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{
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"structure_string": "Co8 Br8 O8\n1.0\n5.881289 0.000000 0.000000\n0.000000 6.362369 0.000000\n0.000000 0.000000 12.676452\nCo Br O\n8 8 8\ndirect\n0.207559 0.134036 0.504995 Co\n0.707559 0.865964 0.995005 Co\n0.792441 0.365964 0.004995 Co\n0.292441 0.634036 0.495005 Co\n0.792441 0.865964 0.495005 Co\n0.292441 0.134036 0.004995 Co\n0.207559 0.634036 0.995005 Co\n0.707559 0.365964 0.504995 Co\n0.930965 0.092223 0.142087 Br\n0.430965 0.907777 0.357913 Br\n0.069035 0.407777 0.642087 Br\n0.569035 0.592223 0.857913 Br\n0.069035 0.907777 0.857913 Br\n0.569035 0.092223 0.642087 Br\n0.930965 0.592223 0.357913 Br\n0.430965 0.407777 0.142087 Br\n0.888688 0.144419 0.451587 O\n0.388688 0.855581 0.048413 O\n0.111312 0.355581 0.951587 O\n0.611312 0.644419 0.548413 O\n0.111312 0.855581 0.548413 O\n0.611312 0.144419 0.951587 O\n0.888688 0.644419 0.048413 O\n0.388688 0.355581 0.451587 O\n",
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{
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"structure_string": "Bi4 I12 O36\n1.0\n6.114178 0.000000 0.000000\n0.000000 8.975158 0.000000\n0.000000 7.187320 15.427325\nBi I O\n4 12 36\ndirect\n0.717856 0.347742 0.605355 Bi\n0.217856 0.652258 0.894645 Bi\n0.282144 0.652258 0.394645 Bi\n0.782144 0.347742 0.105355 Bi\n0.903482 0.915003 0.698646 I\n0.403482 0.084997 0.801354 I\n0.096518 0.084997 0.301354 I\n0.596518 0.915003 0.198646 I\n0.362916 0.143398 0.520745 I\n0.862916 0.856602 0.979255 I\n0.637084 0.856602 0.479255 I\n0.137084 0.143398 0.020745 I\n0.815932 0.432389 0.354107 I\n0.315932 0.567611 0.145893 I\n0.184068 0.567611 0.645893 I\n0.684068 0.432389 0.854107 I\n0.178282 0.845143 0.745060 O\n0.678282 0.154857 0.754940 O\n0.821718 0.154857 0.254940 O\n0.321718 0.845143 0.245060 O\n0.913442 0.834618 0.616280 O\n0.413442 0.165382 0.883720 O\n0.086558 0.165382 0.383720 O\n0.586558 0.834618 0.116280 O\n0.993214 0.130012 0.633919 O\n0.493214 0.869988 0.866081 O\n0.006786 0.869988 0.366081 O\n0.506786 0.130012 0.133919 O\n0.528594 0.096533 0.619790 O\n0.028594 0.903467 0.880210 O\n0.471406 0.903467 0.380210 O\n0.971406 0.096533 0.119790 O\n0.600504 0.395895 0.963709 O\n0.100504 0.604105 0.536291 O\n0.399496 0.604105 0.036291 O\n0.899496 0.395895 0.463709 O\n0.446006 0.562910 0.801421 O\n0.946006 0.437090 0.698579 O\n0.553994 0.437090 0.198579 O\n0.053994 0.562910 0.301421 O\n0.886699 0.601539 0.828681 O\n0.386699 0.398461 0.671319 O\n0.113301 0.398461 0.171319 O\n0.613301 0.601539 0.328681 O\n0.103003 0.366351 0.990302 O\n0.603003 0.633649 0.509698 O\n0.896997 0.633649 0.009698 O\n0.396997 0.366351 0.490302 O\n0.917767 0.142380 0.944975 O\n0.417767 0.857620 0.555025 O\n0.082233 0.857620 0.055025 O\n0.582233 0.142380 0.444975 O\n",
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"formula_full": "Bi4 I12 O36",
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{
