 0.862543 P\n0.335268 0.330980 0.637457 P\n0.973735 0.929575 0.310732 P\n0.070425 0.026265 0.189268 P\n0.026265 0.070425 0.689268 P\n0.929575 0.973735 0.810732 P\n0.000914 0.962364 0.393468 S\n0.037636 0.999086 0.106532 S\n0.999086 0.037636 0.606532 S\n0.962364 0.000914 0.893468 S\n0.163346 0.633557 0.084460 S\n0.366443 0.836654 0.415540 S\n0.836654 0.366443 0.915540 S\n0.633557 0.163346 0.584460 S\n0.169445 0.631459 0.312729 S\n0.368541 0.830555 0.187271 S\n0.830555 0.368541 0.687271 S\n0.631459 0.169445 0.812729 S\n0.220901 0.338390 0.262656 S\n0.661610 0.779099 0.237344 S\n0.779099 0.661610 0.737344 S\n0.338390 0.220901 0.762656 S\n0.747803 0.720810 0.401500 S\n0.279190 0.252197 0.098500 S\n0.252197 0.279190 0.598500 S\n0.720810 0.747803 0.901500 S\n0.855356 0.360757 0.395147 S\n0.639243 0.144644 0.104853 S\n0.144644 0.639243 0.604853 S\n0.360757 0.855356 0.895147 S\n0.882611 0.319707 0.189156 S\n0.680293 0.117389 0.310844 S\n0.117389 0.680293 0.810844 S\n0.319707 0.882611 0.689156 S\n",
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"formula_full": "Sm4 Tl8 P8 S28",
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},
{
"id": "mp-1192299",
"created_at": "2022-09-04T14:39:06.312692Z",
"structure_string": "Sb8 Br2 O12\n1.0\n2.069363 9.582824 0.000000\n-2.069363 9.582824 0.000000\n0.000000 3.594375 10.253383\nSb Br O\n8 2 12\ndirect\n0.266948 0.266948 0.823826 Sb\n0.733052 0.733052 0.176174 Sb\n0.497057 0.497057 0.716613 Sb\n0.502943 0.502943 0.283387 Sb\n0.079272 0.079272 0.023679 Sb\n0.920728 0.920728 0.976321 Sb\n0.309978 0.309978 0.345754 Sb\n0.690022 0.690022 0.654246 Sb\n0.108550 0.108550 0.484315 Br\n0.891450 0.891450 0.515685 Br\n0.265634 0.265634 0.198669 O\n0.734366 0.734366 0.801331 O\n0.032186 0.032186 0.219674 O\n0.967814 0.967814 0.780326 O\n0.430021 0.430021 0.914868 O\n0.569979 0.569979 0.085132 O\n0.203360 0.203360 0.702960 O\n0.796640 0.796640 0.297040 O\n0.186257 0.186257 0.000072 O\n0.813743 0.813743 0.999928 O\n0.414800 0.414800 0.223269 O\n0.585200 0.585200 0.776731 O\n",
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{
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"structure_string": "Ag4 B4 H4 C48 N36 F72\n1.0\n8.558653 0.000000 0.000000\n0.000000 13.752196 0.000000\n0.000000 0.000000 18.983718\nAg B H C N F\n4 4 4 48 36 72\ndirect\n0.451131 0.137100 0.284748 Ag\n0.048869 0.862900 0.784748 Ag\n0.548869 0.637100 0.215252 Ag\n0.951131 0.362900 0.715252 Ag\n0.698216 0.462921 0.100167 B\n0.801784 0.537079 0.600167 B\n0.301784 0.962921 0.399833 B\n0.198216 0.037079 0.899833 B\n0.748515 0.405321 0.059050 H\n0.751485 0.594679 0.559050 H\n0.251485 0.905321 0.440950 H\n0.248515 0.094679 0.940950 H\n0.593738 0.232821 0.108273 C\n0.906262 0.767179 0.608273 C\n0.406262 0.732821 0.391727 C\n0.093738 0.267179 0.891727 C\n0.198488 0.277692 0.548840 C\n0.301512 0.722308 0.048840 C\n0.801512 0.777692 0.951160 C\n0.698488 0.222308 0.451160 C\n0.392490 0.396187 0.321363 C\n0.107510 0.603813 0.821363 C\n0.607510 0.896187 0.178637 C\n0.892490 0.103813 0.678637 C\n0.481184 0.378391 0.254032 C\n0.018816 0.621609 0.754032 C\n0.518816 0.878391 0.245968 C\n0.981184 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