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"structure_string": "K4 P8 H12 O24\n1.0\n-7.266215 0.000000 0.327619\n-0.023562 0.000000 -7.889077\n0.000000 -11.153862 0.000000\nK P H O\n4 8 12 24\ndirect\n0.570134 0.003829 0.748517 K\n0.070134 0.503829 0.751483 K\n0.429866 0.996171 0.251483 K\n0.929866 0.496171 0.248517 K\n0.067302 0.043694 0.583445 P\n0.567302 0.543694 0.916555 P\n0.932698 0.956306 0.416555 P\n0.432698 0.456306 0.083445 P\n0.123847 0.936350 0.968668 P\n0.623847 0.436350 0.531332 P\n0.876153 0.063650 0.031332 P\n0.376153 0.563650 0.468668 P\n0.008884 0.900642 0.766536 H\n0.508884 0.400642 0.733464 H\n0.991116 0.099358 0.233464 H\n0.491116 0.599358 0.266536 H\n0.272701 0.836373 0.575786 H\n0.772701 0.336373 0.924214 H\n0.727299 0.163627 0.424214 H\n0.227299 0.663627 0.075786 H\n0.320657 0.159563 0.989029 H\n0.820657 0.659563 0.510971 H\n0.679343 0.840437 0.010971 H\n0.179343 0.340437 0.489029 H\n0.081904 0.235081 0.589248 O\n0.581904 0.735081 0.910752 O\n0.918096 0.764919 0.410752 O\n0.418096 0.264919 0.089248 O\n0.944534 0.956074 0.681501 O\n0.444534 0.456074 0.818499 O\n0.055466 0.043926 0.318499 O\n0.555466 0.543926 0.181501 O\n0.265854 0.970290 0.582591 O\n0.765854 0.470290 0.917409 O\n0.734146 0.029710 0.417409 O\n0.234146 0.529710 0.082591 O\n0.200209 0.841086 0.074676 O\n0.700209 0.341086 0.425324 O\n0.799791 0.158914 0.925324 O\n0.299791 0.658914 0.574676 O\n0.072081 0.827206 0.858568 O\n0.572081 0.327206 0.641432 O\n0.927919 0.172794 0.141432 O\n0.427919 0.672794 0.358568 O\n0.261050 0.084277 0.922580 O\n0.761050 0.584277 0.577420 O\n0.738950 0.915723 0.077420 O\n0.238950 0.415723 0.422580 O\n",
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{
"id": "mp-1022462",
"created_at": "2022-09-04T14:40:09.183220Z",
"structure_string": "Mg12 Zr2 Sb2\n1.0\n5.048577 0.000000 0.000000\n0.000000 6.538373 0.000000\n0.000000 0.000000 10.959647\nMg Zr Sb\n12 2 2\ndirect\n0.000000 0.242745 0.080832 Mg\n0.000000 0.757255 0.080832 Mg\n0.000000 0.500000 0.835244 Mg\n0.500000 0.254253 0.917517 Mg\n0.500000 0.745747 0.917517 Mg\n0.500000 0.500000 0.666952 Mg\n0.000000 0.742745 0.580832 Mg\n0.000000 0.257255 0.580832 Mg\n0.000000 0.000000 0.335244 Mg\n0.500000 0.754253 0.417517 Mg\n0.500000 0.245747 0.417517 Mg\n0.500000 0.000000 0.166952 Mg\n0.000000 0.500000 0.332236 Zr\n0.000000 0.000000 0.832236 Zr\n0.500000 0.500000 0.168870 Sb\n0.500000 0.000000 0.668870 Sb\n",
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"formula_full": "Mg12 Zr2 Sb2",
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{
"id": "mp-728687",
"created_at": "2022-09-04T14:40:09.231389Z",
"structure_string": "Yb2 Re6 O32\n1.0\n7.273316 0.000000 0.000000\n2.145541 8.801717 0.000000\n1.366762 3.346799 11.388886\nYb Re O\n2 6 32\ndirect\n0.141783 0.221786 0.215630 Yb\n0.858217 0.778214 0.784370 Yb\n0.171309 0.330043 0.865375 Re\n0.828691 0.669957 0.134625 Re\n0.787738 0.322291 0.485724 Re\n0.212262 0.677709 0.514276 Re\n0.683912 0.209439 0.097240 Re\n0.316088 0.790561 0.902760 Re\n0.149149 0.265768 0.019648 O\n0.850851 0.734232 0.980352 O\n0.086341 0.209088 0.805217 O\n0.913659 0.790912 0.194783 O\n0.407830 0.321422 0.821121 O\n0.592170 0.678578 0.178879 O\n0.044116 0.531247 0.808725 O\n0.955884 0.468753 0.191275 O\n0.765157 0.252840 0.658329 O\n0.234843 0.747160 0.341671 O\n0.812381 0.515429 0.446251 O\n0.187619 0.484571 0.553749 O\n0.576175 0.318987 0.435678 O\n0.423825 0.681013 0.564322 O\n0.973250 0.207608 0.422832 O\n0.026750 0.792392 0.577168 O\n0.863769 0.146256 0.200856 O\n0.136231 0.853744 0.799144 O\n0.457375 0.225435 0.171972 O\n0.542625 0.774565 0.828028 O\n0.708608 0.390745 0.000878 O\n0.291392 0.609255 0.999122 O\n0.706651 0.073234 0.018416 O\n0.293349 0.926766 0.981584 O\n0.441957 0.996413 0.384469 O\n0.558043 0.003587 0.615531 O\n0.213175 0.417261 0.292231 O\n0.786825 0.582739 0.707769 O\n0.777975 0.097657 0.703580 O\n0.222025 0.902343 0.296420 O\n0.387593 0.060616 0.611682 O\n0.612407 0.939384 0.388318 O\n",
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{
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{
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"structure_string": "Sm2 Co2 Si4\n1.0\n2.055308 -8.130848 0.000000\n2.055308 8.130848 0.000000\n0.000000 0.000000 4.044318\nSm Co Si\n2 2 4\ndirect\n0.106745 0.893255 0.250000 Sm\n0.893255 0.106745 0.750000 Sm\n0.681190 0.318810 0.750000 Co\n0.318810 0.681190 0.250000 Co\n0.750216 0.249784 0.250000 Si\n0.249784 0.750216 0.750000 Si\n0.543133 0.456867 0.750000 Si\n0.456867 0.543133 0.250000 Si\n",
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{
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"structure_string": "Ba8 Sr4 Mn4 O24\n1.0\n8.599206 -0.000000 0.000000\n-0.000000 8.599206 0.000000\n0.000000 0.000000 8.599206\nBa Sr Mn O\n8 4 4 24\ndirect\n0.500000 0.500000 0.500000 Ba\n-0.000000 -0.000000 0.000000 Ba\n-0.000000 -0.000000 0.500000 Ba\n-0.000000 0.500000 -0.000000 Ba\n0.500000 -0.000000 -0.000000 Ba\n0.500000 0.500000 0.000000 Ba\n0.500000 -0.000000 0.500000 Ba\n-0.000000 0.500000 0.500000 Ba\n0.250000 0.250000 0.250000 Sr\n0.250000 0.750000 0.750000 Sr\n0.750000 0.250000 0.750000 Sr\n0.750000 0.750000 0.250000 Sr\n0.750000 0.750000 0.750000 Mn\n0.750000 0.250000 0.250000 Mn\n0.250000 0.750000 0.250000 Mn\n0.250000 0.250000 0.750000 Mn\n0.231574 0.270190 0.529221 O\n0.231574 0.729810 0.470779 O\n0.768426 0.270190 0.470779 O\n0.768426 0.729810 0.529221 O\n0.270190 0.529221 0.231574 O\n0.729810 0.470779 0.231574 O\n0.270190 0.470779 0.768426 O\n0.729810 0.529221 0.768426 O\n0.529221 0.231574 0.270190 O\n0.470779 0.231574 0.729810 O\n0.470779 0.768426 0.270190 O\n0.529221 0.768426 0.729810 O\n0.268426 0.229810 0.970779 O\n0.268426 0.770190 0.029221 O\n0.731574 0.229810 0.029221 O\n0.731574 0.770190 0.970779 O\n0.229810 0.970779 0.268426 O\n0.770190 0.029221 0.268426 O\n0.229810 0.029221 0.731574 O\n0.770190 0.970779 0.731574 O\n0.970779 0.268426 0.229810 O\n0.029221 0.268426 0.770190 O\n0.029221 0.731574 0.229810 O\n0.970779 0.731574 0.770190 O\n",
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"volume": 635.8798435447484,
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"formula_full": "Ba8 Sr4 Mn4 O24",
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{
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"structure_string": "Ca1 Si2 Pd2\n1.0\n-2.126544 2.126544 4.918498\n2.126544 -2.126544 4.918498\n2.126544 2.126544 -4.918498\nCa Si Pd\n1 2 2\ndirect\n0.000000 0.000000 0.000000 Ca\n0.378431 0.378431 0.000000 Si\n0.621569 0.621569 0.000000 Si\n0.250000 0.750000 0.500000 Pd\n0.750000 0.250000 0.500000 Pd\n",
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